data_r5kgmsf
# 
_audit.revision_id     1_0 
_audit.creation_date   2017-04-05 
_audit.update_record   "Initial release" 
# 
_cell.entry_id      5kgm 
_cell.length_a      67.8500 
_cell.length_b      94.3750 
_cell.length_c      102.2010 
_cell.angle_alpha   90.0000 
_cell.angle_beta    96.5660 
_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   1.00000 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   2.950 
_diffrn_reflns.pdbx_d_res_low    101.531 
_diffrn_reflns.limit_h_max       22 
_diffrn_reflns.limit_h_min       -22 
_diffrn_reflns.limit_k_max       31 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       34 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            27116 
_diffrn_reflns.pdbx_number_obs   27005 
# 
_entry.id   5kgm 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5kgm 
_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 -22 0  1  o 98.77422 67.59392 -3.018308      8.211276      -3.018308      8.211276      -3.018308      8.211276  98.77422 67.59392 98.77422 67.59392 0.000000       0.000000 
1 1 1 -22 0  2  o 223.7343 96.81113 16.50124       8.671300      16.50124       8.671300      16.50124       8.671300  223.7343 96.81113 223.7343 96.81113 0.000000       0.000000 
1 1 1 -22 0  3  o 298.0123 88.88097 24.03380       8.955583      24.03380       8.955583      24.03380       8.955583  298.0123 88.88097 298.0123 88.88097 -0.000000      0.000000 
1 1 1 -22 0  4  o 107.9024 72.80194 -1.466264      8.854417      -1.466264      8.854417      -1.466264      8.854417  107.9024 72.80194 107.9024 72.80194 -0.000000      0.000000 
1 1 1 -22 0  5  o 109.4766 76.31570 -6.493341      11.72728      -6.493341      11.72728      -6.493341      11.72728  109.4766 76.31570 109.4766 76.31570 0.000000       0.000000 
1 1 1 -22 0  6  o 135.9865 88.44624 3.414584       11.24279      3.414584       11.24279      3.414584       11.24279  135.9865 88.44624 135.9865 88.44624 0.000000       0.000000 
1 1 1 -22 0  7  o 102.7246 71.64227 -6.198332      10.36762      -6.198332      10.36762      -6.198332      10.36762  102.7246 71.64227 102.7246 71.64227 -0.000000      0.000000 
1 1 1 -22 0  8  o 163.1353 96.07764 9.762592       10.36374      9.762592       10.36374      9.762592       10.36374  163.1353 96.07764 163.1353 96.07764 0.000000       0.000000 
1 1 1 -22 0  9  o 315.9191 102.6630 29.34231       11.14331      29.34231       11.14331      29.34231       11.14331  315.9191 102.6630 315.9191 102.6630 -0.000000      0.000000 
1 1 1 -22 0  10 o 103.0255 69.87749 -1.744706      8.370853      -1.744706      8.370853      -1.744706      8.370853  103.0255 69.87749 103.0255 69.87749 -0.000000      0.000000 
1 1 1 -22 0  11 o 118.4175 77.78234 1.679811       9.014337      1.679811       9.014337      1.679811       9.014337  118.4175 77.78234 118.4175 77.78234 -0.000000      0.000000 
1 1 1 -22 0  12 o 236.4470 99.60921 18.95416       9.220407      18.95416       9.220407      18.95416       9.220407  236.4470 99.60921 236.4470 99.60921 -0.000000      0.000000 
1 1 1 -22 0  13 o 253.2470 94.80945 20.10940       8.699047      20.10940       8.699047      20.10940       8.699047  253.2470 94.80945 253.2470 94.80945 0.000000       0.000000 
1 1 1 -22 1  1  o 103.7835 49.97605 -3.728249      5.960880      -0.3259323     8.466739      -7.072081      8.393653  128.2811 61.17751 111.6490 54.95380 16.63213       82.23508 
1 1 1 -22 1  2  o 299.9466 62.28042 26.09848       7.017450      30.69647       8.842150      18.27422       11.53441  299.0287 75.98483 187.1079 82.23713 111.9208       111.9671 
1 1 1 -22 1  3  o 118.2789 55.23983 0.5503362      6.269930      -9.639276      8.749924      11.30426       8.988948  106.4543 53.03803 165.1877 72.60052 -58.73336      89.91033 
1 1 1 -22 1  4  o 139.6470 62.42559 5.666546       6.931313      6.610657       8.586571      3.900687       11.74319  143.9361 66.32412 139.1212 67.73365 4.814880       94.79840 
1 1 1 -22 1  5  o 123.5407 57.70331 2.400472       6.844471      3.943982       8.542782      -0.3665397     11.43800  132.1349 62.56432 127.6978 63.09805 4.437119       88.85751 
1 1 1 -22 1  6  o 98.44930 48.50181 -5.117163      6.589062      -7.029638      8.158560      -1.529922      11.17367  103.0594 51.32500 122.1235 60.69539 -19.06413      79.48701 
1 1 1 -22 1  7  o 122.6940 58.52925 3.337408       7.760833      -1.946537      11.60997      7.605792       10.43479  118.8990 59.52002 134.4939 65.09709 -15.59484      88.20580 
1 1 1 -22 1  8  o 97.25422 48.53374 -6.059134      7.454603      -10.45852      10.46215      -1.522127      10.62453  102.4851 51.93777 114.1837 57.12716 -11.69868      77.20780 
1 1 1 -22 1  9  o 107.0114 51.78481 1.006723       6.595090      4.470016       10.49672      -1.252176      8.477296  119.0367 59.10419 106.6800 52.99382 12.35667       79.38293 
1 1 1 -22 1  10 o 84.84534 42.90162 -9.360497      6.891312      -15.11302      11.08416      -5.735788      8.798527  94.20627 48.23716 97.35349 49.13663 -3.147224      68.85661 
1 1 1 -22 1  11 o 85.81454 42.94059 -4.807428      6.013982      -11.00339      8.292439      2.067397       8.734913  86.60646 44.12208 105.2239 52.51502 -18.61746      68.58997 
1 1 1 -22 1  12 o 85.28246 42.72855 -3.886282      6.043623      -10.87094      8.553756      3.076270       8.540208  85.07412 43.46635 102.4853 51.26582 -17.41120      67.21240 
1 1 1 -22 1  13 o 87.43389 43.53437 -1.101557      5.857483      -7.901286      8.221512      5.907981       8.347388  84.36962 43.06620 102.6720 51.25671 -18.30242      66.94736 
1 1 1 -22 2  1  o 154.1805 65.41105 7.256336       6.804581      11.11988       8.664430      1.038365       10.99186  170.9045 73.19193 139.1336 67.21429 31.77084       99.37212 
1 1 1 -22 2  2  o 151.3597 69.05385 7.209212       9.001875      7.209212       9.001875      0.000000       0.000000  151.3597 69.05385 ?        ?        0.000000       69.05385 
1 1 1 -22 2  3  o 126.6700 60.92385 0.4908389E-01  8.795704      0.4908389E-01  8.795704      0.000000       0.000000  126.6700 60.92385 ?        ?        0.000000       60.92385 
1 1 1 -22 2  4  o 109.9444 53.17567 -2.545857      6.930820      -2.893769      8.612500      -1.906488      11.67536  116.9595 57.17387 128.1354 63.39438 -11.17588      85.36802 
1 1 1 -22 2  5  o 143.5434 62.94767 7.164919       6.724526      10.70744       8.490662      1.203717       11.01419  155.6260 69.36442 129.2610 63.48904 26.36494       94.03340 
1 1 1 -22 2  6  o 129.9559 59.52473 4.902866       6.776328      2.283795       8.892014      8.530822       10.46544  124.6561 60.27660 140.7000 67.35023 -16.04392      90.38431 
1 1 1 -22 2  7  o 281.5454 64.22028 26.91651       6.866374      38.36013       8.784081      8.939845       11.00954  318.6771 72.59798 136.4606 66.24133 182.2165       98.27706 
1 1 1 -22 2  8  o 118.1694 55.67059 3.598033       6.609663      20.69660       11.05289      -5.920421      8.246680  159.2560 74.02991 100.5838 50.32406 58.67212       89.51501 
1 1 1 -22 2  9  o 87.87990 44.14597 -7.812467      6.663670      -0.6434774     10.43595      -12.74755      8.658649  110.9130 55.65135 90.63380 46.06685 20.27924       72.24422 
1 1 1 -22 2  10 o 111.2956 53.37881 3.778733       6.645539      6.761743       10.01796      1.434464       8.880873  117.5894 58.27384 108.0947 53.78621 9.494751       79.30193 
1 1 1 -22 2  11 f 140.7917 60.97044 11.73626       6.142637      8.148919       8.373262      15.91660       9.038873  116.8638 56.96238 134.1411 63.75719 -17.27732      85.49673 
1 1 1 -22 2  12 o 78.29625 39.61536 -7.630722      5.932062      -0.9622220     8.313017      -14.54940      8.467522  95.91563 48.32872 81.24361 41.64016 14.67202       63.79316 
1 1 1 -22 2  13 o 87.70871 43.61867 -0.8322937     5.807888      13.40190       8.407491      -13.82512      8.032520  116.9753 57.03033 78.07482 40.05302 38.90047       69.69005 
1 1 1 -22 3  1  o 133.3662 63.29820 1.290485       8.847303      1.290485       8.847303      0.000000       0.000000  133.3662 63.29820 ?        ?        0.000000       63.29820 
1 1 1 -22 3  2  o 172.1950 74.07070 12.42742       8.944085      12.42742       8.944085      0.000000       0.000000  172.1950 74.07070 ?        ?        0.000000       74.07070 
1 1 1 -22 3  3  o 108.0571 53.76894 -8.721796      8.877601      -8.721796      8.877601      0.000000       0.000000  108.0571 53.76894 ?        ?        0.000000       53.76894 
1 1 1 -22 3  4  o 115.9809 55.49904 -0.5563056     7.093075      14.18846       9.042571      -24.13926      11.43595  171.9575 74.22142 100.0450 51.04311 71.91253       90.07896 
1 1 1 -22 3  5  o 131.2921 62.41192 4.002410       8.667436      4.002410       8.667436      0.000000       0.000000  131.2921 62.41192 ?        ?        0.000000       62.41192 
1 1 1 -22 3  6  o 89.21777 44.34087 -7.169275      5.962908      -5.928115      8.596910      -8.320001      8.277791  106.2506 52.87689 100.7871 50.42472 5.463539       73.06585 
1 1 1 -22 3  7  o 91.19338 45.21106 -5.878545      6.052445      -12.20830      8.581554      0.3864055      8.537516  94.70659 47.88635 115.7311 56.64747 -21.02452      74.17573 
1 1 1 -22 3  8  o 135.6086 59.76987 7.754628       6.132102      6.202065       8.385098      9.539573       8.990748  126.0406 60.32059 134.6246 63.87042 -8.583992      87.85217 
1 1 1 -22 3  9  o 97.28669 48.11874 -2.810957      6.709331      14.19569       10.64891      -14.00589      8.639856  135.9116 65.77805 88.82540 45.23173 47.08624       79.82895 
1 1 1 -22 3  10 o 113.7963 54.27546 4.769349       6.667792      9.463573       10.12034      1.168660       8.863516  121.5309 59.91901 107.0577 53.34540 14.47321       80.22481 
1 1 1 -22 3  11 o 98.74505 48.40942 0.8737721      6.309030      7.079620       9.946376      -3.303992      8.160866  112.3818 56.07954 95.26851 47.98760 17.11327       73.80870 
1 1 1 -22 3  12 o 122.8292 55.80665 9.011156       5.802844      4.789171       7.861792      14.06422       8.600838  104.7713 51.86809 123.6208 59.65535 -18.84956      79.05099 
1 1 1 -22 3  13 o 122.3626 55.64622 10.15655       5.786583      10.48079       7.998188      9.800413       8.382244  111.4507 54.61102 108.9339 53.86203 2.516800       76.70386 
1 1 1 -22 4  1  o 99.76921 50.22194 -15.12152      8.858783      -15.12152      8.858783      0.000000       0.000000  99.76921 50.22194 ?        ?        0.000000       50.22194 
1 1 1 -22 4  2  o 156.3055 70.57571 9.084563       9.109759      9.084563       9.109759      0.000000       0.000000  156.3055 70.57571 ?        ?        0.000000       70.57571 
1 1 1 -22 4  3  o 126.7899 60.86890 0.7655879      8.687808      0.7655879      8.687808      0.000000       0.000000  126.7899 60.86890 ?        ?        0.000000       60.86890 
1 1 1 -22 4  4  o 152.3343 65.98232 8.811128       7.196923      10.96098       8.681046      4.085737       12.87023  157.8491 70.26254 137.8968 67.90681 19.95232       97.71468 
1 1 1 -22 4  5  o 132.5002 62.70489 4.794448       8.559404      4.794448       8.559404      0.000000       0.000000  132.5002 62.70489 ?        ?        0.000000       62.70489 
1 1 1 -22 4  6  f 109.5841 53.08517 -0.9460090     6.975837      2.610513       8.576457      -7.898423      11.99121  123.3064 59.52066 113.5879 57.33439 9.718483       82.64346 
1 1 1 -22 4  7  o 121.3620 57.50879 3.757898       7.245995      13.57636       8.943192      -15.00423      12.36266  152.1844 69.19666 104.7530 53.41137 47.43131       87.41254 
1 1 1 -22 4  8  o 139.5320 60.62285 8.677678       6.112583      5.485808       8.759247      11.70760       8.534143  123.0832 59.59061 141.5008 65.52400 -18.41766      88.56882 
1 1 1 -22 4  9  o 110.9275 52.34122 3.149770       5.884815      0.5390851      8.195407      5.928762       8.455456  107.8859 53.32774 119.8435 58.14654 -11.95753      78.89783 
1 1 1 -22 4  10 o 84.55859 42.59186 -7.450536      6.426630      -8.798611      10.17677      -6.556333      8.288406  96.24496 49.01763 93.53672 47.26724 2.708237       68.09493 
1 1 1 -22 4  11 o 98.34001 48.28759 0.8857592      6.356775      -5.885789      9.365468      6.670305       8.656057  94.29683 47.92681 111.8843 55.21034 -17.58745      73.11060 
1 1 1 -22 4  12 o 193.9667 69.11848 22.59347       6.563540      15.59338       10.03082      27.83467       8.679604  119.7709 59.16391 169.8676 73.01549 -50.09670      93.97675 
1 1 1 -22 5  1  f 132.7922 58.28785 3.979528       5.777777      -3.463824      8.743580      9.749060       7.697953  119.2788 58.15461 163.1548 69.40751 -43.87604      90.55032 
1 1 1 -22 5  2  o 110.4610 52.06151 -0.6796786     5.791825      -1.294373      8.937407      -0.2346285     7.604775  123.4517 59.87045 121.1336 57.82719 2.318092       83.23734 
1 1 1 -22 5  3  o 149.5485 64.65786 7.820448       6.885703      13.07959       8.754516      -0.7106049     11.15003  169.0935 73.00734 128.7482 63.36377 40.34523       96.66974 
1 1 1 -22 5  4  o 190.5439 71.93945 15.48742       7.273596      7.800293       9.080735      29.24806       12.14949  143.8379 66.94215 205.9646 87.39333 -62.12665      110.0856 
1 1 1 -22 5  5  o 104.7451 51.17746 -3.117391      6.874916      -6.826929      8.791130      2.723125       11.03089  106.1725 52.93967 128.9316 63.36975 -22.75910      82.57320 
1 1 1 -22 5  6  f 132.3061 59.22126 6.049604       6.259753      19.02713       8.817458      -7.137060      8.888223  181.8242 75.61548 104.0170 52.07134 77.80719       91.81026 
1 1 1 -22 5  7  o 97.04600 47.61320 -3.166958      6.140641      -2.400089      8.519360      -3.996181      8.858947  108.3136 53.68809 106.5478 53.12948 1.765785       75.53246 
1 1 1 -22 5  8  o 96.29869 47.85441 -4.343131      6.937413      -1.005244      8.656790      -10.33459      11.59811  108.3197 53.76456 103.3783 52.61969 4.941460       75.22939 
1 1 1 -22 5  9  o 103.6046 49.87014 1.197953       5.921707      6.762252       8.096152      -5.203438      8.683815  121.0336 58.27277 98.70620 49.69147 22.32743       76.58302 
1 1 1 -22 5  10 o 147.0012 63.36145 13.11071       6.571493      6.741651       10.21851      17.60245       8.581387  114.6982 57.17245 146.7281 67.12547 -32.02990      88.17323 
1 1 1 -22 5  11 o 100.6109 49.22848 2.015841       6.430170      -0.6474344     10.09583      3.833619       8.340739  100.6115 50.99174 105.7643 52.54342 -5.152748      73.21864 
1 1 1 -22 5  12 o 90.13212 45.02819 -1.429111      6.492949      2.970970       9.380080      -5.476903      8.996745  100.6122 50.77584 90.32807 46.01225 10.28417       68.52235 
1 1 1 -22 6  1  o 187.7254 63.80000 11.58671       5.557329      9.104300       8.726611      13.28026       7.207875  156.5106 69.99874 185.4024 71.22503 -28.89182      99.86405 
1 1 1 -22 6  2  o 91.15554 44.85355 -6.236281      5.577881      -0.4635281     8.818340      -10.08633      7.201593  123.9920 59.97258 95.24924 47.56020 28.74271       76.54203 
1 1 1 -22 6  3  o 109.6101 52.09017 -0.7314187     6.029275      2.854586       8.862489      -3.821112      8.226366  130.4452 62.31500 112.1888 55.05607 18.25639       83.15245 
1 1 1 -22 6  4  o 125.2502 58.22203 3.265401       6.836361      -0.9729972     8.700067      10.10646       11.05308  118.2342 57.72543 146.5911 69.90684 -28.35688      90.65976 
1 1 1 -22 6  5  o 116.6824 55.48312 1.455655       6.859492      -13.33861      8.741996      25.15713       11.06500  95.63331 48.35221 189.4454 81.93564 -93.81211      95.13876 
1 1 1 -22 6  6  o 146.1110 63.55269 9.374149       6.732730      13.93748       8.392989      1.137092       11.27618  158.4797 69.88409 121.7026 60.56544 36.77709       92.47680 
1 1 1 -22 6  7  o 134.7170 59.36933 7.446798       6.048287      9.571147       8.516884      5.285449       8.590734  136.3065 63.89127 124.0016 59.78357 12.30492       87.49953 
1 1 1 -22 6  8  o 123.9411 56.07533 5.911019       5.784598      1.865424       8.134796      10.04915       8.227302  111.9676 54.90739 133.7641 62.73024 -21.79653      83.36609 
1 1 1 -22 6  9  o 136.7217 59.88579 9.557343       6.070471      10.47693       8.292194      8.495369       8.911060  129.6107 61.44733 122.8695 59.63260 6.741226       85.62605 
1 1 1 -22 6  10 o 92.48585 46.03947 -2.720549      6.535933      0.4021282      7.951318      -9.226062      11.47668  102.0316 50.78956 97.13128 49.68475 4.900360       71.05036 
1 1 1 -22 6  11 o 101.5535 49.78943 2.591248       6.677237      -0.5957799     10.50716      4.750262       8.648087  100.2651 50.94049 106.4936 53.00370 -6.228432      73.51412 
1 1 1 -22 7  1  o 148.4160 67.38434 7.413975       8.441307      7.413975       8.441307      0.000000       0.000000  148.4160 67.38434 ?        ?        0.000000       67.38434 
1 1 1 -22 7  2  o 92.65265 45.37069 -5.210752      5.494269      -10.16718      8.205091      -1.181842      7.397632  100.7138 50.36007 115.6626 55.69073 -14.94878      75.08392 
1 1 1 -22 7  3  o 218.9943 66.04593 16.70555       6.084387      19.47485       9.245464      14.58996       8.080888  192.3359 78.43707 176.5821 72.82160 15.75374       107.0297 
1 1 1 -22 7  4  o 114.1569 54.39018 0.5422246      6.659158      0.7357609      8.546474      0.2431690      10.62385  120.5523 58.48316 123.9915 61.18102 -3.439133      84.63686 
1 1 1 -22 7  5  o 237.0696 70.09272 21.83370       6.903632      27.46395       8.913056      13.39072       10.91467  233.5353 80.75293 148.4969 70.42904 85.03842       107.1508 
1 1 1 -22 7  6  o 120.5274 56.38931 3.854313       6.581234      3.755248       8.489607      4.003502       10.41825  122.1902 59.03899 124.1638 61.13489 -1.973663      84.98869 
1 1 1 -22 7  7  o 94.99998 46.69006 -3.087667      5.985821      -3.054538      8.259605      -3.124314      8.687018  104.3600 51.91861 105.5094 52.61161 -1.149315      73.91565 
1 1 1 -22 7  8  o 140.7617 60.29489 9.445621       5.882061      11.78576       8.088451      6.818946       8.569342  138.3703 63.97413 122.3277 59.15607 16.04261       87.13284 
1 1 1 -22 7  9  o 114.3548 53.31056 4.821684       5.797861      -0.3910002     7.900135      10.90654       8.535502  102.7370 51.05608 128.3828 61.28115 -25.64586      79.76279 
1 1 1 -22 7  10 f 81.16703 40.82812 -6.636143      5.796476      -3.931151      7.700415      -10.17292      8.805110  93.47836 47.02589 89.03992 45.37106 4.438431       65.34499 
1 1 1 -22 8  1  o 124.5933 55.77630 3.067631       5.554612      5.636207       8.054874      0.7386152      7.670061  140.1837 64.46243 122.9704 58.52963 17.21330       87.06964 
1 1 1 -22 8  2  o 133.5361 58.34738 5.017318       5.731347      19.82461       8.365180      -8.083204      7.868317  207.8485 77.41469 101.7323 50.62150 106.1162       92.49632 
1 1 1 -22 8  3  o 103.5418 49.64164 -1.571392      5.735788      -8.341294      8.234011      4.810468       7.994547  101.8638 50.86182 132.2303 61.95522 -30.36652      80.15843 
1 1 1 -22 8  4  o 93.79762 46.07273 -4.653018      5.802418      -5.614924      8.367307      -3.761929      8.053410  105.6203 52.49841 107.8604 53.23013 -2.240013      74.76315 
1 1 1 -22 8  5  f 101.9813 50.03588 -3.041616      6.782846      -1.494859      8.776823      -5.335257      10.68782  112.6746 55.59917 111.5861 56.03472 1.088531       78.93768 
1 1 1 -22 8  6  o 97.41178 48.21881 -4.284645      6.786785      -5.826437      8.638634      -1.798585      10.96953  102.3573 51.25431 114.2120 57.27194 -11.85464      76.85753 
1 1 1 -22 8  7  o 89.78152 44.88478 -6.515658      6.503516      -11.60397      8.047321      3.064871       11.04229  89.82697 45.52588 117.7912 58.82737 -27.96427      74.38592 
1 1 1 -22 8  8  o 92.72204 45.71120 -2.750507      5.885653      3.644410       8.178557      -9.619973      8.476582  113.5385 55.54659 92.24339 46.74775 21.29513       72.60011 
1 1 1 -22 9  2  o 103.0336 49.18279 -1.464038      5.498888      -13.13092      7.504280      12.06466       8.080898  90.66520 45.71280 163.0031 70.26053 -72.33791      83.82244 
1 1 1 -22 9  3  f 110.1775 51.53506 0.8339143      5.491429      2.238518       7.684161      -0.6322031     7.850620  122.4045 58.34913 115.0926 55.88441 7.311836       80.79411 
1 1 1 -22 9  4  o 115.4495 53.74572 2.236151       5.860183      0.1695229      8.471048      4.132931       8.115482  116.6228 56.94353 126.1081 60.07312 -9.485283      82.77286 
1 1 1 -22 9  5  o 109.3848 51.83236 1.151547       5.885651      13.24974       8.601292      -9.501173      8.071116  152.5458 68.75554 95.43304 48.02628 57.11272       83.86804 
1 1 1 -22 9  6  o 121.4747 57.12432 4.777157       6.902856      -3.799384      8.710908      19.25325       11.31705  104.9243 52.37788 151.5825 71.84115 -46.65816      88.90778 
1 1 1 -21 0  1  o 112.4702 77.34779 -5.137532      11.05800      -5.137532      11.05800      -5.137532      11.05800  112.4702 77.34779 112.4702 77.34779 0.000000       0.000000 
1 1 1 -21 0  2  o 198.2914 108.9561 14.03690       12.10222      14.03690       12.10222      14.03690       12.10222  198.2914 108.9561 198.2914 108.9561 -0.000000      0.000000 
1 1 1 -21 0  3  o 82.58739 60.51237 -29.04830      12.49587      -29.04830      12.49587      -29.04830      12.49587  82.58739 60.51237 82.58739 60.51237 0.000000       0.000000 
1 1 1 -21 0  4  o 160.8803 105.1151 3.994714       16.14420      3.994714       16.14420      3.994714       16.14420  160.8803 105.1151 160.8803 105.1151 -0.000000      0.000000 
1 1 1 -21 0  5  o 130.8721 83.10624 2.958948       9.194620      2.958948       9.194620      2.958948       9.194620  130.8721 83.10624 130.8721 83.10624 0.000000       0.000000 
1 1 1 -21 0  6  o 83.24180 59.67308 -12.82721      9.065793      -12.82721      9.065793      -12.82721      9.065793  83.24180 59.67308 83.24180 59.67308 0.000000       0.000000 
1 1 1 -21 0  7  o 137.9274 85.78456 4.412355       9.264879      4.412355       9.264879      4.412355       9.264879  137.9274 85.78456 137.9274 85.78456 0.000000       0.000000 
1 1 1 -21 0  8  o 133.5264 83.83710 3.764847       9.066568      3.764847       9.066568      3.764847       9.066568  133.5264 83.83710 133.5264 83.83710 0.000000       0.000000 
1 1 1 -21 0  9  o 76.80714 55.76793 -17.32421      9.223618      -17.32421      9.223618      -17.32421      9.223618  76.80714 55.76793 76.80714 55.76793 0.000000       0.000000 
1 1 1 -21 0  10 o 129.7195 89.50866 -5.519321      15.10245      -5.519321      15.10245      -5.519321      15.10245  129.7195 89.50866 129.7195 89.50866 0.000000       0.000000 
1 1 1 -21 0  11 o 211.5360 119.4999 18.02153       15.05065      18.02153       15.05065      18.02153       15.05065  211.5360 119.4999 211.5360 119.4999 -0.000000      0.000000 
1 1 1 -21 0  12 o 195.4197 114.2271 15.20350       14.45397      15.20350       14.45397      15.20350       14.45397  195.4197 114.2271 195.4197 114.2271 -0.000000      0.000000 
1 1 1 -21 0  13 o 230.6253 100.0996 17.63510       9.268850      17.63510       9.268850      17.63510       9.268850  230.6253 100.0996 230.6253 100.0996 0.000000       0.000000 
1 1 1 -21 0  14 o 185.4918 94.58979 12.42010       8.578292      12.42010       8.578292      12.42010       8.578292  185.4918 94.58979 185.4918 94.58979 0.000000       0.000000 
1 1 1 -21 0  15 o 216.7322 95.79719 15.89828       8.483720      15.89828       8.483720      15.89828       8.483720  216.7322 95.79719 216.7322 95.79719 0.000000       0.000000 
1 1 1 -21 0  16 f 105.6202 70.39000 -0.4215977E-01 7.828054      -0.4215977E-01 7.828054      -0.4215977E-01 7.828054  105.6202 70.39000 105.6202 70.39000 0.000000       0.000000 
1 1 1 -21 0  17 o 67.28270 49.00366 -14.47214      7.441680      -14.47214      7.441680      -14.47214      7.441680  67.28270 49.00366 67.28270 49.00366 -0.000000      0.000000 
1 1 1 -21 1  1  o 128.5413 60.86811 -3.361372      8.089351      -19.50311      11.49269      12.48806       11.38816  118.3079 59.22331 197.9448 84.31877 -79.63686      103.0391 
1 1 1 -21 1  2  o 120.1488 58.90675 -9.796673      9.347176      -9.796673      9.347176      0.000000       0.000000  120.1488 58.90675 ?        ?        0.000000       58.90675 
1 1 1 -21 1  3  o 128.8846 59.86563 -0.8893855     7.205631      7.301676       9.236259      -13.62741      11.51800  170.2320 74.23384 125.0611 62.06431 45.17095       96.76074 
1 1 1 -21 1  4  o 251.3310 72.57063 18.97962       7.478754      11.26261       9.288554      33.20335       12.61044  186.2363 77.54301 286.1347 96.11205 -99.89845      123.4927 
1 1 1 -21 1  5  o 304.3142 81.20222 30.42824       9.774763      -8.610633      15.17635      58.10392       12.77815  143.3574 71.16090 435.1353 78.50474 -291.7779      105.9569 
1 1 1 -21 1  6  o 180.3212 69.23704 10.33766       6.808935      9.304612       9.949929      11.24751       9.337773  169.4029 75.32415 178.4562 76.19256 -9.053299      107.1403 
1 1 1 -21 1  7  o 242.9529 67.13241 18.01722       6.544547      7.786981       9.239590      28.31772       9.271266  159.4044 71.60733 282.4035 80.57558 -122.9991      107.7963 
1 1 1 -21 1  8  o 87.51852 43.90087 -12.35721      6.471947      -4.070402      9.086064      -20.89171      9.220856  120.7785 58.97303 94.98250 48.20151 25.79598       76.16563 
1 1 1 -21 1  9  o 128.5724 60.53766 1.958135       7.795929      7.783201       9.147776      -13.49799      14.90100  150.0085 68.87530 123.6852 62.60416 26.32326       93.07571 
1 1 1 -21 1  10 o 238.8978 77.80895 24.00168       8.282830      32.14848       9.980765      5.978260       14.84530  261.7480 85.42050 140.9545 70.03830 120.7935       110.4628 
1 1 1 -21 1  11 o 116.7109 57.68207 -1.843788      9.577190      -20.07887      13.93682      14.47201       13.18299  108.0813 55.24243 148.3573 72.12428 -40.27595      90.84954 
1 1 1 -21 1  12 o 117.0975 56.55530 2.318980       7.770350      -8.095657      14.21750      6.754810       9.278730  113.7861 57.94999 129.2961 62.28431 -15.51006      85.07371 
1 1 1 -21 1  13 o 111.8643 53.29897 2.908919       6.395336      -0.3472148E-01 9.184793      5.679181       8.910199  109.7077 54.60672 120.5602 58.76326 -10.85252      80.21855 
1 1 1 -21 1  14 o 103.3417 49.86018 1.857998       6.001792      4.056746       8.358107      -0.4827378     8.623756  111.0651 54.69944 103.1166 51.57169 7.948540       75.17757 
1 1 1 -21 1  15 o 101.4144 49.12637 2.746540       5.973297      1.435092       8.418329      4.076336       8.477013  100.9828 50.57048 105.4153 52.46865 -4.432571      72.87202 
1 1 1 -21 1  16 o 76.07825 38.43658 -6.382191      5.463326      -10.85193      7.548292      -1.464442      7.917546  79.36820 40.57380 91.45628 46.21375 -12.08808      61.49751 
1 1 1 -21 1  17 o 123.0214 55.84501 11.72918       5.794587      12.49962       8.034904      10.89421       8.364602  109.8119 53.99490 105.5095 52.45092 4.302429       75.27647 
1 1 1 -21 2  1  o 138.1702 64.98611 -1.847424      8.939809      -1.847424      8.939809      0.000000       0.000000  138.1702 64.98611 ?        ?        0.000000       64.98611 
1 1 1 -21 2  2  o 143.3154 63.86919 2.408495       7.196140      5.149328       9.286971      -1.709859      11.38399  162.8710 72.57256 148.9030 70.99171 13.96797       101.5214 
1 1 1 -21 2  3  f 100.2295 49.66619 -11.45702      7.270835      5.035144       9.092480      -40.70605      12.10875  159.9779 71.50729 98.66921 50.51430 61.30865       87.54991 
1 1 1 -21 2  4  o 292.6482 66.75266 23.73531       7.418584      26.56974       9.277453      18.70904       12.35432  287.4803 80.10982 211.0352 88.75579 76.44508       119.5624 
1 1 1 -21 2  5  o 172.3519 69.81552 8.904899       7.266321      6.002775       8.927233      14.60203       12.50798  158.5564 70.86449 189.6698 84.38910 -31.11340      110.1966 
1 1 1 -21 2  6  o 121.3390 57.80960 -2.314944      7.521082      -9.518291      9.853604      7.739366       11.64137  118.0386 58.37030 163.7806 76.08059 -45.74203      95.89237 
1 1 1 -21 2  7  o 204.8727 75.40861 15.52460       7.893095      24.42937       14.91109      12.05812       9.303427  200.1529 90.34106 176.9356 75.81066 23.21730       117.9354 
1 1 1 -21 2  8  o 111.2085 54.48863 -5.661545      7.958388      -6.179813      9.327212      -4.274238      15.26023  117.2086 57.73642 138.0417 68.97306 -20.83315      89.94875 
1 1 1 -21 2  9  o 130.9348 65.70892 -5.489588      14.58069      0.000000       0.000000      -5.489588      14.58069  ?        ?        130.9348 65.70892 0.000000       65.70892 
1 1 1 -21 2  10 o 132.6783 61.53716 4.573491       7.571552      -3.564956      8.879574      26.25557       14.49345  114.6003 56.42877 177.8850 83.36958 -63.28472      100.6712 
1 1 1 -21 2  11 o 106.4187 52.47767 -3.767477      7.774383      -21.10197      13.50220      4.829613       9.508781  105.7288 54.06703 130.0514 62.75003 -24.32254      82.83000 
1 1 1 -21 2  12 o 130.1893 61.26902 6.965775       7.967583      21.67936       15.15965      1.350204       9.365416  145.5120 72.03507 117.0598 57.70024 28.45226       92.29501 
1 1 1 -21 2  13 o 214.8547 75.74752 25.18250       7.862722      24.59244       14.71768      25.41817       9.301311  140.6688 69.86903 185.2541 77.40400 -44.58528      104.2740 
1 1 1 -21 2  14 o 93.67580 46.33141 -1.994666      6.218475      -7.587902      8.903377      3.332516       8.689043  93.72619 47.54321 109.3736 54.21467 -15.64741      72.10817 
1 1 1 -21 2  15 o 85.08167 42.58007 -3.976783      5.923523      -0.1561209     8.295200      -7.952199      8.461530  98.01936 49.24155 88.34836 44.96708 9.670998       66.68409 
1 1 1 -21 2  16 o 78.90068 39.89645 -6.023584      5.961264      -4.418794      8.085710      -7.934610      8.823529  87.80366 44.61711 85.78069 43.85320 2.022964       62.56029 
1 1 1 -21 2  17 o 122.4575 55.72018 11.73245       5.812191      8.741690       7.708959      15.67187       8.847521  102.9176 51.02373 112.1718 55.43917 -9.254143      75.34535 
1 1 1 -21 3  1  o 135.7063 60.57609 1.480210       6.501398      2.680772       9.142163      0.2518309      9.247470  153.7942 69.94158 145.8541 67.77153 7.940170       97.38996 
1 1 1 -21 3  2  o 106.8266 51.61413 -6.032481      6.487276      6.221712       9.201534      -18.14315      9.147491  166.3491 73.27287 103.7812 52.07701 62.56792       89.89398 
1 1 1 -21 3  3  o 241.5561 71.82526 17.33409       7.233531      26.64025       9.332942      3.333583       11.44736  290.3393 80.14433 159.5916 74.56979 130.7478       109.4704 
1 1 1 -21 3  4  o 142.2971 63.97483 2.778002       7.392110      2.836074       9.377563      2.682697       12.01341  149.8200 69.13276 156.6822 74.18871 -6.862183      101.4066 
1 1 1 -21 3  5  o 198.3574 74.17459 13.22714       7.694628      15.98988       9.842896      8.885448       12.33906  203.3186 81.64207 170.4449 78.87807 32.87369       113.5217 
1 1 1 -21 3  6  o 160.1273 69.02880 7.470031       7.801847      3.151218       9.566804      16.04552       13.48076  146.0531 68.21906 185.4675 84.57182 -39.41441      108.6565 
1 1 1 -21 3  7  o 126.5049 60.26060 -0.7949113     8.165122      2.484163       9.329468      -11.52716      16.87822  140.2048 66.07855 136.5136 68.79465 3.691147       95.38910 
1 1 1 -21 3  8  o 114.2896 57.08391 -10.49801      10.40853      -28.21866      14.90533      6.367435       14.54120  113.2858 57.83938 151.3875 74.06401 -38.10167      93.97272 
1 1 1 -21 3  9  o 203.9775 82.52332 21.86879       10.13866      29.55559       14.24575      13.97908       14.43254  197.7062 88.85566 158.7303 76.76257 38.97591       117.4215 
1 1 1 -21 3  10 o 103.8135 50.45089 -3.023619      6.434889      -4.946298      8.545538      -0.5056601     9.779358  109.9291 54.35975 122.7611 60.20077 -12.83204      81.11174 
1 1 1 -21 3  11 o 90.57546 45.04104 -6.985657      6.188167      -7.036402      8.772078      -6.935387      8.730847  104.1262 52.06705 104.1211 52.04646 0.5012512E-02  73.61937 
1 1 1 -21 3  12 o 98.45454 48.88941 -4.573186      7.188710      -7.171383      11.91292      -3.085285      9.015075  109.2476 55.37104 107.6464 53.66426 1.601227       77.10904 
1 1 1 -21 3  13 o 119.0483 57.07310 5.488297       7.579493      -12.99416      13.42888      14.12877       9.181816  102.7321 52.63964 140.1269 65.89145 -37.39476      84.33632 
1 1 1 -21 3  14 o 95.46770 46.97775 -0.8726770     6.121311      2.456888       8.677598      -4.170573      8.636231  107.0744 53.26040 96.79755 48.83444 10.27688       72.25975 
1 1 1 -21 3  15 o 110.6055 52.56955 5.993471       6.144382      14.44744       8.656528      -2.590409      8.722785  125.8873 60.52040 94.84940 47.99637 31.03793       77.24229 
1 1 1 -21 3  16 o 101.7548 49.52560 4.918665       6.264135      9.303345       8.397625      -0.5815968     9.405443  107.9473 53.47005 93.68931 47.65843 14.25802       71.62662 
1 1 1 -21 3  17 o 106.9716 51.01241 8.090428       5.885324      1.898396       7.710025      16.73597       9.110353  91.13550 45.99809 112.3087 55.64156 -21.17317      72.19286 
1 1 1 -21 4  1  o 146.4666 63.21264 3.662381       6.557755      7.450679       9.275561      -0.1234764     9.272573  172.5450 74.82182 143.9658 67.21647 28.57922       100.5801 
1 1 1 -21 4  2  o 264.9949 64.08420 18.84305       6.522750      23.17731       9.491041      14.96356       8.979338  263.8283 83.03078 211.2517 79.88921 52.57658       115.2232 
1 1 1 -21 4  3  o 94.88483 46.68371 -8.605870      6.037109      -6.056679      8.543711      -11.14797      8.531826  121.0082 58.65067 109.9285 54.35125 11.07971       79.96224 
1 1 1 -21 4  4  o 179.7215 68.68204 9.700088       6.680593      15.78424       9.230096      3.006094       9.681640  208.1643 80.42860 150.3067 69.66817 57.85759       106.4068 
1 1 1 -21 4  5  o 192.2453 79.35265 14.03014       9.606636      14.03014       9.606636      0.000000       0.000000  192.2453 79.35265 ?        ?        0.000000       79.35265 
1 1 1 -21 4  6  o 181.0223 77.36005 12.71435       9.642311      12.71435       9.642311      0.000000       0.000000  181.0223 77.36005 ?        ?        0.000000       77.36005 
1 1 1 -21 4  7  o 223.6636 84.66656 22.54508       10.09167      22.54508       10.09167      0.000000       0.000000  223.6636 84.66656 ?        ?        0.000000       84.66656 
1 1 1 -21 4  8  o 287.4548 73.38955 28.06365       8.221081      37.69946       9.901512      6.678852       14.75061  323.6868 79.37478 150.3495 73.77119 173.3374       108.3630 
1 1 1 -21 4  9  f 94.86330 47.02971 -7.707137      6.548165      0.9582818      9.396580      -15.88817      9.130175  128.0379 61.92423 97.72909 49.41210 30.30880       79.22226 
1 1 1 -21 4  10 o 107.2507 52.59043 -3.536562      7.458398      11.01134       13.44707      -10.00056      8.963508  145.2966 71.11357 102.5830 51.48617 42.71355       87.79502 
1 1 1 -21 4  11 o 84.23830 42.24066 -9.169251      5.965558      -10.26394      8.414345      -8.062915      8.458979  96.92502 48.80994 100.3989 50.33810 -3.473877      70.11658 
1 1 1 -21 4  12 o 87.00147 43.79951 -9.393270      6.747729      -17.12696      11.08060      -4.834838      8.507025  96.81065 49.46353 102.4122 51.21969 -5.601517      71.20462 
1 1 1 -21 4  13 o 87.40487 44.17176 -9.242526      7.246057      -7.825213      11.75385      -10.11139      9.202887  102.8806 52.42342 94.14445 47.81510 8.736122       70.95420 
1 1 1 -21 4  14 o 127.1604 58.30357 9.323618       6.523920      7.530296       9.066129      11.24944       9.395095  115.3185 56.82813 122.2622 59.75524 -6.943710      82.46287 
1 1 1 -21 4  15 o 129.1193 58.55636 11.25679       6.351194      9.517282       8.512473      13.44104       9.538778  113.7034 55.84099 118.6418 58.43178 -4.938324      80.82381 
1 1 1 -21 4  16 o 68.51006 35.05917 -12.78017      5.772026      -19.68280      7.640111      -3.601575      8.810095  71.41888 36.74720 89.20566 45.44925 -17.78678      58.44648 
1 1 1 -21 5  1  o 178.2923 75.30956 9.036081       8.956769      9.036081       8.956769      0.000000       0.000000  178.2923 75.30956 ?        ?        0.000000       75.30956 
1 1 1 -21 5  2  o 123.5371 58.37806 -2.502624      7.370227      5.284250       9.118698      -17.17411      12.51666  159.8825 71.52702 124.0396 62.05024 35.84290       94.69080 
1 1 1 -21 5  3  o 207.0321 73.80282 13.77894       7.484035      10.82174       9.271928      19.30787       12.67799  182.2376 76.78032 210.3212 89.25970 -28.08356      117.7392 
1 1 1 -21 5  4  o 89.11139 45.00743 -17.98982      7.457111      -12.57558      9.043157      -29.49443      13.18218  109.1433 54.30270 111.2916 56.59386 -2.148254      78.43244 
1 1 1 -21 5  5  o 99.68755 49.91697 -14.14505      8.192802      -4.574288      9.497731      -41.97317      16.19528  125.8551 61.19264 113.0029 57.89612 12.85223       84.24073 
1 1 1 -21 5  6  o 146.1326 68.35536 3.957808       9.662564      3.957808       9.662564      0.000000       0.000000  146.1326 68.35536 ?        ?        0.000000       68.35536 
1 1 1 -21 5  7  f 211.4005 82.39953 20.38209       9.754115      20.38209       9.754115      0.000000       0.000000  211.4005 82.39953 ?        ?        0.000000       82.39953 
1 1 1 -21 5  8  o 174.7781 71.71081 12.42729       7.786777      9.139696       9.805373      18.04069       12.81261  154.3645 71.03498 174.6334 80.66180 -20.26892      107.4816 
1 1 1 -21 5  9  o 182.7721 68.78757 13.18943       6.638333      23.35491       9.716215      4.290133       9.090984  210.8899 82.22852 134.4733 63.92254 76.41664       104.1519 
1 1 1 -21 5  10 o 113.8686 53.72358 1.105089       6.196927      0.9673696      8.814841      1.239662       8.713592  121.1886 58.93019 121.6001 59.00539 -0.4114532     83.39307 
1 1 1 -21 5  11 o 148.6617 63.48009 9.801934       6.483324      11.86855       9.057215      7.630239       9.284622  145.8625 67.52908 132.8050 63.53572 13.05753       92.71982 
1 1 1 -21 5  12 o 109.8396 53.19435 1.428851       6.992597      -3.393100      10.81225      4.895716       9.167974  109.1295 55.00316 120.5219 58.93078 -11.39236      80.61132 
1 1 1 -21 5  13 o 116.2103 55.65211 5.301188       7.163359      3.596482       10.80425      6.638354       9.568911  113.1221 56.74106 118.0443 58.21240 -4.922211      81.29103 
1 1 1 -21 5  14 o 140.7591 63.11490 13.96125       7.142982      21.27633       11.45826      9.311519       9.135300  132.2883 64.93137 117.2597 57.64024 15.02854       86.82442 
1 1 1 -21 5  15 o 96.46545 47.50597 1.595798       6.300840      -9.540843      8.374958      16.12079       9.564527  84.91463 43.35426 122.3631 59.90731 -37.44851      73.94916 
1 1 1 -21 5  16 f 92.89172 45.89615 1.892424       6.047618      2.710473       7.938208      0.7609036      9.336071  95.58438 48.03897 93.79246 47.68865 1.791924       67.69010 
1 1 1 -21 6  1  o 248.2876 70.02229 17.89552       7.043953      19.12587       8.894477      15.82576       11.53631  238.2513 80.71506 203.7818 85.73940 34.46956       117.7547 
1 1 1 -21 6  2  o 118.5531 56.54509 -3.530391      7.237669      5.627157       9.343600      -17.26811      11.44411  160.0176 71.93509 117.4740 58.84855 42.54357       92.93981 
1 1 1 -21 6  3  o 304.9268 67.72754 26.40263       7.811622      19.75405       9.641750      39.10400       13.32652  228.5713 83.46291 301.5159 98.71977 -72.94466      129.2736 
1 1 1 -21 6  4  o 190.4044 75.08997 12.73351       8.181068      15.93370       9.812880      5.438958       14.81523  200.4863 81.16009 161.9327 78.18140 38.55356       112.6911 
1 1 1 -21 6  5  o 156.0494 68.84516 6.869219       8.154834      13.36722       9.572412      -10.32654      15.57193  184.1145 77.81645 136.7732 68.53548 47.34126       103.6943 
1 1 1 -21 6  6  o 99.69614 48.99641 -7.084520      6.590007      1.656936       9.343204      -15.73848      9.296329  136.9787 65.02302 102.4799 51.56881 34.49889       82.98997 
1 1 1 -21 6  7  o 123.2429 58.40776 0.1597352      7.479135      0.9379331      9.529773      -1.088301      12.06844  132.4417 63.62683 134.5334 66.15510 -2.091751      91.78709 
1 1 1 -21 6  8  o 128.3387 59.93937 2.664210       7.382789      6.406459       9.318695      -3.644406      12.09918  143.4075 67.09570 126.7968 63.04125 16.61069       92.06537 
1 1 1 -21 6  9  o 103.1301 50.12686 -3.091647      6.359303      2.571374       9.111480      -8.470363      8.879819  128.0839 61.70541 105.1776 52.56161 22.90630       81.05727 
1 1 1 -21 6  10 o 112.1214 52.94944 1.141115       6.045608      5.520686       8.821344      -2.737810      8.301847  130.7749 62.38857 110.1272 54.29128 20.64773       82.70354 
1 1 1 -21 6  11 o 188.7321 68.37829 16.04655       6.453282      9.347691       8.758561      24.00185       9.544666  136.2191 64.14670 188.5374 78.56168 -52.31828      101.4235 
1 1 1 -21 6  12 o 257.2249 63.88124 24.61594       6.352379      26.91814       8.421159      21.57635       9.676291  213.8514 78.01442 164.1616 73.54425 49.68980       107.2148 
1 1 1 -21 6  13 o 109.3115 52.92870 3.403280       6.914851      11.47120       10.31528      -3.180955      9.318646  124.1517 61.07146 100.8705 50.86862 23.28116       79.48170 
1 1 1 -21 6  14 o 160.0535 67.92603 18.93789       7.341918      -0.2553423     10.92018      34.77019       9.918083  101.9768 51.82235 187.0999 79.15080 -85.12312      94.60658 
1 1 1 -21 6  15 o 88.26978 43.98669 -1.506702      6.030800      -4.129148      7.721519      2.595427       9.657264  88.62608 44.88165 99.63581 50.42779 -11.00974      67.50796 
1 1 1 -21 6  16 o 129.2118 58.59748 13.75473       6.359830      16.32603       8.368417      10.23910       9.785161  119.9431 58.11293 104.0019 52.40696 15.94125       78.25344 
1 1 1 -21 7  1  o 160.9386 66.55319 6.726751       6.775560      3.997228       8.499717      11.48461       11.22191  151.3688 68.27525 183.2565 80.80891 -31.88776      105.7903 
1 1 1 -21 7  2  o 118.2280 56.22927 -2.889466      7.052029      -9.860432      8.573722      11.69039       12.39937  111.3808 54.95913 180.2538 81.77358 -68.87307      98.52627 
1 1 1 -21 7  3  o 129.3533 58.94384 1.318825       6.534331      2.944790       9.532618      -0.1223170     8.974496  147.0406 68.48436 135.7926 64.24596 11.24809       93.90234 
1 1 1 -21 7  4  o 136.8262 60.57914 3.434537       6.369254      9.292284       9.290746      -1.759577      8.748649  167.2459 73.64967 128.4254 61.50204 38.82056       95.95193 
1 1 1 -21 7  5  o 235.7658 68.02647 17.49807       6.573639      19.54467       9.626046      15.70954       8.998691  213.0983 82.19147 195.8697 78.27013 17.22865       113.4974 
1 1 1 -21 7  6  o 145.9561 62.25840 6.045305       6.224162      12.58738       9.382874      0.9043174      8.317667  173.1801 75.17532 129.7496 61.52143 43.43050       97.14019 
1 1 1 -21 7  7  o 129.2706 60.09408 2.634417       7.284619      5.053963       9.244220      -1.329622      11.83238  141.0212 66.24870 131.4091 64.78932 9.612030       92.66362 
1 1 1 -21 7  8  o 149.6244 65.44478 8.318529       7.227103      7.318381       8.937858      10.20752       12.28334  143.6710 66.71399 149.2326 71.83114 -5.561630      98.03300 
1 1 1 -21 7  9  o 88.50280 44.55498 -11.63448      6.981731      -6.806995      8.597276      -20.98398      11.96450  105.3217 52.48956 101.9714 52.04259 3.350327       73.91607 
1 1 1 -21 7  10 o 128.6330 59.82080 5.583679       7.229701      20.21772       8.859257      -23.59110      12.50890  184.8220 76.23727 99.10499 50.78265 85.71697       91.60239 
1 1 1 -21 7  11 o 131.2681 59.07990 7.152058       6.324090      18.57346       8.445275      -7.428521      9.542047  171.3315 72.78783 101.9564 51.42367 69.37502       89.12050 
1 1 1 -21 7  12 o 86.59861 43.29490 -6.068194      6.053093      -10.37844      7.818923      0.3789690      9.562692  88.71948 44.95501 109.1524 54.54757 -20.43288      70.68515 
1 1 1 -21 7  13 o 101.4138 50.08266 0.5579835      7.171277      0.9693678      10.59944      0.2107084      9.738589  106.3902 53.72541 104.6192 52.66249 1.771042       75.23136 
1 1 1 -21 7  14 o 101.7803 51.62868 1.108641       10.49924      1.108641       10.49924      0.000000       0.000000  101.7803 51.62868 ?        ?        0.000000       51.62868 
1 1 1 -21 7  15 o 142.1451 64.25816 18.74776       7.577844      18.80541       11.29795      18.70062       10.21680  116.6596 58.44513 120.6978 59.63834 -4.038185      83.50188 
1 1 1 -21 8  1  o 213.0555 64.91667 13.17511       5.856136      14.16190       8.397697      12.24096       8.170624  200.9708 76.95648 189.9863 75.00484 10.98448       107.4617 
1 1 1 -21 8  2  o 161.6439 64.45984 7.408000       6.090989      9.711232       8.580855      5.068882       8.647448  172.5222 73.33348 152.0213 68.69038 20.50090       100.4797 
1 1 1 -21 8  3  o 238.5816 65.45083 16.85737       6.247002      12.61000       9.086338      20.66461       8.602680  183.1201 76.50764 237.7591 79.38573 -54.63899      110.2520 
1 1 1 -21 8  4  o 159.8738 65.53992 7.845223       6.497405      13.80284       9.655851      2.915546       8.783422  183.0426 77.79811 140.3547 65.49324 42.68788       101.6952 
1 1 1 -21 8  5  o 294.8916 55.42759 23.40015       6.114662      28.80229       9.463535      19.52851       8.011576  272.8065 82.39025 227.1495 76.60604 45.65701       112.5017 
1 1 1 -21 8  6  o 111.9064 53.14536 -1.186305      6.255326      5.973706       9.372752      -6.936888      8.399747  145.0271 67.66721 109.4490 54.07928 35.57814       86.62228 
1 1 1 -21 8  7  o 135.3921 59.92154 5.060026       6.225974      -1.783971      8.788778      11.95433       8.821022  119.7336 58.36061 163.3540 71.85397 -43.62045      92.56864 
1 1 1 -21 8  8  o 100.4247 49.59222 -5.749692      7.029110      -7.599745      8.792981      -2.474368      11.69960  105.9420 52.84394 123.2370 61.38818 -17.29498      80.99995 
1 1 1 -21 8  9  o 112.2042 53.91112 0.2586023      6.846268      -2.687681      8.228202      6.887680       12.34225  109.9977 54.19289 133.9707 66.07494 -23.97309      85.45622 
1 1 1 -21 8  10 o 108.4777 52.00109 0.6637406      6.289277      0.4694850      8.656566      0.8809124      9.152939  114.3294 56.18146 116.1055 57.19332 -1.776093      80.17126 
1 1 1 -21 8  11 f 97.62437 48.31734 -3.186222      6.805851      -4.820890      8.235134      0.3358642      12.08804  100.0062 50.07200 114.5779 57.80090 -14.57175      76.47319 
1 1 1 -21 8  12 o 155.1681 64.39652 13.37171       6.376191      10.87511       8.128873      17.36425       10.27970  130.9040 61.69060 139.0616 66.61440 -8.157608      90.79212 
1 1 1 -21 8  13 o 103.6209 51.02297 2.147769       7.260259      12.37555       11.24257      -5.168883      9.508919  119.2711 59.53408 96.27776 48.86806 22.99336       77.02203 
1 1 1 -21 8  14 o 91.63471 45.92249 -1.930841      7.000896      3.762808       9.920959      -7.578363      9.880689  103.3058 52.14517 91.22782 46.61899 12.07802       69.94604 
1 1 1 -21 9  1  o 187.1447 65.27227 10.59824       5.829311      11.82475       8.249403      9.375009       8.238391  183.9629 74.43413 170.5601 72.14488 13.40283       103.6597 
1 1 1 -21 9  2  o 117.3699 54.29104 -0.1478543     5.835608      10.62189       8.548556      -9.546203      7.985754  174.0143 73.54182 105.8473 52.37843 68.16696       90.28787 
1 1 1 -21 9  3  o 145.8080 61.30565 5.598564       5.891518      -0.9263449     8.141097      12.77302       8.536702  126.1464 60.11245 182.3978 74.98961 -56.25146      96.10905 
1 1 1 -21 9  4  f 115.6634 53.82436 -0.2351918E-01 5.868207      4.585312       8.903486      -3.563270      7.802810  143.5665 66.63789 115.6752 56.06201 27.89124       87.08363 
1 1 1 -21 9  5  o 112.3492 53.08178 -0.8528714     6.088716      -4.057931      8.980386      1.873918       8.283287  118.4378 57.99901 130.8855 61.86223 -12.44771      84.79871 
1 1 1 -21 9  6  o 118.5582 55.20659 1.164211       6.189193      -8.475185      9.196334      9.145108       8.367886  109.1086 54.36263 153.7924 68.68102 -44.68378      87.59211 
1 1 1 -21 9  7  o 199.4458 68.58095 15.17348       6.424264      20.63351       8.856695      9.110996       9.332532  203.7352 78.76600 147.6955 68.43764 56.03967       104.3446 
1 1 1 -21 9  8  o 155.7690 65.66773 10.30233       6.788794      3.985146       8.468966      21.65935       11.35535  127.9654 61.07079 174.9212 78.90543 -46.95583      99.77830 
1 1 1 -21 9  9  o 119.6140 56.66871 3.116686       7.028679      5.906922       8.573373      -2.602900      12.27477  129.1483 61.58290 117.7773 59.26538 11.37097       85.46835 
1 1 1 -21 9  10 o 92.79019 45.86152 -4.255872      6.056187      1.408474       7.983409      -11.93412      9.294894  113.0031 55.19895 95.63756 48.51962 17.36555       73.49202 
1 1 1 -21 9  11 o 108.8009 51.87186 2.468518       6.077393      7.486705       7.929665      -4.675294      9.461204  124.4299 59.30339 102.2453 51.52312 22.18456       78.55904 
1 1 1 -21 9  12 o 108.1468 51.51841 3.388901       5.969516      12.15450       7.676914      -10.01731      9.493995  134.7173 62.29932 93.01617 47.37047 41.70112       78.26344 
1 1 1 -21 9  13 o 90.07397 44.96549 -2.901223      6.421166      -4.415930      7.503401      1.243095       12.41139  91.08987 45.89943 104.5239 53.31442 -13.43408      70.35044 
1 1 1 -21 10 1  o 215.6722 68.35268 14.78015       6.422806      11.40404       7.416642      24.90602       12.84445  181.4862 71.52031 216.5594 90.75874 -35.07320      115.5522 
1 1 1 -21 10 2  o 136.4527 59.03239 4.131320       5.746804      0.6835269      8.003788      7.800289       8.256520  130.1326 61.29268 157.7063 69.43987 -27.57368      92.62121 
1 1 1 -21 10 3  o 104.4713 49.81216 -2.504516      5.606966      5.027024       8.375348      -8.621461      7.547937  144.1252 66.07410 102.6052 50.80046 41.52002       83.34550 
1 1 1 -21 10 4  o 134.6278 58.89036 4.383353       5.853079      6.287148       8.544217      2.700012       8.034304  146.2841 66.94348 132.9169 62.22342 13.36711       91.39575 
1 1 1 -21 10 5  o 265.9733 61.96830 21.43588       6.282048      28.73139       9.236141      15.15541       8.569572  262.7553 81.78086 182.4761 75.09090 80.27922       111.0259 
1 1 1 -21 10 6  f 135.3315 59.98059 5.365490       6.260050      -3.862201      8.717149      15.19191       8.995508  113.6865 55.96557 174.2171 74.59300 -60.53059      93.25375 
1 1 1 -21 10 7  o 117.2682 54.71020 1.955116       6.124698      -0.7495713     8.569491      4.779336       8.756807  117.2370 57.25005 131.5082 62.57829 -14.27119      84.81515 
1 1 1 -21 10 8  o 108.3644 52.51595 -0.8481576     6.844618      0.5450163E-01  8.351767      -2.694558      11.94481  115.4795 56.41900 118.4975 59.46823 -3.018021      81.97301 
1 1 1 -21 10 9  o 104.7713 51.12057 -1.175180      6.793108      1.691963       8.383488      -6.656829      11.59193  115.9520 56.62317 109.6632 55.47323 6.288788       79.26830 
1 1 1 -21 10 10 o 112.0111 53.69936 2.592725       6.709898      -2.460535      7.823544      16.64956       13.04853  102.7940 51.03711 135.9291 67.20827 -33.13512      84.39039 
1 1 1 -21 10 11 o 112.3811 52.78826 4.000638       5.866549      4.652675       7.399858      2.897436       9.625308  114.7041 55.34771 111.9239 55.74103 2.780151       78.55209 
1 1 1 -21 10 12 o 95.87602 46.98350 -0.2931557     5.923827      0.1689176      7.504816      -1.056912      9.648550  100.8314 50.04975 102.3599 51.63766 -1.528458      71.91262 
1 1 1 -21 11 1  o 115.5907 53.99622 -0.4587986     5.995996      0.9555887      7.186570      -3.698723      10.87689  127.2764 59.34055 129.8837 63.65211 -2.607277      87.02236 
1 1 1 -21 11 2  o 129.2347 57.11345 3.206023       5.636097      -0.3338323     7.991217      6.709661       7.950232  125.0890 59.59422 150.1253 67.00136 -25.03631      89.66969 
1 1 1 -21 11 3  o 150.8452 62.06306 7.088179       5.852645      8.281942       8.174473      5.832657       8.383255  154.2558 68.44621 144.4024 66.16587 9.853439       95.19878 
1 1 1 -21 11 4  o 211.0618 65.80876 15.01034       5.977735      23.11025       8.564503      7.316118       8.347271  234.4177 79.20473 147.1652 66.89017 87.25249       103.6710 
1 1 1 -21 11 5  o 196.2879 67.56791 14.25638       6.236690      18.06490       8.758055      10.33816       8.883302  192.1947 77.06940 154.5614 69.74934 37.63332       103.9455 
1 1 1 -21 11 6  f 247.5127 63.94955 20.27764       6.190845      13.62445       8.538144      27.65309       8.989648  165.3329 71.74021 244.1699 81.13580 -78.83701      108.3036 
1 1 1 -21 11 7  o 101.5829 49.23196 -2.105267      6.017222      -5.670657      8.001106      2.536536       9.129350  103.3324 51.35701 123.7088 60.11324 -20.37643      79.06418 
1 1 1 -21 11 8  o 92.93836 47.01947 -12.21584      8.345248      -12.21584      8.345248      0.000000       0.000000  92.93836 47.01947 ?        ?        0.000000       47.01947 
1 1 1 -21 11 9  o 103.7190 50.72723 -1.026715      6.805603      1.310181       8.056272      -6.849848      12.71724  112.5732 55.08604 109.7311 55.77913 2.842026       78.39504 
1 1 1 -21 11 10 o 159.7717 65.75760 13.77982       6.572894      10.79627       7.633310      22.33624       12.92684  136.5386 62.77390 142.2347 69.63818 -5.696106      93.75520 
1 1 1 -21 11 11 o 139.0537 60.17115 10.22632       5.973352      6.025821       7.466404      17.69546       9.956264  116.6663 56.11725 139.5931 66.50828 -22.92682      87.02010 
1 1 1 -21 12 1  o 118.3812 54.87346 0.5210691      6.007462      -7.761845      7.186511      19.73683       10.94600  101.7642 50.23322 197.4078 83.31151 -95.64354      97.28403 
1 1 1 -21 12 2  o 133.9149 59.60780 4.093351       6.247555      4.661820       7.267749      2.484122       12.22801  138.4900 62.73820 140.6255 68.60855 -2.135498      92.96889 
1 1 1 -21 12 3  o 125.8938 56.68640 3.047904       5.829649      0.9633430      8.025192      5.376831       8.482543  125.4296 59.74665 140.3774 65.11726 -14.94781      88.37375 
1 1 1 -21 12 4  o 162.0605 64.15205 9.535943       5.992140      5.362123       8.177889      14.37462       8.805169  137.3640 63.79511 173.0543 73.93952 -35.69025      97.65690 
1 1 1 -21 12 5  o 99.81312 48.38971 -2.999409      5.824846      -3.750284      7.900306      -2.105063      8.622092  109.1984 53.66239 115.5879 56.65157 -6.389473      78.03238 
1 1 1 -21 12 6  o 100.5396 48.77102 -2.492556      5.940763      2.926028       8.134978      -8.684396      8.696077  124.0462 59.37874 101.9660 51.11192 22.08021       78.34707 
1 1 1 -21 12 7  o 88.43834 44.04877 -7.069060      6.016636      -4.555774      8.232256      -9.950920      8.815246  104.9365 52.14386 98.79713 49.77892 6.139351       72.08968 
1 1 1 -21 12 8  o 110.3748 52.41480 1.693740       6.082746      -1.117776      8.293186      4.967336       8.948776  109.2819 53.94757 123.4709 59.88635 -14.18903      80.60220 
1 1 1 -21 12 9  o 82.93980 41.78477 -9.263564      6.202222      -3.248642      7.550857      -21.73827      10.87418  100.3254 49.86741 91.10127 46.72639 9.224174       68.33823 
1 1 1 -21 13 3  o 166.9914 64.59211 10.07650       5.958248      12.71182       8.070288      6.918904       8.833858  170.1015 71.64789 143.6008 66.55573 26.50069       97.79103 
1 1 1 -21 13 4  o 108.7321 51.67790 -0.5462087     5.936994      -1.420609      7.942932      0.5607688      8.937067  115.2916 56.03423 123.1837 59.77001 -7.892075      81.92856 
1 1 1 -20 0  1  o 103.3449 70.83270 -4.808171      9.095146      -4.808171      9.095146      -4.808171      9.095146  103.3449 70.83270 103.3449 70.83270 0.000000       0.000000 
1 1 1 -20 0  2  o 256.7739 129.4095 22.96985       15.94738      22.96985       15.94738      22.96985       15.94738  256.7739 129.4095 256.7739 129.4095 -0.000000      0.000000 
1 1 1 -20 0  3  o 94.66439 66.70047 -9.865951      9.690776      -9.865951      9.690776      -9.865951      9.690776  94.66439 66.70047 94.66439 66.70047 0.000000       0.000000 
1 1 1 -20 0  4  o 145.3870 89.57533 4.648973       9.868276      4.648973       9.868276      4.648973       9.868276  145.3870 89.57533 145.3870 89.57533 -0.000000      0.000000 
1 1 1 -20 0  5  o 127.1072 85.39757 -2.661182      11.94194      -2.661182      11.94194      -2.661182      11.94194  127.1072 85.39757 127.1072 85.39757 0.000000       0.000000 
1 1 1 -20 0  6  o 266.0308 121.0171 23.02499       13.54388      23.02499       13.54388      23.02499       13.54388  266.0308 121.0171 266.0308 121.0171 0.000000       0.000000 
1 1 1 -20 0  7  o 134.7654 90.07600 -1.786445      12.98332      -1.786445      12.98332      -1.786445      12.98332  134.7654 90.07600 134.7654 90.07600 0.000000       0.000000 
1 1 1 -20 0  8  o 556.5017 54.04133 64.14056       11.42652      64.14056       11.42652      64.14056       11.42652  556.5017 54.04133 556.5017 54.04133 -0.000000      0.000000 
1 1 1 -20 0  9  o 159.9265 96.04833 7.067652       10.74098      7.067652       10.74098      7.067652       10.74098  159.9265 96.04833 159.9265 96.04833 0.000000       0.000000 
1 1 1 -20 0  10 o 152.5165 94.68785 5.373080       11.23671      5.373080       11.23671      5.373080       11.23671  152.5165 94.68785 152.5165 94.68785 0.000000       0.000000 
1 1 1 -20 0  11 o 128.4927 84.39986 0.3922370      10.61324      0.3922370      10.61324      0.3922370      10.61324  128.4927 84.39986 128.4927 84.39986 0.000000       0.000000 
1 1 1 -20 0  12 o 168.5179 99.84478 8.807866       11.31187      8.807866       11.31187      8.807866       11.31187  168.5179 99.84478 168.5179 99.84478 0.000000       0.000000 
1 1 1 -20 0  13 o 105.5921 76.31153 -25.05436      16.25685      -25.05436      16.25685      -25.05436      16.25685  105.5921 76.31153 105.5921 76.31153 -0.000000      0.000000 
1 1 1 -20 0  14 o 74.83740 55.61945 -53.76498      14.71160      -53.76498      14.71160      -53.76498      14.71160  74.83740 55.61945 74.83740 55.61945 0.000000       0.000000 
1 1 1 -20 0  15 o 71.11554 52.19526 -23.65398      9.585809      -23.65398      9.585809      -23.65398      9.585809  71.11554 52.19526 71.11554 52.19526 -0.000000      0.000000 
1 1 1 -20 0  16 o 232.4288 102.6262 17.98763       9.736740      17.98763       9.736740      17.98763       9.736740  232.4288 102.6262 232.4288 102.6262 0.000000       0.000000 
1 1 1 -20 0  17 o 87.37971 61.76195 -8.180152      8.523775      -8.180152      8.523775      -8.180152      8.523775  87.37971 61.76195 87.37971 61.76195 0.000000       0.000000 
1 1 1 -20 0  18 o 82.41422 58.95365 -10.76167      8.658033      -10.76167      8.658033      -10.76167      8.658033  82.41422 58.95365 82.41422 58.95365 -0.000000      0.000000 
1 1 1 -20 0  19 o 97.40127 66.73142 -2.778340      8.054179      -2.778340      8.054179      -2.778340      8.054179  97.40127 66.73142 97.40127 66.73142 0.000000       0.000000 
1 1 1 -20 0  20 o 85.46455 60.57777 -7.919551      8.394598      -7.919551      8.394598      -7.919551      8.394598  85.46455 60.57777 85.46455 60.57777 0.000000       0.000000 
1 1 1 -20 1  1  o 257.5949 76.84574 17.39194       8.270044      16.44690       9.365880      20.73641       17.61913  245.3369 82.82778 250.7800 105.7599 -5.443161      134.3340 
1 1 1 -20 1  2  o 124.1985 57.72111 -3.131597      6.713614      -9.522609      9.690885      2.766351       9.309559  130.3396 63.00097 166.4770 73.49608 -36.13744      96.80286 
1 1 1 -20 1  3  o 307.9755 71.02908 24.03287       8.321918      28.16791       13.85142      21.69720       10.41020  290.5407 100.6566 272.5794 87.08805 17.96124       133.1017 
1 1 1 -20 1  4  o 146.0984 68.82368 -3.731737      10.09892      0.000000       0.000000      -3.731737      10.09892  ?        ?        146.0984 68.82368 0.000000       68.82368 
1 1 1 -20 1  5  o 178.2658 72.09845 7.291012       7.736277      5.530713       12.00630      8.540745       10.11636  181.6789 81.61941 189.3910 80.01900 -7.712082      114.3012 
1 1 1 -20 1  6  o 433.1668 56.85814 44.56303       9.333764      62.91330       14.02005      29.95577       12.50872  480.5351 77.78545 296.0816 95.55455 184.4534       123.2122 
1 1 1 -20 1  7  o 115.2214 56.18906 -8.919701      8.175540      -7.027920      10.80734      -11.45068      12.50051  136.8890 66.25456 137.3063 67.48047 -0.4172974     94.56892 
1 1 1 -20 1  8  o 149.3034 67.43360 2.450125       8.323640      -8.481976      10.69368      19.25458       13.25830  131.1072 64.00776 220.0565 92.21606 -88.94936      112.2533 
1 1 1 -20 1  9  o 119.1222 57.18123 -4.690450      7.662128      6.400949       10.98658      -15.19352      10.69123  167.8870 76.47504 117.2919 58.46765 50.59505       96.26473 
1 1 1 -20 1  10 o 117.5006 56.64837 -4.706570      7.712565      2.280908       10.92598      -11.64624      10.88854  151.1366 71.31559 121.7739 60.41795 29.36266       93.46786 
1 1 1 -20 1  11 o 220.4268 75.09010 16.90350       7.698393      28.77690       11.02476      5.604853       10.75461  260.3170 89.82251 155.2401 72.44971 105.0769       115.3995 
1 1 1 -20 1  12 o 178.2131 75.77249 13.03610       9.165543      10.33195       11.15285      18.66199       16.08668  163.4136 75.40108 176.5078 84.21842 -13.09424      113.0401 
1 1 1 -20 1  13 o 113.4541 57.04086 -12.12082      11.24392      5.506387       17.47395      -24.57677      14.68885  146.9027 73.46142 113.2206 57.77287 33.68217       93.45740 
1 1 1 -20 1  14 o 138.2583 66.94463 6.241701       11.06184      13.24587       16.14584      0.4565753E-01  15.18586  147.9007 73.41315 131.8521 66.29057 16.04865       98.91376 
1 1 1 -20 1  15 o 149.4673 67.04671 11.24849       8.069317      20.72939       14.98713      7.378032       9.575790  149.9553 73.73541 133.6144 64.08114 16.34090       97.68983 
1 1 1 -20 1  16 o 127.3044 58.63568 6.807804       6.701619      2.426005       9.524160      11.10481       9.431559  115.7506 57.26529 134.7969 64.36351 -19.04630      86.15089 
1 1 1 -20 1  17 f 99.90072 48.83759 0.3009311      6.286647      9.300251       8.764690      -9.235018      9.022225  122.6759 59.44571 92.66785 47.09299 30.00806       75.83892 
1 1 1 -20 1  18 o 78.97162 39.98975 -8.099118      6.123348      -5.328753      8.317240      -11.37792      9.048324  90.82548 46.05884 86.45133 44.21317 4.374146       63.84529 
1 1 1 -20 1  19 o 105.3512 50.47383 6.128031       5.906698      7.395051       7.759903      4.382655       9.107706  104.7801 51.81116 98.83784 49.89847 5.942276       71.93229 
1 1 1 -20 1  20 o 85.14451 42.62084 -0.5156245E-02 5.950078      2.410028       8.137452      -2.779993      8.722321  90.87079 46.02466 85.62888 43.76135 5.241905       63.50846 
1 1 1 -20 2  1  o 202.8171 73.12518 10.13653       7.367366      31.08578       12.00245      -2.528590      9.332339  329.6902 90.83696 147.6260 68.41656 182.0642       113.7197 
1 1 1 -20 2  2  o 168.9067 70.16928 5.060313       7.581598      -4.211416      12.10894      11.03867       9.723363  158.6214 74.91759 208.0320 81.91953 -49.41058      111.0111 
1 1 1 -20 2  3  o 219.2602 73.77563 12.62404       7.430326      9.633978       11.38802      14.84056       9.804926  200.8360 84.87949 228.7301 84.06810 -27.89409      119.4654 
1 1 1 -20 2  4  o 118.1687 56.69211 -6.725558      7.508511      -18.56669      11.56224      1.909764       9.873806  124.4937 61.85084 162.7509 73.48180 -38.25722      96.04739 
1 1 1 -20 2  5  o 300.9449 84.70426 26.66119       10.31817      0.000000       0.000000      26.66119       10.31817  ?        ?        300.9449 84.70426 0.000000       84.70426 
1 1 1 -20 2  6  o 415.2110 67.81787 44.07267       10.55797      0.000000       0.000000      44.07267       10.55797  ?        ?        415.2110 67.81787 0.000000       67.81787 
1 1 1 -20 2  7  o 129.1854 60.77023 -2.800452      7.822919      5.200727       10.23926      -14.01969      12.12476  169.1563 75.72673 130.7802 64.68512 38.37608       99.59268 
1 1 1 -20 2  8  o 202.1303 77.21954 12.72661       8.442885      11.81981       10.93680      14.06403       13.28210  192.7086 82.37272 199.2883 87.89439 -6.579620      120.4603 
1 1 1 -20 2  9  o 240.1322 78.81278 18.90199       8.491891      18.83339       10.81044      19.01254       13.72254  221.3277 86.61390 209.3257 90.88924 12.00203       125.5501 
1 1 1 -20 2  10 o 146.7444 65.22556 4.089839       7.454311      -0.1020670     10.82948      7.864390       10.27624  144.2918 68.91699 166.9635 75.21259 -22.67172      102.0122 
1 1 1 -20 2  11 o 234.4963 76.04250 19.13149       7.914620      16.45256       11.08240      21.92005       11.30690  192.7223 82.66283 216.6683 87.32660 -23.94598      120.2459 
1 1 1 -20 2  12 o 131.6498 63.01593 0.2981559      9.160060      3.848253       11.19331      -6.899827      15.93836  145.2597 69.56450 137.0537 68.76865 8.205978       97.81792 
1 1 1 -20 2  13 o 123.7677 59.95992 -0.8068005     8.903218      -16.36158      10.77011      32.76397       15.82227  106.0177 53.61036 196.8991 90.47004 -90.88142      105.1613 
1 1 1 -20 2  14 o 110.2364 54.61853 -5.035698      8.783790      15.15354       16.52075      -12.99207      10.37116  149.1493 74.07165 104.9131 52.99902 44.23621       91.07967 
1 1 1 -20 2  15 o 124.0417 59.61774 3.959592       8.387316      14.68559       15.21251      -0.7248735     10.05338  140.1345 69.83656 116.8083 57.97129 23.32621       90.76242 
1 1 1 -20 2  16 o 97.93191 48.04993 -2.041543      6.255950      -7.224642      8.380834      4.480674       9.401347  96.92873 48.79922 118.9967 58.48988 -22.06792      76.17368 
1 1 1 -20 2  17 o 87.10057 43.60812 -5.334695      6.242517      0.7405904      8.391869      -12.86139      9.340659  104.6409 52.10298 89.65345 45.77470 14.98749       69.35448 
1 1 1 -20 2  18 o 87.54144 43.60482 -2.493441      5.899811      0.7955190      7.888876      -6.667542      8.887249  98.39394 49.22719 90.40050 46.01852 7.993439       67.38709 
1 1 1 -20 2  19 o 85.91774 42.90250 -1.360182      5.862828      -7.261927      7.553951      7.580517       9.297574  82.22970 41.91165 102.6690 51.65238 -20.43925      66.51733 
1 1 1 -20 2  20 o 95.64380 46.82894 4.795994       5.847135      12.49368       7.808608      -5.029377      8.822018  107.8323 53.06146 83.54256 42.79680 24.28970       68.16953 
1 1 1 -20 3  1  o 138.7777 64.27610 -2.654021      8.218317      -6.321422      11.43199      1.268393       11.82277  149.9689 71.40079 173.3456 79.10488 -23.37677      106.5629 
1 1 1 -20 3  2  o 133.1605 61.37032 -2.137505      7.356448      1.710417       11.57844      -4.742355      9.526387  172.3885 78.51874 140.9706 66.54090 31.41791       102.9217 
1 1 1 -20 3  3  o 185.9433 72.12182 8.183067       7.444322      16.08177       11.92871      3.144520       9.527264  230.5523 90.75193 166.9054 73.98404 63.64690       117.0878 
1 1 1 -20 3  4  o 136.0963 61.57520 -0.2587606     6.975093      -21.07255      9.697586      22.05019       10.03986  107.3335 53.82636 272.6100 85.33327 -165.2765      100.8913 
1 1 1 -20 3  5  o 126.9845 59.05906 -2.417603      7.049096      5.668115       10.31015      -9.514952      9.659483  176.0868 77.56178 126.7553 61.64910 49.33154       99.07795 
1 1 1 -20 3  6  o 449.4433 44.64038 44.88044       7.688588      34.64360       11.21884      53.94653       10.55785  340.6715 85.05798 472.4326 58.81863 -131.7611      103.4142 
1 1 1 -20 3  7  o 176.0494 74.15414 7.725689       8.644937      23.59815       17.26354      2.413305       9.987396  227.9660 100.3914 157.7133 72.24824 70.25272       123.6861 
1 1 1 -20 3  8  o 307.2459 72.06502 26.61467       8.450144      14.90620       11.10309      42.73158       13.02671  205.2042 85.05447 351.3723 93.73325 -146.1681      126.5709 
1 1 1 -20 3  9  o 140.0093 64.75037 0.9518138      8.294641      -3.477291      10.70494      7.606019       13.12122  138.5298 66.77470 172.6790 80.39941 -34.14915      104.5128 
1 1 1 -20 3  10 o 152.1637 66.92383 5.314420       7.650090      -11.19050      10.64439      22.94764       11.00221  120.4774 59.76823 233.0105 88.35596 -112.5331      106.6725 
1 1 1 -20 3  11 o 111.7021 55.33281 -9.642284      8.997231      -27.43728      10.86829      29.11267       16.03895  99.26379 50.56479 210.5108 94.47034 -111.2470      107.1515 
1 1 1 -20 3  12 o 120.9140 58.80211 -3.217489      8.781970      -5.389084      10.62777      1.457260       15.59308  124.0345 61.20038 145.8555 72.35503 -21.82101      94.76675 
1 1 1 -20 3  13 o 131.7868 62.84159 2.590790       8.927803      -6.179997      10.86273      20.84675       15.67192  119.4225 59.43299 168.6089 81.15231 -49.18643      100.5882 
1 1 1 -20 3  14 o 159.2232 70.73148 12.63783       8.753741      11.80428       17.46448      12.91751       10.11627  143.1345 71.84275 154.9988 71.62112 -11.86435      101.4444 
1 1 1 -20 3  15 o 147.0559 67.41934 11.88186       8.720600      -4.650129      16.01258      18.85281       10.39788  119.8160 61.06478 162.2189 74.08850 -42.40285      96.01048 
1 1 1 -20 3  16 o 86.01328 43.22950 -8.066872      6.429796      -15.49336      8.519166      1.763075       9.801239  86.90720 44.31442 113.4626 56.46492 -26.55540      71.77782 
1 1 1 -20 3  17 o 94.56564 46.55626 -1.170750      6.036160      3.902347       8.013645      -7.823651      9.176966  109.6662 53.92327 93.84866 47.67316 15.81749       71.97533 
1 1 1 -20 3  18 o 98.11984 47.67822 2.190392       5.742447      -1.575208      7.427320      7.786459       9.054335  93.20232 46.79037 109.5833 54.49141 -16.38095      71.82376 
1 1 1 -20 3  19 o 86.46780 43.00142 -0.6413229     5.644497      4.393716       7.417537      -7.567985      8.700021  98.41752 49.00107 84.52544 43.23840 13.89208       65.35032 
1 1 1 -20 3  20 o 83.79722 42.01289 -0.4328114     5.889843      2.518124       7.766580      -4.426982      9.035731  90.37444 45.67935 84.09953 43.09805 6.274918       62.80163 
1 1 1 -20 4  1  o 417.9048 43.72857 37.61194       6.991838      46.26277       9.766889      28.51849       10.01363  448.9008 57.33406 327.6936 79.49778 121.2072       98.01577 
1 1 1 -20 4  2  o 133.1859 60.25895 -0.6712868     6.680250      5.491862       9.212910      -7.504122      9.700541  176.4749 75.52248 134.2948 64.43124 42.18011       99.27250 
1 1 1 -20 4  3  o 137.4994 62.39655 -0.4896978     7.226277      1.664753       9.173750      -4.012188      11.73015  158.5184 71.26808 154.4952 73.19814 4.023193       102.1622 
1 1 1 -20 4  4  o 267.6844 68.52603 18.51838       7.154042      31.51754       10.30982      6.446602       9.935261  337.8408 79.84368 179.6516 77.67006 158.1892       111.3896 
1 1 1 -20 4  5  o 279.3239 66.59986 20.07958       7.122739      15.57960       10.12899      24.48155       10.01808  223.9406 84.81061 284.7937 84.49146 -60.85316      119.7149 
1 1 1 -20 4  6  o 396.6721 50.69090 36.38444       7.630319      27.53992       10.79512      45.21514       10.78668  293.4407 87.85554 416.3300 69.14021 -122.8892      111.7988 
1 1 1 -20 4  7  o 196.8244 72.75305 11.19558       7.360344      5.317741       11.10343      15.80306       9.830602  169.8857 77.19011 217.9160 83.30666 -48.03024      113.5707 
1 1 1 -20 4  8  o 130.8483 63.22047 -5.503958      9.732918      9.291427       17.75822      -11.85666      11.63631  183.7870 87.91114 128.6093 63.56615 55.17766       108.4851 
1 1 1 -20 4  9  o 327.9311 69.55193 30.45742       8.583097      37.90232       11.31056      20.34926       13.17926  335.3210 86.33755 212.8341 90.68543 122.4869       125.2119 
1 1 1 -20 4  10 o 167.6093 76.46262 8.698080       11.03497      8.698080       11.03497      0.000000       0.000000  167.6093 76.46262 ?        ?        0.000000       76.46262 
1 1 1 -20 4  11 f 139.8773 65.53221 2.519060       8.940866      -0.2726652     10.85104      8.422050       15.77869  138.0716 66.72076 161.8056 78.71857 -23.73395      103.1905 
1 1 1 -20 4  12 o 177.8681 75.13215 13.50279       8.914958      7.194645       10.82822      26.77519       15.70655  151.1210 71.21279 190.6838 88.50789 -39.56279      113.5998 
1 1 1 -20 4  13 o 130.1362 59.77686 3.715029       6.900738      2.395148       9.934846      4.945487       9.592397  132.0921 63.83384 138.0049 65.61892 -5.912720      91.54563 
1 1 1 -20 4  14 o 200.8835 77.01382 20.40002       8.416386      24.79741       15.62974      18.60420       9.988174  161.6372 78.56932 174.1849 76.54272 -12.54771      109.6901 
1 1 1 -20 4  15 o 152.4155 67.84227 12.91082       8.092769      3.873094       14.84244      16.73438       9.654055  125.0736 63.20961 157.5095 71.72455 -32.43597      95.60265 
1 1 1 -20 4  16 o 104.6473 50.84695 0.7227686      6.528463      3.227156       8.572227      -2.735796      10.07374  113.8410 55.93449 106.1849 53.46463 7.656036       77.37657 
1 1 1 -20 4  17 o 129.7688 58.40956 9.433699       6.182766      6.759550       8.003077      13.39238       9.737320  115.0165 55.98006 125.9770 61.40938 -10.96046      83.09560 
1 1 1 -20 4  18 o 102.9756 49.58914 4.050896       5.870437      3.389660       7.589971      5.035425       9.261385  101.4075 50.33523 104.0784 52.25027 -2.670868      72.55154 
1 1 1 -20 4  19 o 83.92770 41.96706 -1.730141      5.698946      -7.651412      7.418508      6.795690       8.901792  80.67126 41.15429 100.6073 50.60535 -19.93604      65.22712 
1 1 1 -20 5  1  o 128.2955 58.16209 -0.9784931     6.259230      -2.937197      8.578608      1.251320       9.153068  139.4733 64.96230 158.2490 71.16348 -18.77567      96.35529 
1 1 1 -20 5  2  o 234.8137 67.86198 14.07722       6.537116      29.89758       9.176976      -2.220177      9.314309  342.8574 71.24832 145.9705 67.88895 196.8869       98.41358 
1 1 1 -20 5  3  o 306.2448 58.62949 22.33543       6.718926      28.38832       9.651206      16.64291       9.359501  323.5381 77.77296 238.2794 82.73031 85.25870       113.5471 
1 1 1 -20 5  4  o 329.3417 62.69258 26.69142       7.725550      27.63068       9.942773      25.26041       12.27254  311.0396 81.37602 272.5004 94.72704 38.53922       124.8810 
1 1 1 -20 5  5  f 219.4149 74.53196 13.67431       7.584164      18.08735       10.08543      7.930941       11.50558  237.6644 85.57330 185.0580 81.70226 52.60631       118.3133 
1 1 1 -20 5  6  o 127.6510 59.90121 -2.613657      7.522155      -7.062630      10.84202      1.515412       10.44495  136.6803 66.20375 157.1583 72.67387 -20.47801      98.30782 
1 1 1 -20 5  7  o 94.74924 47.41673 -15.11665      7.342772      -10.03945      10.47058      -20.02978      10.30001  126.6928 62.16169 109.4678 54.97619 17.22500       82.98468 
1 1 1 -20 5  8  o 116.4805 57.18309 -9.378328      8.899865      -8.206964      10.50809      -12.35090      16.73957  128.4418 62.86411 146.9514 73.23763 -18.50958      96.51760 
1 1 1 -20 5  9  o 121.1794 60.16592 -12.06647      10.87339      -12.06647      10.87339      0.000000       0.000000  121.1794 60.16592 ?        ?        0.000000       60.16592 
1 1 1 -20 5  10 o 193.3773 91.06699 22.87577       17.65611      22.87577       17.65611      0.000000       0.000000  193.3773 91.06699 ?        ?        0.000000       91.06699 
1 1 1 -20 5  11 o 141.6458 70.65171 -4.016415      15.71474      0.000000       0.000000      -4.016415      15.71474  ?        ?        141.6458 70.65171 0.000000       70.65171 
1 1 1 -20 5  12 o 95.01353 47.38103 -10.09897      7.050467      -6.659444      10.16015      -13.29360      9.791779  118.0503 58.53512 106.2445 53.39067 11.80583       79.22704 
1 1 1 -20 5  13 o 101.9844 50.10809 -5.076893      6.878542      7.110573       9.488366      -18.57673      9.986170  142.2781 66.92851 98.01925 49.78559 44.25886       83.41482 
1 1 1 -20 5  14 o 103.6603 50.60271 -2.666382      6.678712      -5.190102      9.221015      0.1185191      9.686414  109.1075 54.37374 119.8361 58.99329 -10.72856      80.22912 
1 1 1 -20 5  15 o 126.0779 60.33742 6.182261       8.388976      -19.00154      14.43092      19.03657       10.30998  104.6294 53.67639 157.8179 72.70407 -53.18859      90.37166 
1 1 1 -20 5  16 o 105.4605 52.11632 0.2708073      7.811045      -1.063504      13.87806      0.8894774      9.449951  111.0832 56.63470 109.1490 54.49768 1.934174       78.59699 
1 1 1 -20 5  17 o 125.1469 57.01713 8.705567       6.110765      4.056118       7.781530      16.18559       9.869968  107.6097 52.95531 129.4719 62.81907 -21.86217      82.16143 
1 1 1 -20 5  18 o 102.1757 49.54464 4.143896       6.114130      1.631615       7.836846      8.051578       9.773877  97.44062 48.79605 106.8500 53.64656 -9.409409      72.51901 
1 1 1 -20 5  19 o 93.97791 46.23555 2.907548       5.919664      -1.598617      7.845122      8.865507       9.020798  88.24030 44.74621 102.5094 51.47714 -14.26911      68.20644 
1 1 1 -20 6  1  o 153.8249 63.90170 3.875649       6.287400      5.140122       8.732492      2.514551       9.060001  172.1157 73.58857 161.8433 71.92381 10.27238       102.8995 
1 1 1 -20 6  2  o 131.5431 59.16185 -0.1508585     6.328548      -0.1240857     8.632898      -0.1819599     9.304642  148.0597 67.57761 151.8470 69.62489 -3.787277      97.02762 
1 1 1 -20 6  3  o 120.0319 56.17205 -3.192337      6.537903      -2.435278      9.452553      -3.886657      9.052405  144.1712 67.49207 137.2693 64.81541 6.901825       93.57466 
1 1 1 -20 6  4  o 322.9264 77.47451 28.97628       9.591619      0.000000       0.000000      28.97628       9.591619  ?        ?        322.9264 77.47451 0.000000       77.47451 
1 1 1 -20 6  5  o 111.0266 53.61018 -6.726881      6.971400      -11.29583      9.985401      -2.382087      9.737374  123.4559 60.59992 143.0271 67.43884 -19.57116      90.66613 
1 1 1 -20 6  6  o 206.7531 76.38734 12.92699       8.112183      14.36843       10.20882      10.45756       13.36216  208.7554 83.38557 189.9731 85.65408 18.78238       119.5398 
1 1 1 -20 6  7  o 270.9533 80.51531 23.30125       9.091908      29.21461       10.68764      7.814269       17.29611  293.7115 87.29950 181.2240 86.70480 112.4875       123.0403 
1 1 1 -20 6  8  o 138.1602 64.80238 -0.2003107     8.785922      1.088637       10.76359      -2.773782      15.20896  149.7068 70.68454 154.3460 75.56098 -4.639191      103.4687 
1 1 1 -20 6  9  o 183.4976 81.14737 12.83423       11.39585      12.83423       11.39585      0.000000       0.000000  183.4976 81.14737 ?        ?        0.000000       81.14737 
1 1 1 -20 6  10 o 194.1356 82.75526 16.90068       10.98397      16.90068       10.98397      0.000000       0.000000  194.1356 82.75526 ?        ?        0.000000       82.75526 
1 1 1 -20 6  11 o 205.0390 74.57106 16.02943       7.685724      23.25592       11.27699      9.761140       10.50277  211.8895 86.54371 160.9818 73.87176 50.90773       113.7842 
1 1 1 -20 6  12 o 158.2147 69.29241 9.804821       8.125327      16.01811       15.02946      7.238842       9.658490  162.2397 78.42932 146.8657 68.58066 15.37404       104.1848 
1 1 1 -20 6  13 o 146.4674 63.44882 7.964859       6.656477      5.429709       8.886459      11.20570       10.04745  135.0872 63.91774 151.4989 70.47681 -16.41168      95.14441 
1 1 1 -20 6  14 o 110.3139 52.45589 0.8443108      6.131950      1.887271       8.147478      -0.5182790     9.312622  118.8617 57.52864 116.1002 57.28611 2.761444       81.18646 
1 1 1 -20 6  15 o 210.5978 76.21207 24.25673       8.013268      25.38553       13.23363      23.60323       10.06910  152.4727 73.68051 172.0883 76.18091 -19.61555      105.9828 
1 1 1 -20 6  16 o 112.3991 55.05018 4.134371       8.099490      -14.23810      13.73532      13.92872       10.02866  99.91253 51.31986 131.1159 63.54821 -31.20335      81.68294 
1 1 1 -20 6  17 o 111.0313 52.89001 5.628414       6.290044      -3.005916      7.934659      20.23096       10.31878  94.04122 47.36285 133.4822 64.63813 -39.44100      80.13319 
1 1 1 -20 6  18 o 128.1208 58.00439 11.78041       6.201152      5.381006       8.195786      20.34983       9.484103  102.6981 51.19269 128.4658 62.15071 -25.76772      80.51958 
1 1 1 -20 6  19 o 99.71658 48.87840 5.691924       6.424216      19.83673       8.691386      -11.34251      9.537935  123.4925 59.68469 81.74609 42.01111 41.74643       72.98764 
1 1 1 -20 7  1  o 159.1862 64.53693 4.923432       6.214725      -11.05522      8.552608      22.79896       9.046029  115.9621 56.74718 286.7423 78.80078 -170.7802      97.10719 
1 1 1 -20 7  2  o 99.32388 48.70753 -9.596931      6.401908      -2.723641      9.012406      -16.59754      9.095498  140.5121 65.81822 109.1426 54.32796 31.36948       85.34380 
1 1 1 -20 7  3  o 228.2173 70.23553 14.07135       6.834182      11.20679       9.404811      17.27639       9.948037  199.8625 79.96323 234.9825 84.93417 -35.12007      116.6530 
1 1 1 -20 7  4  o 202.0603 77.39194 11.81387       8.494249      14.57766       9.772774      3.275435       17.17728  215.8536 82.93225 181.9670 86.87946 33.88666       120.1074 
1 1 1 -20 7  5  f 200.3538 77.32855 12.00888       8.525205      8.158328       9.879586      23.23581       16.86971  179.6018 77.55057 227.7436 99.79094 -48.14185      126.3817 
1 1 1 -20 7  6  o 167.1833 72.56181 6.441805       8.739312      6.863103       10.39979      5.429321       16.12220  171.9696 76.69958 177.0011 84.41436 -5.031525      114.0553 
1 1 1 -20 7  7  o 167.8883 72.98978 7.221343       8.872210      2.057360       10.65522      18.89614       16.02119  153.4864 71.79058 203.8725 92.66680 -50.38608      117.2221 
1 1 1 -20 7  8  o 154.7012 72.38315 3.493484       10.84750      3.493484       10.84750      0.000000       0.000000  154.7012 72.38315 ?        ?        0.000000       72.38315 
1 1 1 -20 7  9  o 120.0335 57.31914 -2.653975      7.483378      11.60300       10.66187      -16.49724      10.50604  176.8626 78.33807 110.6861 55.57909 66.17649       96.05148 
1 1 1 -20 7  10 o 155.9795 67.76154 7.376168       7.635292      -0.6852957     10.44164      16.64016       11.19338  135.1874 65.35664 188.2047 81.90321 -53.01730      104.7837 
1 1 1 -20 7  11 o 143.6179 65.13557 5.641119       7.860115      -1.976178      10.04530      17.66890       12.62279  127.1342 62.06123 177.4026 81.25137 -50.26839      102.2418 
1 1 1 -20 7  12 o 153.0762 65.34641 8.637239       6.866583      0.4453418      9.202788      18.92583       10.31348  125.6613 60.89744 184.1919 79.38445 -58.53064      100.0519 
1 1 1 -20 7  13 o 162.0449 69.35485 12.46956       7.771138      1.364522       12.95248      18.71527       9.713677  128.2967 64.01707 177.0610 76.67424 -48.76436      99.88556 
1 1 1 -20 7  14 o 84.04900 42.14645 -8.685522      5.940243      -8.509028      7.705130      -8.944124      9.326809  94.79961 47.60131 101.0653 50.95722 -6.265717      69.73180 
1 1 1 -20 7  15 o 113.6625 55.23455 3.089220       7.710484      21.81756       12.91349      -7.286912      9.611958  143.0015 69.92626 100.0658 50.60601 42.93568       86.31715 
1 1 1 -20 7  16 o 130.8677 61.47317 11.73801       7.956435      34.27903       12.83012      -2.347420      10.14213  155.0184 74.30106 102.4236 51.82024 52.59477       90.58689 
1 1 1 -20 7  17 o 91.07229 45.30579 -1.520676      6.286372      8.166874       8.388730      -13.92938      9.494070  112.4529 55.26871 85.48555 43.83302 26.96731       70.54052 
1 1 1 -20 7  18 o 137.2450 61.25079 15.30137       6.643500      15.74545       9.040716      14.78006       9.795234  118.7767 58.17106 113.9085 56.64785 4.868210       81.19637 
1 1 1 -20 8  1  o 271.4806 72.50022 19.78292       7.787911      21.89942       8.857531      12.57291       16.34825  278.5734 78.50575 208.5443 94.31866 70.02916       122.7158 
1 1 1 -20 8  2  o 247.0935 75.55383 17.24405       7.922984      20.78915       9.003325      5.074258       16.68131  266.1757 80.35619 187.6401 88.41150 78.53557       119.4726 
1 1 1 -20 8  3  o 184.5358 73.94621 8.920648       8.056417      8.724837       9.243880      9.539296       16.43083  184.3407 77.10568 194.7340 90.43495 -10.39330      118.8435 
1 1 1 -20 8  4  o 197.4012 76.92774 11.45509       8.500387      12.84892       9.949925      7.689308       16.35467  202.8488 81.86195 186.8465 87.88586 16.00223       120.1054 
1 1 1 -20 8  5  o 212.1058 77.94296 14.15406       8.427638      20.92327       10.08682      -1.497048      15.33762  246.6752 85.87106 162.8533 78.84738 83.82193       116.5794 
1 1 1 -20 8  6  o 320.1504 73.07255 29.41424       8.885022      27.28081       10.64421      34.31653       16.13515  278.3216 87.97048 258.9197 104.3316 19.40192       136.4694 
1 1 1 -20 8  7  f 149.3168 67.89160 3.412653       8.608546      -0.9008551     10.29945      13.41093       15.68056  142.1216 67.69415 185.8231 86.97086 -43.70154      110.2108 
1 1 1 -20 8  8  o 97.40028 48.34288 -10.67867      6.996349      -3.679388      10.17026      -16.96673      9.639706  132.1374 64.03162 105.6799 53.08889 26.45753       83.17739 
1 1 1 -20 8  9  o 153.3291 67.51971 6.426406       7.808133      4.890721       10.28538      8.515241       11.99558  150.9562 70.58379 162.6471 76.10613 -11.69093      103.7989 
1 1 1 -20 8  10 o 219.1485 76.75846 18.58545       8.065499      2.943310       9.979128      48.05362       13.69686  140.4282 66.81712 310.1200 99.97977 -169.6918      120.2517 
1 1 1 -20 8  11 o 101.2631 50.23143 -8.089507      7.511612      -0.5446243     9.394757      -21.46114      12.50696  126.0687 61.19549 108.0393 54.95801 18.02937       82.25127 
1 1 1 -20 8  12 o 122.4900 57.00230 2.543821       6.582155      4.913821       8.695407      -0.6365597     10.07292  134.0775 63.37447 123.2798 60.58456 10.79770       87.67447 
1 1 1 -20 8  13 o 122.3620 56.58973 3.772069       6.335923      1.815215       8.195513      6.679117       9.989026  119.5621 57.82655 132.8814 64.16523 -13.31930      86.37759 
1 1 1 -20 8  14 o 84.73552 42.47943 -8.091102      6.014479      -7.178654      7.767910      -9.456914      9.503765  95.88737 48.09843 99.47143 50.30718 -3.584053      69.60080 
1 1 1 -20 8  15 o 125.8262 58.82641 7.877518       7.140499      13.51551       10.97027      3.733025       9.405696  130.3254 63.88015 113.9803 56.48164 16.34508       85.26927 
1 1 1 -20 8  16 o 111.3950 54.12787 5.326017       7.400245      9.150016       11.41739      2.555710       9.717886  114.9377 57.74469 106.4587 53.45599 8.479004       78.68922 
1 1 1 -20 8  17 o 81.21472 41.10936 -7.006623      6.430170      -4.637747      8.825948      -9.686388      9.387254  91.58452 46.54602 87.80666 44.91663 3.777863       64.68412 
1 1 1 -20 8  18 o 114.1624 54.43105 9.969941       6.693819      3.208210       9.185338      17.62792       9.775146  96.95175 49.08160 117.0638 57.93271 -20.11201      75.92893 
1 1 1 -20 9  1  o 223.7045 74.76284 14.22130       7.629999      8.635057       8.761800      31.75093       15.52099  184.5055 75.92751 277.8151 105.0398 -93.30959      129.6085 
1 1 1 -20 9  2  o 142.0396 64.47768 0.7306973      7.724324      3.219986       8.902018      -6.854508      15.53941  158.0181 70.68401 158.6110 77.37434 -0.5928650     104.7999 
1 1 1 -20 9  3  o 220.5987 76.32993 14.59942       7.964057      11.69795       9.506331      21.42945       14.58530  196.9693 79.83126 228.7812 96.33975 -31.81184      125.1175 
1 1 1 -20 9  4  o 184.7997 73.82459 9.747575       8.002899      8.645376       9.608616      12.24383       14.46024  179.1103 76.90138 193.4203 87.96259 -14.30998      116.8385 
1 1 1 -20 9  5  o 317.7268 57.46869 25.32011       6.830064      36.89160       10.12327      15.65147       9.253559  356.8310 75.41220 214.1346 81.07098 142.6964       110.7226 
1 1 1 -20 9  6  f 200.2079 70.60447 12.26528       6.831737      6.949543       9.898325      17.10114       9.440964  166.1953 74.42440 217.4303 81.99118 -51.23500      110.7319 
1 1 1 -20 9  7  o 211.1721 71.00861 14.12940       6.883375      18.55674       9.967387      10.09286       9.517324  216.8227 83.63377 175.1583 75.87279 41.66438       112.9216 
1 1 1 -20 9  8  o 104.1919 51.12154 -7.390936      7.081505      -1.848048      10.24704      -12.45825      9.797592  134.3982 64.91951 112.0147 55.85832 22.38350       85.64283 
1 1 1 -20 9  9  o 189.9271 71.68694 13.03955       7.221372      11.94040       10.17729      14.15407       10.24820  171.2507 76.16122 179.9781 78.34618 -8.727463      109.2642 
1 1 1 -20 9  10 o 205.9128 74.76814 16.88015       7.721908      6.824622       9.301308      39.18095       13.85166  148.0340 68.49865 247.3760 97.65991 -99.34203      119.2876 
1 1 1 -20 9  11 f 153.6547 66.42561 9.054405       7.265697      15.93022       8.879663      -4.875127      12.63871  180.2125 75.49079 124.5437 62.30987 55.66884       97.88452 
1 1 1 -20 9  12 o 118.9586 55.72917 2.293515       6.464661      10.90378       8.368542      -10.44835      10.18024  151.7547 68.16125 105.9818 53.41093 45.77297       86.59494 
1 1 1 -20 9  13 o 146.5723 62.29286 9.264022       6.189752      -1.051390      7.942523      25.21898       9.877864  109.8913 53.96280 192.8182 80.09753 -82.92696      96.57948 
1 1 1 -20 9  14 o 137.6736 60.07705 8.748328       6.058615      4.254716       7.663508      16.23820       9.893892  117.5663 56.62634 145.9704 68.56200 -28.40415      88.92295 
1 1 1 -20 9  15 o 143.4850 64.64483 13.91263       7.594342      17.51373       11.18032      10.82777       10.34795  133.5480 65.25310 123.2886 60.74737 10.25935       89.15273 
1 1 1 -20 9  16 o 132.8242 61.36035 13.07993       7.418848      -2.136759      11.23281      24.85326       9.880479  100.5467 51.23540 149.8751 69.77718 -49.32841      86.56744 
1 1 1 -20 9  17 o 121.8862 58.05720 12.44304       7.576673      28.74262       12.29170      2.454861       9.622041  128.6143 63.87650 99.51515 50.36329 29.09915       81.34290 
1 1 1 -20 10 1  o 122.6599 55.54208 -0.2644491     5.688805      -7.270447      7.503233      9.207958       8.724562  113.7165 55.07928 184.6946 75.85760 -70.97810      93.74488 
1 1 1 -20 10 2  o 144.4003 61.63648 3.448361       6.107911      8.822504       8.848082      -1.443811      8.442000  180.9379 75.53852 136.7013 63.92744 44.23654       98.95850 
1 1 1 -20 10 3  o 98.05572 47.93030 -7.812304      6.050204      -1.486154      8.669442      -13.81861      8.447438  136.6455 64.18124 105.8577 52.63795 30.78788       83.00594 
1 1 1 -20 10 4  o 137.3859 60.49678 2.466419       6.267745      -6.622451      9.206470      10.31814       8.556982  124.7118 60.54657 184.3172 75.34686 -59.60536      96.65939 
1 1 1 -20 10 5  o 149.7880 64.10339 4.811316       6.637821      10.53809       9.445380      -0.7767278     9.330272  181.2703 76.99290 138.7104 65.58973 42.55989       101.1431 
1 1 1 -20 10 6  o 163.2394 66.12482 7.468505       6.518441      4.917593       9.446100      9.787533       9.006535  154.7259 70.64687 174.4660 74.66753 -19.74011      102.7921 
1 1 1 -20 10 7  o 114.4777 54.65200 -2.886948      6.794028      9.734823       9.698072      -15.05149      9.520795  169.4725 74.90633 106.7075 53.48751 62.76499       92.04278 
1 1 1 -20 10 8  o 140.0456 62.52090 4.235548       6.927897      3.963383       9.880425      4.498768       9.716680  145.4635 68.38525 146.7589 68.61598 -1.295395      96.87463 
1 1 1 -20 10 9  o 130.5191 59.37723 3.012008       6.596247      0.4528481      8.860261      6.194013       9.879800  129.3530 61.93226 147.6448 69.08076 -18.29182      92.77799 
1 1 1 -20 10 10 o 115.5483 55.44851 -1.025698      7.192437      -2.003832      8.633696      1.192670       13.00213  119.0426 57.98421 135.4274 66.98381 -16.38479      88.59457 
1 1 1 -20 10 11 o 136.0279 61.40129 5.987393       6.889222      9.239079       7.995855      -3.381633      13.57244  148.4620 66.65814 124.9750 62.81079 23.48698       91.58877 
1 1 1 -20 10 12 o 145.5682 66.19791 10.27783       8.188612      10.27783       8.188612      0.000000       0.000000  145.5682 66.19791 ?        ?        0.000000       66.19791 
1 1 1 -20 10 13 o 124.9160 57.59018 5.684174       6.486251      15.82163       7.944013      -14.59059      11.23449  163.5943 70.07275 99.63088 50.81003 63.96345       86.55547 
1 1 1 -20 10 14 o 163.4162 65.49306 14.04157       6.320794      8.312815       8.130031      22.79576       10.05009  125.5930 59.91025 160.3099 73.06984 -34.71691      94.49042 
1 1 1 -20 10 15 o 127.8499 59.52823 10.11572       7.193675      -3.217899      10.60617      21.47530       9.789611  101.4584 51.50924 147.3250 68.87821 -45.86658      86.00820 
1 1 1 -20 10 16 o 116.9627 55.82913 8.626761       7.083737      5.230546       10.33414      11.63690       9.729050  106.2546 53.58187 116.4673 57.66575 -10.21274      78.71693 
1 1 1 -20 11 1  o 243.7975 65.59019 16.07659       6.346053      13.57585       7.342102      23.46328       12.61861  213.4939 73.32198 242.3079 93.92254 -28.81395      119.1535 
1 1 1 -20 11 2  o 105.9092 50.56522 -4.298057      5.818226      -5.359545      8.120965      -3.178583      8.339828  121.3442 58.40709 128.8520 61.24296 -7.507851      84.62912 
1 1 1 -20 11 3  o 349.1386 49.29913 28.92359       6.498466      29.35478       9.285880      28.50972       9.097455  311.4716 77.16467 307.8628 76.44226 3.608734       108.6177 
1 1 1 -20 11 4  o 158.5547 64.63197 6.468603       6.273907      0.5899622E-01  8.486141      14.19520       9.317274  136.8821 64.03812 199.7018 79.69655 -62.81969      102.2371 
1 1 1 -20 11 5  o 114.3664 54.02134 -2.258832      6.299008      2.586227       8.559096      -7.983559      9.303701  143.6543 66.20303 119.0411 58.44536 24.61319       88.31026 
1 1 1 -20 11 6  o 109.4620 52.65417 -4.008521      6.574951      0.3009158      9.304026      -8.307522      9.292755  136.7021 64.89018 116.6721 57.50272 20.02992       86.70235 
1 1 1 -20 11 7  o 93.24251 46.31890 -9.732788      6.476571      -18.69445      9.199062      -0.9245931     9.119958  98.36478 49.71753 130.0625 62.41994 -31.69772      79.80025 
1 1 1 -20 11 8  o 145.1790 62.79821 5.992060       6.501448      10.02381       8.879705      1.333347       9.545194  162.4327 71.74143 134.1062 64.22740 28.32646       96.29118 
1 1 1 -20 11 9  o 254.5464 65.82462 20.82535       6.555430      13.08658       8.946533      29.79735       9.633043  169.9277 73.58477 262.1736 83.77543 -92.24590      111.5035 
1 1 1 -20 11 10 o 110.7874 52.86353 -0.5511340     6.339890      -3.527877      8.151433      4.006591       10.08643  111.3086 54.66061 133.2439 64.37320 -21.93531      84.44933 
1 1 1 -20 11 11 o 104.2652 50.72740 -2.200472      6.554375      -7.128297      7.771805      9.937427       12.19736  99.74049 49.73948 139.8173 68.28217 -40.07678      84.47763 
1 1 1 -20 11 12 o 169.7545 66.43327 13.26703       6.359883      15.68089       7.989649      9.092113       10.50740  166.1225 70.69109 133.2581 64.69281 32.86444       95.82479 
1 1 1 -20 11 13 o 120.1612 55.78840 5.155809       6.246161      -3.378115      8.151753      17.29097       9.720742  101.8393 50.81078 149.7037 69.53496 -47.86440      86.12111 
1 1 1 -20 11 14 o 141.3151 63.11960 12.27579       7.070789      18.02558       8.258405      -3.514583      13.68568  155.6027 68.93214 107.1904 54.78343 48.41229       88.05035 
1 1 1 -20 11 15 o 113.0979 54.70299 6.295018       7.336442      9.457453       11.28796      3.982177       9.653342  114.4229 57.47659 107.6488 53.94448 6.774063       78.82617 
1 1 1 -20 12 1  o 156.6023 63.73775 5.932909       6.089645      4.408679       7.149847      9.959846       11.62141  150.5998 65.49842 180.5124 80.75285 -29.91264      103.9763 
1 1 1 -20 12 2  o 153.2062 64.45891 5.456343       6.520153      0.6725050      7.416453      21.73736       13.68198  134.1192 61.74082 216.7970 92.38701 -82.67781      111.1184 
1 1 1 -20 12 3  o 119.5232 55.14487 -0.4369224     5.963568      -2.047006      8.269045      1.308159       8.608726  128.3902 61.01150 140.5482 65.33373 -12.15805      89.39183 
1 1 1 -20 12 4  o 128.8970 58.04074 1.727831       6.112181      5.540599       8.278520      -2.841203      9.062430  153.4744 68.44251 128.7569 61.90574 24.71751       92.28596 
1 1 1 -20 12 5  o 150.6168 62.46163 6.062695       5.992450      12.11883       8.366696      -0.3162671     8.586797  182.6800 74.57113 131.5131 62.40143 51.16695       97.23576 
1 1 1 -20 12 6  o 88.01836 43.90517 -10.52722      6.072107      -22.50986      8.462631      2.188210       8.717555  88.88622 45.21435 137.0858 64.37877 -48.19962      78.66997 
1 1 1 -20 12 7  o 99.86688 48.64783 -5.022848      6.080667      -10.43631      8.487962      0.6844440      8.715268  104.5050 52.09398 129.8721 61.97294 -25.36716      80.95943 
1 1 1 -20 12 8  o 120.4228 55.58012 1.621409       6.066254      8.702265       8.239522      -6.759711      8.964172  153.2041 68.30454 111.5442 55.25039 41.65992       87.85281 
1 1 1 -20 12 9  f 117.5138 54.58438 1.619633       5.990539      -6.792422      7.703661      14.48757       9.527974  102.8643 50.99889 167.3684 74.09787 -64.50406      89.95210 
1 1 1 -20 12 10 o 202.1443 75.78607 19.81775       8.042740      19.81775       8.042740      0.000000       0.000000  202.1443 75.78607 ?        ?        0.000000       75.78607 
1 1 1 -20 12 11 o 256.2462 69.88322 25.37195       7.146418      25.76557       8.312479      24.25674       13.99166  228.2962 78.02629 157.0887 75.87502 71.20752       108.8353 
1 1 1 -20 12 12 o 87.06728 43.64379 -7.739092      6.340602      -5.876903      8.068012      -10.74702      10.25388  98.67403 49.42788 99.82507 50.67658 -1.151047      70.79005 
1 1 1 -20 12 13 o 86.95219 43.54787 -6.408125      6.248735      2.092843       8.278175      -17.66721      9.526909  110.3381 54.35996 87.96622 45.01757 22.37189       70.58037 
1 1 1 -20 12 14 o 94.91910 46.95042 -1.580826      6.390911      -1.940180      8.245867      -1.040236      10.11369  99.34799 49.79543 103.7606 52.40728 -4.412560      72.29182 
1 1 1 -20 13 1  o 157.7911 65.19881 6.446510       6.495014      4.363926       7.456538      12.99559       13.22288  148.6503 65.69341 184.4140 83.96255 -35.76367      106.6083 
1 1 1 -20 13 2  o 118.1755 55.21193 -1.137049      6.272739      -1.653469      7.079746      0.7486771      13.52867  121.7204 57.42654 152.3074 73.81668 -30.58692      93.52385 
1 1 1 -20 13 3  o 183.5820 65.11048 10.23469       5.817850      3.910127       7.956030      17.50336       8.529207  144.7838 65.61089 217.6772 78.64979 -72.89340      102.4235 
1 1 1 -20 13 4  o 133.5139 58.40477 3.404282       5.757320      -6.259962      7.687596      15.74758       8.688046  110.4516 53.99767 200.7850 77.90403 -90.33336      94.78812 
1 1 1 -20 13 5  o 242.7358 65.31850 17.94350       6.292794      14.90277       8.558237      21.52245       9.284807  192.2118 76.48382 226.8064 82.04254 -34.59457      112.1640 
1 1 1 -20 13 6  o 200.0469 66.71703 13.43226       6.076405      7.137411       8.151491      21.30456       9.115810  150.4326 67.43993 221.1454 81.09330 -70.71283      105.4716 
1 1 1 -20 13 7  o 105.7348 50.72797 -2.321655      6.012501      -4.394362      7.853712      0.6132011      9.345431  110.9060 54.29542 128.4475 62.03371 -17.54153      82.43891 
1 1 1 -20 13 8  o 115.8711 53.79280 1.350456       5.805770      -0.1251904     7.772059      3.213504       8.732870  118.7769 57.16312 130.4976 62.20608 -11.72073      84.48206 
1 1 1 -20 13 9  o 187.4302 65.15525 13.24331       5.806121      2.352712       7.602416      28.48612       8.994110  122.3568 58.24673 246.7954 81.11518 -124.4387      99.86167 
1 1 1 -20 13 10 o 119.3018 55.21653 3.327885       6.049118      9.191773       7.866305      -5.157542      9.462693  141.8186 64.64301 108.5146 54.23377 33.30398       84.38021 
1 1 1 -20 13 11 o 137.4998 61.78312 8.648112       6.882880      1.414932       8.049098      28.32573       13.27605  113.9136 55.59562 163.3412 77.52903 -49.42761      95.40244 
1 1 1 -20 13 12 o 129.3116 59.88645 8.055195       7.131797      4.518758       8.503433      16.44246       13.09548  117.6685 57.36534 133.8554 66.38609 -16.18688      87.73765 
1 1 1 -20 13 13 o 117.9157 55.27369 5.793217       6.375717      -0.1156410E-01 8.292866      14.18395       9.970381  104.5194 52.00197 132.1790 63.89319 -27.65963      82.38049 
1 1 1 -20 14 1  o 119.4699 55.30733 -0.2866444     6.074275      1.818686       6.792185      -8.696337      13.57499  132.3624 60.23006 135.2992 67.18491 -2.936798      90.23010 
1 1 1 -20 14 2  o 103.1910 49.82970 -4.570012      6.025151      -2.708995      6.819604      -11.19053      12.86263  114.8299 54.80201 127.6686 63.71823 -12.83871      84.04328 
1 1 1 -20 14 3  o 203.3902 67.99605 13.45026       6.311340      14.16013       7.119572      10.84541       13.63813  201.1821 71.95503 166.2922 78.82784 34.88985       106.7303 
1 1 1 -20 14 4  o 112.3854 52.56065 -0.6172218     5.708836      2.287219       7.624674      -4.322785      8.612261  132.7127 61.62314 118.1993 57.64765 14.51337       84.38402 
1 1 1 -20 14 5  o 168.0513 64.40677 9.462164       5.885285      8.520628       8.092099      10.51942       8.574975  155.8345 68.67382 163.9732 71.51517 -8.138779      99.14894 
1 1 1 -20 14 6  o 121.4520 55.44036 2.134665       5.812691      0.8210222      7.425612      4.213336       9.340856  122.7991 58.19773 137.6117 65.23375 -14.81253      87.42092 
1 1 1 -20 14 7  o 118.8515 54.57796 2.075959       5.747060      -0.8099346     7.344412      6.634048       9.230140  115.3696 55.53461 141.0759 66.24999 -25.70636      86.44741 
1 1 1 -20 14 8  o 132.5615 58.30946 5.391415       5.808934      12.60551       7.470863      -5.638471      9.237730  166.1994 69.40049 110.2060 54.83993 55.99338       88.45251 
1 1 1 -20 14 9  o 153.7127 62.59281 9.527995       5.876522      11.19082       7.720417      7.237597       9.060924  152.1955 67.07375 134.6938 63.96594 17.50168       92.68511 
1 1 1 -20 14 10 o 82.77550 41.72836 -10.54901      6.239697      -6.158529      8.247762      -16.42484      9.541454  100.7682 50.40287 93.03369 47.38990 7.734482       69.18275 
1 1 1 -20 14 11 o 115.1038 54.97957 3.314597       6.894405      -4.523603      8.327322      20.39605       12.29305  101.3069 50.66826 146.3598 70.79576 -45.05292      87.05925 
1 1 1 -20 15 1  o 117.2198 54.81302 -0.7147706     6.204435      -1.987546      7.066511      3.567848       12.96235  118.2432 56.25123 151.9427 73.30042 -33.69946      92.39671 
1 1 1 -20 15 2  o 116.7000 54.31599 -0.2026729     5.979960      -3.110801      6.764305      10.20104       12.79413  111.7980 53.68176 164.0838 77.34762 -52.28574      94.15086 
1 1 1 -20 15 3  o 128.5862 57.61716 2.829836       5.941942      6.782630       6.577784      -14.70159      13.85275  150.6484 64.12486 122.7783 61.92991 27.87011       89.14769 
1 1 1 -20 15 4  f 172.8345 64.44145 10.03910       5.799418      0.7662594      7.544206      23.43481       9.067548  125.0052 59.06915 234.4753 81.42863 -109.4701      100.5971 
1 1 1 -20 15 5  o 341.4742 45.66856 29.33251       5.904532      34.00990       7.866934      23.29850       8.935253  337.6904 62.28184 229.3926 80.76205 108.2978       101.9879 
1 1 1 -20 15 6  o 230.9146 61.58586 16.81447       5.624337      19.51450       7.145135      12.41636       9.119259  225.9121 72.14664 162.0267 72.07474 63.88544       101.9799 
1 1 1 -20 15 7  o 114.1586 52.69740 1.676461       5.456548      2.157028       6.964522      0.9125592      8.780777  121.1371 57.09207 122.3075 59.32195 -1.170364      82.33224 
1 1 1 -20 15 8  o 177.2155 66.10415 12.85629       6.103876      7.232796       7.503617      23.85627       10.49454  137.1849 62.76301 188.2034 80.57477 -51.01857      102.1347 
1 1 1 -19 0  1  o 144.6006 87.25399 4.779695       8.948217      4.779695       8.948217      4.779695       8.948217  144.6006 87.25399 144.6006 87.25399 0.000000       0.000000 
1 1 1 -19 0  2  o 967.2019 33.49606 184.0527       12.54747      184.0527       12.54747      184.0527       12.54747  967.2019 33.49606 967.2019 33.49606 -0.000000      0.000000 
1 1 1 -19 0  3  o 314.3573 92.80310 24.65320       9.849675      24.65320       9.849675      24.65320       9.849675  314.3573 92.80310 314.3573 92.80310 0.000000       0.000000 
1 1 1 -19 0  4  o 179.3624 97.31118 9.792545       9.527015      9.792545       9.527015      9.792545       9.527015  179.3624 97.31118 179.3624 97.31118 0.000000       0.000000 
1 1 1 -19 0  5  o 150.0052 90.80383 5.117496       9.752686      5.117496       9.752686      5.117496       9.752686  150.0052 90.80383 150.0052 90.80383 -0.000000      0.000000 
1 1 1 -19 0  6  o 175.1083 99.06389 9.014753       10.36298      9.014753       10.36298      9.014753       10.36298  175.1083 99.06389 175.1083 99.06389 -0.000000      0.000000 
1 1 1 -19 0  7  o 156.8933 93.81432 6.131640       10.15662      6.131640       10.15662      6.131640       10.15662  156.8933 93.81432 156.8933 93.81432 -0.000000      0.000000 
1 1 1 -19 0  8  o 107.4365 75.53375 -11.95516      12.21697      -11.95516      12.21697      -11.95516      12.21697  107.4365 75.53375 107.4365 75.53375 -0.000000      0.000000 
1 1 1 -19 0  9  o 127.7629 86.84645 -5.192975      13.07578      -5.192975      13.07578      -5.192975      13.07578  127.7629 86.84645 127.7629 86.84645 0.000000       0.000000 
1 1 1 -19 0  10 o 540.9871 73.82773 62.86169       14.69275      62.86169       14.69275      62.86169       14.69275  540.9871 73.82773 540.9871 73.82773 0.000000       0.000000 
1 1 1 -19 0  11 o 162.4625 99.12696 6.388766       11.82409      6.388766       11.82409      6.388766       11.82409  162.4625 99.12696 162.4625 99.12696 0.000000       0.000000 
1 1 1 -19 0  12 o 319.2498 110.9881 28.24570       12.42891      28.24570       12.42891      28.24570       12.42891  319.2498 110.9881 319.2498 110.9881 -0.000000      0.000000 
1 1 1 -19 0  13 o 226.2470 112.8148 17.05182       12.05320      17.05182       12.05320      17.05182       12.05320  226.2470 112.8148 226.2470 112.8148 -0.000000      0.000000 
1 1 1 -19 0  14 o 384.2470 95.09352 36.18215       12.28290      36.18215       12.28290      36.18215       12.28290  384.2470 95.09352 384.2470 95.09352 -0.000000      0.000000 
1 1 1 -19 0  15 o 237.1442 131.5479 21.21821       17.83209      21.21821       17.83209      21.21821       17.83209  237.1442 131.5479 237.1442 131.5479 0.000000       0.000000 
1 1 1 -19 0  16 o 214.7214 126.4595 17.17459       17.95473      17.17459       17.95473      17.17459       17.95473  214.7214 126.4595 214.7214 126.4595 0.000000       0.000000 
1 1 1 -19 0  17 o 90.94030 65.28937 -15.56606      11.02437      -15.56606      11.02437      -15.56606      11.02437  90.94030 65.28937 90.94030 65.28937 0.000000       0.000000 
1 1 1 -19 0  18 o 175.9311 97.66064 10.82292       9.835974      10.82292       9.835974      10.82292       9.835974  175.9311 97.66064 175.9311 97.66064 0.000000       0.000000 
1 1 1 -19 0  19 o 98.27285 67.87022 -4.600498      8.728301      -4.600498      8.728301      -4.600498      8.728301  98.27285 67.87022 98.27285 67.87022 0.000000       0.000000 
1 1 1 -19 0  20 o 117.1055 76.44418 1.483677       8.509534      1.483677       8.509534      1.483677       8.509534  117.1055 76.44418 117.1055 76.44418 -0.000000      0.000000 
1 1 1 -19 0  21 o 87.78402 61.77650 -6.804439      8.233740      -6.804439      8.233740      -6.804439      8.233740  87.78402 61.77650 87.78402 61.77650 -0.000000      0.000000 
1 1 1 -19 0  22 o 104.3208 70.29070 -0.8176776     8.201900      -0.8176776     8.201900      -0.8176776     8.201900  104.3208 70.29070 104.3208 70.29070 0.000000       0.000000 
1 1 1 -19 1  1  o 183.8956 67.04536 6.861541       6.218194      -7.917964      8.653524      22.64018       8.941242  131.5255 62.47589 309.7146 75.11079 -178.1891      97.69784 
1 1 1 -19 1  2  o 529.9940 41.82763 57.98269       8.539216      63.56216       15.99991      55.76044       10.09756  514.3683 82.91583 512.0500 51.47537 2.318298       97.59482 
1 1 1 -19 1  3  o 702.8646 28.95126 98.71600       7.902548      108.5124       11.23150      89.11120       11.12110  726.7878 39.94586 654.6251 44.00049 72.16272       59.42823 
1 1 1 -19 1  4  o 433.8643 42.75586 39.29887       7.110425      47.84999       10.12132      30.96610       9.991263  467.1325 56.97194 361.0539 73.74856 106.0787       93.19147 
1 1 1 -19 1  5  o 529.5710 37.27562 57.65795       7.617247      46.06189       10.74874      69.35676       10.79625  450.7502 63.13582 569.5765 49.29418 -118.8263      80.10023 
1 1 1 -19 1  6  o 131.0213 60.11901 -2.534886      6.954441      -17.17611      10.20159      10.17620       9.505404  121.1373 59.80633 209.8067 81.46339 -88.66944      101.0598 
1 1 1 -19 1  7  o 251.1424 75.66622 16.11841       7.988904      29.03512       12.71556      7.694604       10.26866  315.5977 95.54546 195.8128 81.53103 119.7850       125.6035 
1 1 1 -19 1  8  o 426.0097 53.96832 40.75561       8.728443      64.65366       14.67633      27.67678       10.85727  504.9429 77.30280 316.0418 86.11455 188.9012       115.7214 
1 1 1 -19 1  9  o 231.7428 83.86526 15.33418       9.703502      11.05355       13.85965      19.44985       13.58997  209.2081 91.09065 244.3916 96.65318 -35.18349      132.8132 
1 1 1 -19 1  10 o 146.7251 67.36676 -0.4409001     8.751010      2.092315       11.12574      -4.550781      14.17123  167.1337 76.45003 162.5208 77.94744 4.612915       109.1806 
1 1 1 -19 1  11 o 400.1364 61.94874 39.63685       9.315411      23.30785       11.94063      65.02999       14.89037  256.7304 93.01281 474.7415 83.82964 -218.0111      125.2150 
1 1 1 -19 1  12 o 466.0396 49.92150 50.68147       8.894623      49.14202       13.08814      52.00264       12.12481  396.7417 87.31366 430.8054 75.20758 -34.06372      115.2383 
1 1 1 -19 1  13 f 397.3841 57.36474 39.81488       8.596514      37.92601       12.62146      41.44936       11.74086  316.3002 95.06438 355.7467 85.94481 -39.44650      128.1552 
1 1 1 -19 1  14 o 90.17746 45.79636 -22.62590      8.429578      -23.56589      12.41928      -21.82290      11.47865  112.7242 57.06696 109.8985 55.54594 2.825783       79.63660 
1 1 1 -19 1  15 o 164.7758 74.16408 9.806475       9.966968      11.60561       12.15538      6.114760       17.41210  168.4095 78.06031 157.4631 77.81426 10.94635       110.2201 
1 1 1 -19 1  16 o 158.1553 75.07253 11.35431       12.45209      5.438231       17.29305      17.72477       17.94485  147.7299 73.75476 163.2565 80.35434 -15.52657      109.0715 
1 1 1 -19 1  17 o 96.51781 48.78384 -14.33028      8.856371      -21.99764      15.54805      -10.64769      10.77531  113.1657 57.88208 109.6077 55.20156 3.557991       79.98467 
1 1 1 -19 1  18 o 129.7962 60.03506 6.066071       7.134042      27.56672       9.663938      -19.68310      10.57572  211.4821 82.13266 95.03067 48.53533 116.4514       95.40153 
1 1 1 -19 1  19 o 150.4780 63.82087 11.87517       6.474618      5.529740       8.884677      19.06123       9.454886  119.6080 58.38259 155.9386 70.99824 -36.33059      91.91994 
1 1 1 -19 1  20 f 132.9102 58.47488 9.688911       5.844579      8.061869       8.084327      11.47043       8.459390  117.6096 57.01524 125.3561 60.14945 -7.746437      82.87758 
1 1 1 -19 1  21 o 115.4552 53.68620 7.884042       5.820198      3.637221       8.136192      12.33475       8.329206  100.7674 50.35090 117.8117 57.28715 -17.04434      76.26945 
1 1 1 -19 1  22 o 68.71025 35.13972 -11.30029      5.714651      -12.56027      8.263198      -10.14522      7.911728  77.62079 39.86726 78.65366 40.30862 -1.032875      56.69377 
1 1 1 -19 2  1  o 624.2101 29.21927 77.73952       7.083179      83.91904       9.968517      71.43800       10.06645  639.7876 40.32690 586.7491 44.50856 53.03845       60.06056 
1 1 1 -19 2  2  o 435.6571 41.17707 39.22742       6.884116      46.62492       9.665777      31.61221       9.806980  465.1789 54.53937 369.8931 70.84994 95.28577       89.41061 
1 1 1 -19 2  3  o 265.2230 74.94336 16.94829       8.060721      13.96278       15.52476      18.05020       9.431689  244.3228 100.8645 268.9189 82.46861 -24.59604      130.2871 
1 1 1 -19 2  4  o 329.0014 57.30122 24.01828       7.055279      24.67196       10.01123      23.37328       9.944447  314.0359 81.41200 304.6971 82.16209 9.338806       115.6656 
1 1 1 -19 2  5  o 335.7592 55.82763 25.01256       7.023940      5.462062       9.962861      44.33312       9.904101  187.9609 79.41190 446.0222 58.59624 -258.0613      98.69027 
1 1 1 -19 2  6  o 246.4599 74.35071 15.16064       7.709902      33.20838       12.65808      4.516086       9.721205  347.8176 92.21386 180.6301 77.44658 167.1875       120.4216 
1 1 1 -19 2  7  o 342.0397 66.76490 27.90977       8.550263      31.79043       13.92772      25.56268       10.83159  323.0658 100.4054 305.0890 87.10766 17.97681       132.9247 
1 1 1 -19 2  8  o 132.8726 62.61003 -4.823977      8.367891      13.82529       13.83753      -15.57566      10.50669  224.3232 94.11690 124.1685 61.18686 100.1547       112.2578 
1 1 1 -19 2  9  o 116.3529 56.75671 -10.48287      8.358106      -6.278720      13.25496      -13.25786      10.76886  157.6528 75.55249 128.8439 63.18152 28.80894       98.48901 
1 1 1 -19 2  10 o 525.0193 47.38399 61.38128       9.557170      47.41090       12.14895      84.06354       15.48025  420.4717 77.24677 572.3589 71.18114 -151.8872      105.0420 
1 1 1 -19 2  11 o 199.7624 80.27148 11.73026       9.522612      -6.103624      12.42220      37.14521       14.82929  147.7021 71.37774 308.2556 104.2219 -160.5535      126.3209 
1 1 1 -19 2  12 o 192.7254 76.31220 11.16902       8.481279      10.08253       12.45701      12.10786       11.57967  186.2993 83.45473 193.8978 83.84045 -7.598495      118.2959 
1 1 1 -19 2  13 f 105.6170 52.52392 -12.95517      8.420207      -8.226057      12.91296      -16.45347      11.10618  138.3026 68.08975 117.0788 58.55023 21.22373       89.80169 
1 1 1 -19 2  14 o 142.1464 67.57693 0.7229173      10.16519      16.09504       12.45295      -29.97423      17.59763  190.6934 84.55373 126.7990 64.56715 63.89445       106.3873 
1 1 1 -19 2  15 o 145.5544 68.75464 3.967433       10.20449      -9.401755      12.36342      32.54048       18.07442  125.7306 62.70594 201.9511 94.13992 -76.22050      113.1122 
1 1 1 -19 2  16 o 185.0040 82.31757 20.20052       11.90299      9.293347       17.03387      30.60883       16.63978  151.6629 75.30177 188.7076 88.72504 -37.04472      116.3722 
1 1 1 -19 2  17 f 123.5273 60.15671 0.7917130      9.279641      2.442803       16.64883      0.4760452E-01  11.17678  134.6453 67.91280 125.8795 62.23224 8.765778       92.11406 
1 1 1 -19 2  18 o 102.3130 50.18379 -2.616745      6.807024      -8.999875      9.061867      5.649062       10.31201  100.4609 50.59850 127.7107 62.45722 -27.24982      80.38104 
1 1 1 -19 2  19 o 106.1479 51.40840 1.221415       6.532477      1.568950       8.780626      0.7906249      9.775957  110.9402 54.90305 110.8741 55.36961 0.6610870E-01  77.97524 
1 1 1 -19 2  20 o 116.6301 54.66704 6.607096       6.234575      -0.8990730     8.490956      15.38819       9.183785  99.81830 50.10023 131.6728 63.04554 -31.85451      80.52809 
1 1 1 -19 2  21 o 86.09876 42.99686 -2.262477      5.894840      -8.341334      7.990989      4.994771       8.731232  84.15010 42.90947 102.5275 51.36713 -18.37740      66.93134 
1 1 1 -19 2  22 o 96.42535 47.46731 4.388036       6.269742      13.78823       9.256316      -3.580923      8.522569  107.9545 53.90655 86.15240 43.96498 21.80207       69.56174 
1 1 1 -19 3  1  o 335.3598 53.36824 24.29969       6.717677      23.78766       9.300473      24.85819       9.713437  315.5445 76.65411 321.2905 78.51400 -5.746063      109.7283 
1 1 1 -19 3  2  o 137.4676 60.67976 -0.2714240     6.343457      -1.488666      8.639280      1.152541       9.344128  152.1904 68.72231 168.1417 73.95702 -15.95134      100.9574 
1 1 1 -19 3  3  o 262.7962 65.39146 15.99460       6.646832      9.125699       9.409865      22.83489       9.390244  207.6841 80.93757 304.9406 78.74545 -97.25642      112.9236 
1 1 1 -19 3  4  o 362.3021 59.30360 29.35268       8.055338      23.29762       13.24673      32.90556       10.14705  287.7747 98.49789 372.1771 72.81183 -84.40240      122.4884 
1 1 1 -19 3  5  o 400.8357 68.11864 37.57270       10.22431      0.000000       0.000000      37.57270       10.22431  ?        ?        400.8357 68.11864 0.000000       68.11864 
1 1 1 -19 3  6  o 140.7499 64.20036 -1.784179      7.775936      -18.57844      12.80279      8.032199       9.788133  137.0088 67.51973 197.4503 80.63536 -60.44151      105.1712 
1 1 1 -19 3  7  o 383.3412 58.23056 33.52267       8.396229      35.12697       14.03266      32.62804       10.47896  341.3240 99.65330 358.1140 77.58981 -16.78995      126.2971 
1 1 1 -19 3  8  o 358.1214 64.31998 30.68077       8.616708      29.05066       14.08732      31.65522       10.89182  297.1487 101.5756 342.1262 82.85596 -44.97751      131.0829 
1 1 1 -19 3  9  o 171.4252 71.37843 5.716352       7.870759      4.880284       11.48117      6.457653       10.81091  180.3813 80.50990 184.3580 80.35556 -3.976654      113.7491 
1 1 1 -19 3  10 o 199.6807 78.18003 10.93157       8.810877      6.087705       12.31272      16.01510       12.61366  182.7477 82.32523 221.6385 91.14211 -38.89085      122.8183 
1 1 1 -19 3  11 f 570.6340 46.72536 73.45374       10.26393      74.13721       13.64676      72.56356       15.57426  536.7390 66.92330 500.7736 82.98858 35.96545       106.6107 
1 1 1 -19 3  12 o 184.1794 77.41370 9.934549       9.389257      13.95729       12.74306      5.156837       13.88746  198.6996 86.90619 172.6453 81.13534 26.05421       118.8933 
1 1 1 -19 3  13 o 190.7252 75.88593 11.99808       8.424308      20.97785       12.98928      5.478698       11.06765  216.2270 90.97731 162.4994 75.02595 53.72755       117.9227 
1 1 1 -19 3  14 f 148.1415 69.41230 3.249618       10.03611      2.465635       12.16139      4.923464       17.77002  150.8464 72.31128 162.5201 79.98609 -11.67372      107.8272 
1 1 1 -19 3  15 o 155.3990 71.51038 7.630539       9.936763      16.38567       12.35837      -8.381234      16.71281  180.1843 81.70213 137.6342 69.24434 42.55003       107.0982 
1 1 1 -19 3  16 o 151.0739 69.39429 8.485625       9.299817      21.35540       17.54006      3.452948       10.96845  166.6778 81.50200 138.0729 66.80798 28.60492       105.3844 
1 1 1 -19 3  17 o 140.6098 65.88346 7.725612       9.041698      -7.333113      15.58739      15.36194       11.09996  123.4622 62.65598 158.9348 73.98270 -35.47253      96.94953 
1 1 1 -19 3  18 o 103.7858 50.79514 -1.879773      6.859166      8.164195       9.104953      -15.06035      10.43019  133.1043 63.46765 98.04243 49.90337 35.06189       80.73716 
1 1 1 -19 3  19 o 106.2183 51.31634 1.586812       6.409578      2.497873       8.609403      0.4539468      9.600377  111.6908 55.10485 109.3013 54.62693 2.389481       77.59283 
1 1 1 -19 3  20 o 96.77179 47.59079 0.2203511      6.250502      -8.702311      8.669388      9.879595       9.020130  89.67704 45.63090 118.2935 57.97061 -28.61647      73.77513 
1 1 1 -19 3  21 o 91.96088 46.65060 -2.286811      8.580847      0.000000       0.000000      -2.286811      8.580847  ?        ?        91.96088 46.65060 0.000000       46.65060 
1 1 1 -19 3  22 o 135.0270 59.89294 15.57405       6.253759      34.40092       9.239220      -0.3448951     8.495781  159.2158 71.55740 89.24051 45.38563 69.97525       84.73676 
1 1 1 -19 4  1  o 440.9928 49.29573 41.24905       8.298014      48.39370       11.93369      34.56080       11.54623  460.8961 68.77704 377.3792 81.19142 83.51694       106.4064 
1 1 1 -19 4  2  o 207.0617 72.93117 9.671264       7.287246      18.55724       11.59162      3.864339       9.370541  266.7078 92.09850 179.9395 76.56338 86.76833       119.7668 
1 1 1 -19 4  3  o 602.0422 35.67025 73.93772       8.302730      83.10717       13.80614      68.74272       10.39187  614.3489 58.57634 570.1497 47.36157 44.19922       75.32799 
1 1 1 -19 4  4  o 184.8633 72.79417 6.662400       7.677575      -0.9427832     12.31791      11.49384       9.817944  175.9041 80.45444 220.1891 83.47225 -44.28502      115.9333 
1 1 1 -19 4  5  f 403.8982 53.25042 35.83420       8.148979      60.27204       13.58492      22.09832       10.18484  503.6884 71.45226 289.0360 85.04461 214.6523       111.0766 
1 1 1 -19 4  6  o 218.9472 85.27462 11.96654       10.44041      0.000000       0.000000      11.96654       10.44041  ?        ?        218.9472 85.27462 0.000000       85.27462 
1 1 1 -19 4  7  o 435.4281 54.07790 42.47816       8.947687      31.30934       18.90995      45.70017       10.15664  288.2261 114.0050 444.8702 60.34549 -156.6441      128.9912 
1 1 1 -19 4  8  o 248.1958 86.79807 17.95802       10.31143      0.000000       0.000000      17.95802       10.31143  ?        ?        248.1958 86.79807 0.000000       86.79807 
1 1 1 -19 4  9  o 188.7575 74.24248 8.760653       7.977562      -6.680099      12.28420      20.02208       10.49082  150.4254 72.25920 255.7011 87.65446 -105.2757      113.5988 
1 1 1 -19 4  10 o 150.1479 67.47031 1.674397       8.209776      3.320062       12.55889      0.4464078      10.84870  173.4918 80.03786 158.6983 73.62486 14.79352       108.7505 
1 1 1 -19 4  11 o 169.3181 73.74997 6.074290       9.092690      -9.539913      12.70011      22.49511       13.02402  141.0194 69.03927 240.8906 94.82514 -99.87114      117.2955 
1 1 1 -19 4  12 o 300.8037 81.71151 28.49946       9.793036      38.23272       13.09998      16.16944       14.74427  318.2976 97.11685 201.4361 90.47509 116.8615       132.7306 
1 1 1 -19 4  13 o 114.0057 56.63519 -12.49796      9.686165      -1.855863      11.99438      -32.44989      16.42316  145.1659 70.14866 123.2725 62.73323 21.89334       94.10788 
1 1 1 -19 4  14 o 362.9490 77.67855 42.25480       10.61833      37.27105       13.10319      51.78765       18.12217  279.6746 97.84296 273.6456 110.4624 6.028992       147.5642 
1 1 1 -19 4  15 o 138.9181 65.84016 2.779704       9.506199      14.14778       11.72852      -18.98975      16.23018  172.9127 78.86138 125.5196 63.72422 47.39310       101.3898 
1 1 1 -19 4  16 o 316.3097 78.03048 36.95013       9.525900      14.84055       17.97470      45.58498       11.23308  154.9662 77.01200 332.6954 86.23112 -177.7291      115.6143 
1 1 1 -19 4  17 o 122.9438 59.55877 1.824829       8.782650      17.69032       15.69841      -5.403437      10.59610  149.9749 74.07094 114.1457 57.09946 35.82920       93.52460 
1 1 1 -19 4  18 o 129.2337 59.08551 6.495064       6.634943      7.362413       8.762844      5.329708       10.15728  129.7459 61.97618 124.6279 61.16390 5.118027       87.07508 
1 1 1 -19 4  19 o 90.14961 44.94399 -4.683793      6.326677      -4.704154      8.246618      -4.654666      9.863445  97.54784 49.01725 101.7734 51.44523 -4.225540      71.05844 
1 1 1 -19 4  20 o 89.05036 44.45950 -3.090114      6.284871      -12.23462      8.796394      6.446150       8.982839  85.85792 43.88396 110.4746 54.82285 -24.61673      70.22355 
1 1 1 -19 4  21 o 79.18410 40.07239 -6.246095      6.087595      -12.55265      8.481074      0.4563673      8.743231  80.80334 41.43196 94.87131 48.01257 -14.06796      63.41778 
1 1 1 -19 4  22 o 78.40210 39.77406 -5.059096      6.241905      -1.453507      9.116414      -8.241117      8.564214  88.23306 45.06348 81.22460 41.64702 7.008461       61.36116 
1 1 1 -19 5  1  o 177.4952 70.36288 5.559083       7.218145      9.016099       10.75961      2.730073       9.733365  211.4142 85.19468 176.8347 76.66400 34.57947       114.6102 
1 1 1 -19 5  2  o 230.4542 73.04119 12.67422       7.334075      6.899920       11.33823      16.82837       9.616924  202.1390 85.02167 257.8264 83.83488 -55.68733      119.4026 
1 1 1 -19 5  3  o 429.7318 52.57661 40.08628       8.591401      44.19997       12.85312      36.76382       11.55106  423.1223 81.17212 386.5774 79.59267 36.54495       113.6834 
1 1 1 -19 5  4  o 437.7356 48.69520 41.17643       8.137712      37.80416       13.10807      43.29122       10.38032  376.9289 90.65608 435.4003 63.23890 -58.47141      110.5336 
1 1 1 -19 5  5  o 191.0818 74.92561 7.776178       8.101873      22.50568       13.47416      -0.5650094     10.13962  274.9525 98.91974 162.1586 73.71185 112.7938       123.3635 
1 1 1 -19 5  6  o 254.3026 71.83019 16.23004       7.406408      18.27166       10.47923      14.19229       10.46926  255.7742 87.60638 230.1345 86.42952 25.63979       123.0648 
1 1 1 -19 5  7  o 201.6741 73.11177 10.06288       7.379289      -11.13841      10.98313      27.50890       9.963066  136.1144 66.09367 321.9605 80.02854 -185.8461      103.7928 
1 1 1 -19 5  8  o 168.5204 71.98972 4.671544       8.344251      -22.20320      18.39098      11.63797       9.363493  155.6165 77.42718 208.8557 80.92026 -53.23924      111.9958 
1 1 1 -19 5  9  o 193.1632 74.33437 9.661427       7.859703      5.910881       12.43732      12.15508       10.14138  183.8970 82.80138 207.3237 83.00468 -23.42679      117.2427 
1 1 1 -19 5  10 o 102.0141 50.63801 -13.52931      7.684036      2.624410       12.36108      -23.70285      9.809704  169.4764 78.61248 103.0949 52.01593 66.38147       94.26334 
1 1 1 -19 5  11 o 121.5021 59.42687 -9.441108      9.342627      -5.161089      12.76948      -14.37123      13.70501  148.4767 71.90065 136.8778 67.88987 11.59891       98.88750 
1 1 1 -19 5  12 o 436.2630 78.55000 56.54244       12.81886      56.54244       12.81886      0.000000       0.000000  436.2630 78.55000 ?        ?        0.000000       78.55000 
1 1 1 -19 5  13 o 299.9478 83.20325 30.75084       10.03179      32.48066       12.13079      27.00864       17.84233  277.8059 94.26175 209.5890 96.21616 68.21687       134.6953 
1 1 1 -19 5  14 o 142.5272 66.73380 2.873419       9.248070      2.994640       11.32915      2.631312       16.01071  147.5616 70.48160 153.8665 75.76506 -6.304886      103.4795 
1 1 1 -19 5  15 o 107.4258 52.65078 -5.715776      7.446807      -14.22044      10.55236      2.721574       10.51052  109.5272 55.09282 139.3750 66.92125 -29.84776      86.68144 
1 1 1 -19 5  16 o 99.89786 50.40957 -14.14192      9.229954      -10.09790      17.60008      -15.67604      10.84021  128.2531 65.23603 105.4635 53.38283 22.78960       84.29393 
1 1 1 -19 5  17 o 256.3107 81.53188 31.09581       9.131907      20.47642       16.31287      35.94245       11.02049  149.8961 74.29797 241.6041 89.07764 -91.70801      115.9958 
1 1 1 -19 5  18 o 99.61896 49.06881 -2.664126      6.733455      -5.040412      9.274052      -0.1492396E-01 9.792142  104.2545 52.33136 113.1437 56.32783 -8.889259      76.88560 
1 1 1 -19 5  19 o 105.1377 50.97655 1.898767       6.468929      5.181466       8.958064      -1.678621      9.351509  114.4218 56.40608 103.4595 52.01642 10.96232       76.72910 
1 1 1 -19 5  20 f 111.5187 53.36414 6.267955       6.558094      7.438748       8.968356      4.922409       9.614402  110.8314 54.96227 106.4103 53.39538 4.421021       76.62844 
1 1 1 -19 5  21 o 74.23965 37.81879 -9.488178      6.083439      -0.3738737     8.171849      -20.81818      9.111157  92.40293 46.72247 76.25117 39.27721 16.15176       61.03842 
1 1 1 -19 6  1  o 400.8728 49.45386 34.40912       7.535786      44.63246       11.58540      26.91153       9.921453  437.8895 70.52161 331.3203 78.34064 106.5692       105.4066 
1 1 1 -19 6  2  o 175.3551 70.33970 5.391064       7.297926      -13.58942      11.98361      16.58007       9.200891  142.3785 69.11301 255.5343 81.89804 -113.1558      107.1629 
1 1 1 -19 6  3  o 127.7629 58.71951 -2.760964      6.671472      10.10991       9.409804      -15.76998      9.460168  210.2911 81.21972 118.0082 58.13346 92.28288       99.88064 
1 1 1 -19 6  4  o 164.5470 68.54235 3.929094       7.261928      1.123194       9.475270      7.923430       11.30519  164.6854 73.34845 201.9328 84.91435 -37.24741      112.2071 
1 1 1 -19 6  5  o 362.8284 77.93056 33.31172       10.65324      33.31172       10.65324      0.000000       0.000000  362.8284 77.93056 ?        ?        0.000000       77.93056 
1 1 1 -19 6  6  o 319.3067 62.03508 24.00993       7.415395      28.07871       10.42318      19.84004       10.55191  323.5376 82.65472 263.6635 87.91749 59.87411       120.6702 
1 1 1 -19 6  7  o 431.2170 47.41659 40.79493       7.809458      30.88367       11.32708      49.77457       10.78159  330.2616 87.07449 459.0896 62.06330 -128.8280      106.9290 
1 1 1 -19 6  8  o 196.1834 73.59829 9.870306       7.587454      39.13612       12.44535      -7.442306      9.572121  367.6296 88.28204 132.3367 63.62587 235.2929       108.8208 
1 1 1 -19 6  9  o 198.7836 75.01398 10.73719       7.906169      -5.656066      12.38736      22.00518       10.26998  150.8561 72.49160 265.5782 86.64824 -114.7221      112.9732 
1 1 1 -19 6  10 f 252.1700 80.89307 19.51073       8.974919      41.95787       19.62426      13.57402       10.09220  282.8689 114.6811 207.9336 82.95621 74.93533       141.5397 
1 1 1 -19 6  11 o 127.7470 63.67165 -16.43264      12.66296      -16.43264      12.66296      0.000000       0.000000  127.7470 63.67165 ?        ?        0.000000       63.67165 
1 1 1 -19 6  12 o 216.6017 90.11819 20.22783       12.53201      20.22783       12.53201      0.000000       0.000000  216.6017 90.11819 ?        ?        0.000000       90.11819 
1 1 1 -19 6  13 o 260.9288 85.44955 25.83213       9.984339      19.46972       12.11324      39.31433       17.63314  205.6201 87.25589 241.5864 103.9613 -35.96635      135.7260 
1 1 1 -19 6  14 o 130.5008 61.04244 1.162224       7.705161      -6.555029      10.89628      8.880802       10.89721  125.1328 61.78458 161.1417 74.41554 -36.00893      96.72129 
1 1 1 -19 6  15 o 116.5482 56.04781 -1.705759      7.437935      8.987597       10.78216      -11.41471      10.27389  153.8195 72.03234 111.0103 55.63229 42.80917       91.01434 
1 1 1 -19 6  16 o 184.0937 71.33105 14.68585       7.276170      -3.803110      10.21667      33.71572       10.36505  118.1052 58.58527 259.6277 87.13650 -141.5225      105.0000 
1 1 1 -19 6  17 o 186.8928 75.67101 19.70151       8.532090      33.46099       15.82265      14.06035       10.13124  168.0921 81.06427 150.6844 70.32191 17.40770       107.3154 
1 1 1 -19 6  18 o 80.12952 40.72119 -13.54136      6.746142      -16.60926      9.641215      -10.59840      9.442848  90.87794 46.40844 96.33125 48.87490 -5.453308      67.39806 
1 1 1 -19 6  19 o 93.73831 46.52171 -2.337330      6.474222      6.100459       8.843315      -12.08347      9.504235  114.4240 56.33647 90.63618 46.26812 23.78786       72.90087 
1 1 1 -19 6  20 o 93.36050 46.23676 -0.1365916     6.269398      6.551627       8.702298      -7.353760      9.039870  107.9238 53.62548 89.66875 45.71604 18.25505       70.46735 
1 1 1 -19 6  21 o 102.9943 51.58094 7.670194       8.764324      0.000000       0.000000      7.670194       8.764324  ?        ?        102.9943 51.58094 0.000000       51.58094 
1 1 1 -19 7  1  f 223.1732 80.75462 12.06685       8.996650      12.06685       8.996650      0.000000       0.000000  223.1732 80.75462 ?        ?        0.000000       80.75462 
1 1 1 -19 7  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -19 7  3  o 174.3468 67.94520 5.985573       6.631307      5.403425       9.127331      6.636398       9.650708  181.9820 76.39962 190.3082 79.12269 -8.326248      109.9877 
1 1 1 -19 7  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -19 7  5  o 132.0815 60.20876 -1.584035      6.825577      3.630666       9.980735      -6.165609      9.355246  174.7496 76.65907 137.2274 65.11890 37.52222       100.5837 
1 1 1 -19 7  6  o 276.7085 73.26471 19.75183       7.997142      20.11068       10.54543      19.26614       12.26845  262.5825 87.89262 250.3921 93.65498 12.19038       128.4382 
1 1 1 -19 7  7  o 376.8690 54.56472 32.58538       7.753642      35.60849       11.55393      30.10841       10.45835  357.1354 84.60453 330.4534 81.90603 26.68204       117.7562 
1 1 1 -19 7  8  o 133.6311 61.99229 -2.076856      7.689950      -7.622988      12.19907      1.580205       9.905985  146.8205 70.89920 159.9946 72.77812 -13.17412      101.6039 
1 1 1 -19 7  9  f 309.4265 67.59863 24.84841       7.895917      50.40955       12.27195      6.791420       10.31445  430.4590 76.19823 178.1052 78.03554 252.3539       109.0675 
1 1 1 -19 7  10 o 154.8854 71.28152 1.895081       9.876780      -2.293509      12.29265      9.524138       16.59002  152.9859 73.16827 189.5531 88.95226 -36.56718      115.1786 
1 1 1 -19 7  11 o 177.0146 82.00765 8.047034       13.39111      12.76328       20.22122      4.363175       17.87149  189.5430 91.46813 174.2759 84.55148 15.26711       124.5607 
1 1 1 -19 7  12 o 233.1333 104.5150 37.81644       19.57754      37.81644       19.57754      0.000000       0.000000  233.1333 104.5150 ?        ?        0.000000       104.5150 
1 1 1 -19 7  13 o 112.1995 55.49106 -9.446767      8.917257      -23.66218      11.10482      16.36107       14.96262  104.8258 53.16526 182.5016 85.26763 -77.67576      100.4844 
1 1 1 -19 7  14 o 270.3880 70.90358 23.71720       7.537024      17.82073       10.60968      29.72450       10.70893  192.0968 81.59607 256.8101 88.53149 -64.71330      120.3983 
1 1 1 -19 7  15 o 122.7666 60.44876 -3.006560      10.18826      -3.006560      10.18826      0.000000       0.000000  122.7666 60.44876 ?        ?        0.000000       60.44876 
1 1 1 -19 7  16 o 112.0592 54.24858 -1.004075      7.255183      -4.959753      10.29551      2.898062       10.22560  114.6892 57.20288 128.5424 62.71932 -13.85323      84.88747 
1 1 1 -19 7  17 o 133.0203 62.87518 7.887422       8.559203      -9.329589      14.56962      16.96073       10.57675  113.3650 57.81855 153.4100 71.68032 -40.04501      92.09264 
1 1 1 -19 7  18 o 212.6556 72.23008 22.65755       7.122927      17.24473       9.908611      28.44591       10.24657  145.1906 68.32787 181.2931 78.62800 -36.10255      104.1684 
1 1 1 -19 7  19 o 165.7713 67.29858 17.36982       6.767905      19.74719       9.122586      14.45954       10.09340  145.6220 67.54270 126.2147 61.73954 19.40729       91.50841 
1 1 1 -19 7  20 o 157.2778 64.69213 16.93761       6.356862      14.29092       8.748182      19.89853       9.252959  121.7281 59.08014 132.5164 63.40546 -10.78832      86.66438 
1 1 1 -19 7  21 o 140.2205 61.65445 16.45863       6.488999      14.52626       8.864465      18.68958       9.524730  113.2942 55.89952 118.0872 58.20324 -4.793076      80.69928 
1 1 1 -19 8  1  o 361.3468 50.61089 28.43813       6.907403      32.78565       9.572521      23.71533       9.977122  372.5786 68.68845 302.3755 82.61667 70.20303       107.4412 
1 1 1 -19 8  2  o 335.4924 52.13627 24.82109       6.572297      31.27632       8.872396      16.97199       9.783521  366.2104 64.75412 252.3763 84.65707 113.8342       106.5829 
1 1 1 -19 8  3  o 257.7094 84.78841 18.03079       9.826213      0.000000       0.000000      18.03079       9.826213  ?        ?        257.7094 84.78841 0.000000       84.78841 
1 1 1 -19 8  4  o 216.0287 71.26771 11.64777       6.940499      10.55462       9.738730      12.77601       9.893804  207.7885 81.93309 220.8055 83.77298 -13.01704      117.1791 
1 1 1 -19 8  5  o 157.5302 65.78458 3.834998       6.713242      3.669413       10.05886      3.967989       9.014653  173.5593 76.52118 170.0977 73.76128 3.461609       106.2837 
1 1 1 -19 8  6  o 348.2442 54.91227 27.85684       7.180394      23.26693       10.46523      31.93956       9.870100  281.6954 86.95014 351.3515 74.63895 -69.65610      114.5919 
1 1 1 -19 8  7  o 214.0585 77.48265 12.68249       8.283391      25.97913       11.22919      -3.189834      12.26867  289.2191 90.19949 157.9644 74.84695 131.2546       117.2093 
1 1 1 -19 8  8  o 179.2962 80.29718 6.024200       11.52439      6.024200       11.52439      0.000000       0.000000  179.2962 80.29718 ?        ?        0.000000       80.29718 
1 1 1 -19 8  9  f 249.0883 84.45763 20.07372       9.738514      17.52209       11.98657      25.02863       16.70333  222.1478 89.78008 236.4359 101.4499 -14.28816      135.4716 
1 1 1 -19 8  10 o 180.4062 77.56163 9.111794       9.797745      11.42248       12.06085      4.627789       16.80120  189.9244 83.76079 176.1501 84.58718 13.77429       119.0414 
1 1 1 -19 8  11 o 181.6564 77.91856 10.50333       9.847287      8.386884       12.10886      14.63640       16.92140  173.9813 79.64606 189.9243 89.35304 -15.94298      119.6974 
1 1 1 -19 8  12 o 356.3239 68.99264 36.57819       9.202211      37.63868       12.14538      35.14887       14.10006  307.0179 93.47512 262.2408 99.88445 44.77713       136.8010 
1 1 1 -19 8  13 o 144.9558 68.85300 2.978348       10.50847      -7.230497      17.23778      9.016185       13.25664  142.3367 71.43298 162.5330 77.24044 -20.19627      105.2082 
1 1 1 -19 8  14 o 102.1920 50.33174 -6.846707      7.079310      -16.93055      9.910017      3.661699       10.11649  102.5595 51.80974 140.3180 66.90540 -37.75851      84.62022 
1 1 1 -19 8  15 o 129.9336 59.50387 3.987049       6.767416      1.317709       9.666675      6.552815       9.477279  127.9096 62.08579 141.0531 66.51543 -13.14356      90.98872 
1 1 1 -19 8  16 o 114.6023 54.64552 1.141386       6.749749      -6.226976      9.347286      9.169962       9.757068  107.7229 53.84771 140.3585 66.57508 -32.63554      85.62603 
1 1 1 -19 8  17 o 95.34796 47.91312 -7.729472      7.882001      8.605490       13.74077      -15.74023      9.622518  127.1622 63.81188 92.80888 47.30371 34.35333       79.43298 
1 1 1 -19 8  18 o 132.8652 60.56293 9.852611       6.905014      9.829278       9.726976      9.876313       9.803805  124.1138 60.69002 124.0744 60.72535 0.3947449E-01  85.85364 
1 1 1 -19 8  19 o 113.0757 53.96532 6.292892       6.613248      10.55675       8.974187      1.225637       9.783183  118.7548 58.11699 102.9393 51.93846 15.81544       77.94350 
1 1 1 -19 8  20 o 103.5700 50.35340 5.012960       6.427713      13.86890       8.803915      -5.096263      9.406272  118.2676 57.81170 90.52692 46.19653 27.74069       74.00211 
1 1 1 -19 9  1  o 194.3484 68.57139 8.785707       6.444713      8.856688       8.794397      8.703374       9.471637  198.7235 78.01822 199.4182 80.08344 -0.6946716     111.8043 
1 1 1 -19 9  2  o 115.5645 54.54782 -4.913270      6.401373      -4.964810      9.072503      -4.862172      9.033439  139.1278 65.44620 139.1453 65.40644 -0.1750183E-01 92.52679 
1 1 1 -19 9  3  o 174.8503 67.97375 6.415832       6.624287      6.553657       9.288900      6.273201       9.449474  184.9491 77.32092 184.1313 77.54152 0.8178101      109.5044 
1 1 1 -19 9  4  o 300.4776 61.04006 21.37644       6.879868      34.07455       9.738292      8.723540       9.720938  371.2799 70.10860 195.4636 80.15210 175.8163       106.4874 
1 1 1 -19 9  5  o 157.0819 66.64632 3.655266       7.064749      9.176724       10.40652      -1.064781      9.621698  196.6259 81.99044 152.0763 70.12240 44.54956       107.8869 
1 1 1 -19 9  6  o 262.7504 80.84764 19.75624       9.055899      22.63116       10.97621      13.62720       16.02637  269.1874 89.66328 214.7375 95.53384 54.44992       131.0199 
1 1 1 -19 9  7  o 121.5028 59.08540 -9.150197      8.863727      -18.89747      10.74483      11.61124       15.68147  116.9394 58.34317 203.7727 92.24840 -86.83325      109.1499 
1 1 1 -19 9  8  f 166.4064 73.17984 5.054802       9.144958      13.52913       11.13266      -12.52849      16.03602  206.5827 85.35912 151.5113 74.83601 55.07140       113.5192 
1 1 1 -19 9  9  o 232.6820 89.73359 20.02007       11.47261      20.02007       11.47261      0.000000       0.000000  232.6820 89.73359 ?        ?        0.000000       89.73359 
1 1 1 -19 9  10 o 136.5674 65.14510 -2.641908      9.612758      6.866283       11.49595      -24.74417      17.52727  170.5563 77.89869 136.5037 68.95068 34.05252       104.0308 
1 1 1 -19 9  11 o 354.6516 58.02950 32.47131       7.715940      25.41386       11.58168      38.10365       10.34647  244.4904 91.08465 350.3625 78.04124 -105.8722      119.9452 
1 1 1 -19 9  12 o 225.4489 77.32540 18.26564       8.164444      20.82144       10.75175      14.78470       12.54772  216.4469 85.85309 182.7156 82.63470 33.73134       119.1606 
1 1 1 -19 9  13 o 223.3894 78.24749 19.60852       8.381505      17.23431       10.69691      23.38419       13.48949  189.3331 81.21086 197.1061 87.67046 -7.773087      119.5045 
1 1 1 -19 9  14 o 144.9074 64.52007 6.688898       7.325628      -1.870004      10.76018      14.08324       10.00139  126.8793 62.40578 169.8248 75.51486 -42.94541      97.96416 
1 1 1 -19 9  15 o 104.7223 51.72815 -5.150824      7.665148      1.447118       11.99325      -9.707041      9.966317  128.9974 63.89743 107.2222 53.87962 21.77515       83.58167 
1 1 1 -19 9  16 f 94.17025 46.65671 -5.346692      6.407632      -7.212999      8.825610      -3.266356      9.317941  102.2609 51.29176 110.1330 54.84824 -7.872101      75.09443 
1 1 1 -19 9  17 o 133.8281 62.01361 9.584992       7.663508      4.259650       12.48297      12.80610       9.708378  118.7465 59.75467 136.6179 65.25194 -17.87147      88.47845 
1 1 1 -19 9  18 o 102.2896 50.24231 0.9316968      6.898428      5.972894       9.518778      -4.644979      10.01157  114.0571 56.57240 99.72623 50.56827 14.33083       75.87876 
1 1 1 -19 9  19 o 101.1271 49.50034 2.688145       6.520222      7.269403       8.879768      -2.671802      9.604827  110.1121 54.61991 96.43447 48.96473 13.67764       73.35448 
1 1 1 -19 9  20 o 99.17489 48.72290 3.811893       6.498473      -2.554438      8.911701      11.04135       9.496617  91.29874 46.43734 109.0107 54.45905 -17.71195      71.56966 
1 1 1 -19 10 1  o 334.1082 60.72340 25.97920       7.588775      30.46922       8.708200      11.80530       15.47210  358.2260 64.98889 220.4629 96.11025 137.7631       116.0204 
1 1 1 -19 10 2  f 136.4128 62.71925 -2.047327      7.621341      0.2324301      8.848133      -8.601237      15.00229  153.9922 69.54085 164.1893 79.11948 -10.19717      105.3367 
1 1 1 -19 10 3  f 152.0900 67.49413 1.389933       7.951203      4.918656       9.482562      -6.966382      14.59232  175.7246 75.92621 164.0702 78.79826 11.65437       109.4256 
1 1 1 -19 10 4  o 350.2309 63.93610 29.70523       8.375740      28.57006       9.694417      33.04723       16.63392  327.6341 77.41907 294.2343 109.2487 33.39981       133.8992 
1 1 1 -19 10 5  o 169.3452 72.95708 4.944911       8.704114      7.999751       10.52202      -1.676853      15.49144  188.4967 80.68973 174.2983 83.02061 14.19838       115.7724 
1 1 1 -19 10 6  o 142.9854 66.32044 -1.308144      8.795718      -6.532453      10.56687      10.47746       15.87113  139.1320 66.88223 201.0264 91.70433 -61.89439      113.5029 
1 1 1 -19 10 7  o 120.3989 58.72801 -9.404271      8.946281      -3.560294      10.72618      -22.76225      16.21664  145.4052 69.20971 139.6586 69.97522 5.746597       98.42010 
1 1 1 -19 10 8  o 163.1426 71.90893 5.052233       8.876875      -2.125508      10.50528      22.97242       16.59912  145.6351 69.07867 225.7674 98.95463 -80.13235      120.6809 
1 1 1 -19 10 9  o 150.2126 65.88323 3.960627       7.369041      -9.983677      10.71011      16.49654       10.15485  126.8418 62.36273 214.9298 83.99178 -88.08804      104.6123 
1 1 1 -19 10 10 o 235.4385 73.14548 17.24582       7.392395      21.36632       10.41210      13.05764       10.49728  234.8228 86.58293 190.3571 81.01687 44.46571       118.5763 
1 1 1 -19 10 11 f 313.0691 66.77937 28.05932       7.871502      29.85122       10.35793      25.60982       12.11033  282.4049 86.39307 233.1421 91.54569 49.26282       125.8744 
1 1 1 -19 10 12 o 104.4422 51.73157 -9.253092      7.857270      -25.99315      10.31184      13.92043       12.13259  96.81881 49.31297 175.5399 80.11729 -78.72114      94.07736 
1 1 1 -19 10 13 o 133.1232 61.82414 3.104789       7.679677      -2.550617      9.768788      12.25500       12.42580  124.5263 60.87662 161.8148 76.26221 -37.28855      97.58016 
1 1 1 -19 10 14 o 152.1558 64.96288 8.672462       6.787992      8.047758       9.330552      9.374823       9.893504  145.3467 67.71519 148.9237 69.49747 -3.576996      97.03219 
1 1 1 -19 10 15 o 136.3005 60.99528 6.787087       6.636372      2.269965       8.937989      12.33692       9.907153  122.8167 59.63359 149.3142 69.63464 -26.49744      91.67960 
1 1 1 -19 10 16 f 103.9491 51.29840 -2.265499      7.477597      -8.651490      10.83591      3.540279       10.33193  104.6651 53.02228 120.5799 59.65265 -15.91480      79.81104 
1 1 1 -19 10 17 o 135.4590 62.88720 11.44282       7.935158      -13.76568      11.88877      31.69512       10.65616  98.03037 50.17712 184.7893 80.16424 -86.75896      94.57298 
1 1 1 -19 10 18 o 98.74622 48.67443 0.3696626      6.665917      -2.663807      8.966679      4.117292       9.966441  98.30741 49.61642 108.6074 54.47933 -10.30001      73.68708 
1 1 1 -19 10 19 o 89.66068 44.87879 -2.157713      6.592570      11.90435       9.004946      -18.40041      9.678000  116.5213 57.26716 81.77257 42.03662 34.74874       71.03946 
1 1 1 -19 11 1  o 345.0812 58.27712 27.64055       7.531778      23.97443       8.763234      38.00455       14.73415  304.4998 74.67509 343.6801 102.5822 -39.18030      126.8837 
1 1 1 -19 11 2  o 382.7260 53.64120 33.28984       7.753867      38.61093       9.220708      20.44126       14.32820  404.9376 60.48803 247.7039 98.83760 157.2337       115.8778 
1 1 1 -19 11 3  o 572.1652 37.69059 69.04646       8.328055      73.74518       9.996966      58.39059       15.05473  582.4042 44.53694 453.8909 88.58669 128.5133       99.15211 
1 1 1 -19 11 4  f 149.2741 67.10719 1.143178       8.132126      2.654740       9.790268      -2.220517      14.60460  163.7448 73.62029 169.4426 80.68063 -5.697815      109.2214 
1 1 1 -19 11 5  o 233.3192 77.78194 15.72712       8.259370      19.65136       9.821879      6.251720       15.26216  251.9901 84.82140 188.4453 87.39023 63.54478       121.7856 
1 1 1 -19 11 6  f 133.6915 63.07155 -3.157269      8.538293      -0.9319659E-01 10.21488      -10.26186      15.55441  152.4132 70.95528 153.3658 75.35281 -0.9526062     103.5022 
1 1 1 -19 11 7  o 132.8833 60.76643 -0.5765888E-01 7.022392      17.67410       10.43584      -14.73097      9.493267  226.6058 86.02194 112.6865 55.99498 113.9193       102.6412 
1 1 1 -19 11 8  o 152.2886 64.78766 4.735985       6.707805      14.74040       10.28201      -2.676852      8.850634  205.7918 83.15813 133.4124 63.31723 72.37944       104.5196 
1 1 1 -19 11 9  o 114.8786 54.97536 -4.107863      6.962528      -9.551171      9.837617      1.355153       9.855410  120.9674 59.53123 147.1772 68.90440 -26.20982      91.05924 
1 1 1 -19 11 10 o 128.3724 59.44128 0.3671901      7.021728      13.16810       10.00017      -12.08171      9.861719  187.1420 79.34019 114.4547 56.90654 72.68728       97.63821 
1 1 1 -19 11 11 o 157.2741 66.46452 7.340277       6.981944      17.30870       9.996396      -2.154300      9.755915  200.0937 81.57594 130.5280 63.12097 69.56567       103.1450 
1 1 1 -19 11 12 o 355.3313 59.84388 35.57750       7.964662      36.51460       10.13674      34.06556       12.87573  312.8532 82.31837 243.2875 94.71471 69.56570       125.4878 
1 1 1 -19 11 13 o 220.1331 75.72502 19.87698       7.832791      27.84513       9.966907      7.007519       12.66665  239.1092 85.17696 144.9309 70.51387 94.17825       110.5772 
1 1 1 -19 11 14 o 128.9658 58.56129 4.664654       6.378197      0.7567710      9.030120      8.555295       9.010177  121.7126 59.28818 142.7051 66.50388 -20.99248      89.09464 
1 1 1 -19 11 15 o 87.59294 43.83410 -8.130657      6.272923      -9.041317      8.340250      -6.944499      9.518583  97.31261 48.95293 104.8856 52.69865 -7.572998      71.92731 
1 1 1 -19 11 16 o 104.0726 50.31476 0.4408337      6.188903      1.466929       7.955585      -1.131951      9.849472  110.8778 54.35812 109.4846 54.80934 1.393280       77.19370 
1 1 1 -19 11 17 o 94.27859 47.04626 -3.380456      7.000734      -1.738734      10.31885      -4.780550      9.529283  104.3698 52.74139 99.29189 50.23510 5.077942       72.83693 
1 1 1 -19 11 18 o 98.45469 49.16283 0.4171329E-01  7.698816      0.8617311      11.95906      -0.5386500     10.06087  103.5658 52.78190 100.7332 51.03719 2.832558       73.42155 
1 1 1 -19 12 1  o 129.3719 59.50941 -1.805150      6.871984      -3.803865      7.609398      7.033651       16.00190  128.2188 60.19321 198.2973 91.06433 -70.07860      109.1601 
1 1 1 -19 12 2  o 232.0710 71.07753 14.28028       7.008669      17.22977       7.827753      2.357957       15.73780  251.7238 74.68726 184.0662 86.46055 67.65767       114.2524 
1 1 1 -19 12 3  o 287.5651 61.79689 20.35304       6.695762      23.17624       9.082714      16.99231       9.909717  286.4656 79.05756 235.4908 84.82098 50.97476       115.9513 
1 1 1 -19 12 4  o 254.0411 83.20876 19.76885       9.467400      19.76885       9.467400      0.000000       0.000000  254.0411 83.20876 ?        ?        0.000000       83.20876 
1 1 1 -19 12 5  o 133.5645 60.54007 0.2140029      6.778066      2.290034       9.759913      -1.720091      9.420367  157.7462 71.94234 143.0346 67.09270 14.71165       98.37242 
1 1 1 -19 12 6  o 116.3406 55.04834 -3.571508      6.591760      -4.199105      9.463260      -2.979996      9.187183  134.5652 64.31355 136.2912 64.63303 -1.725952      91.17928 
1 1 1 -19 12 7  o 181.7928 69.61815 9.364523       6.872834      9.172791       10.01945      9.534909       9.445251  179.4376 77.78746 180.9711 76.93199 -1.533585      109.4048 
1 1 1 -19 12 8  o 183.4820 78.06428 11.01251       9.740074      0.000000       0.000000      11.01251       9.740074  ?        ?        183.4820 78.06428 0.000000       78.06428 
1 1 1 -19 12 9  o 137.2276 61.32997 2.799335       6.686039      11.71570       9.497508      -5.960961      9.414019  182.1215 77.27217 123.7789 60.34744 58.34258       98.04490 
1 1 1 -19 12 10 o 109.3420 52.85847 -4.478522      6.827403      -1.064038      9.494879      -8.134089      9.824361  132.6929 63.68437 118.9852 58.73379 13.70765       86.63346 
1 1 1 -19 12 11 o 160.2106 66.57363 8.476326       6.826999      15.95918       9.996323      1.935256       9.346110  186.6395 79.23712 136.2847 64.79227 50.35481       102.3551 
1 1 1 -19 12 12 o 118.3011 56.76032 -0.8703977     7.530064      9.494509       9.180149      -22.18486      13.16450  154.9208 70.31217 109.7041 55.86069 45.21665       89.80099 
1 1 1 -19 12 13 f 98.43710 48.88765 -7.216813      7.198075      -3.815077      8.823094      -13.98669      12.44689  112.9100 55.72099 111.3013 56.43192 1.608704       79.30567 
1 1 1 -19 12 14 o 93.92220 46.92393 -7.808917      7.055097      -2.830925      8.559063      -18.36015      12.46094  109.9684 54.38364 103.5661 52.87748 6.402374       75.85255 
1 1 1 -19 12 15 o 88.12426 44.05937 -7.092929      6.271517      -5.061510      8.121232      -10.09414      9.871207  100.6279 50.28470 99.76231 50.54622 0.8655624      71.29847 
1 1 1 -19 12 16 o 138.2570 61.15201 10.11221       6.474611      4.900249       8.163371      18.95073       10.63062  116.1815 56.54506 143.6982 68.53572 -27.51669      88.85094 
1 1 1 -19 12 17 o 84.68707 42.83979 -8.261691      6.915083      -7.953130      9.982332      -8.546378      9.588370  95.11553 48.45248 93.56488 47.64563 1.550652       67.95402 
1 1 1 -19 13 1  o 269.0525 64.98146 18.33943       6.713298      18.09912       7.470033      19.34849       15.30727  259.7727 71.69851 230.9476 98.05032 28.82507       121.4683 
1 1 1 -19 13 2  o 148.6239 64.77447 2.778538       7.023469      -1.862080      7.889670      20.49967       15.41760  134.6492 62.57632 231.8642 98.41920 -97.21498      116.6282 
1 1 1 -19 13 3  f 184.7562 67.06319 8.885842       6.211642      0.7244735      8.377887      18.84969       9.256919  146.0810 66.63472 246.6947 82.34920 -100.6137      105.9319 
1 1 1 -19 13 4  o 178.2397 67.31230 8.282578       6.369107      6.483642       9.197668      9.939905       8.828240  171.4115 74.41866 188.2399 76.69312 -16.82846      106.8643 
1 1 1 -19 13 5  o 170.9321 66.93999 7.547152       6.460660      8.509138       9.164096      6.596562       9.109653  178.2347 75.77374 169.3063 73.77968 8.928375       105.7596 
1 1 1 -19 13 6  o 412.2449 43.01794 38.42683       6.785598      46.48214       9.367764      29.53458       9.842389  431.6951 57.29196 306.4054 81.35110 125.2897       99.50061 
1 1 1 -19 13 7  o 178.7252 66.63438 9.230063       6.200687      18.23365       8.725278      0.4331855E-01  8.813581  230.0301 79.87746 138.6098 64.97844 91.42030       102.9690 
1 1 1 -19 13 8  o 210.2482 69.19910 13.74225       6.544844      8.436842       8.945144      19.85450       9.601262  167.2919 73.00031 226.6555 83.20780 -59.36357      110.6914 
1 1 1 -19 13 9  f 158.0201 65.26794 7.304200       6.505126      6.922746       9.113599      7.700407       9.288157  156.7516 70.70100 159.8160 71.79353 -3.064331      100.7618 
1 1 1 -19 13 10 o 178.6264 68.21353 11.04471       6.586747      -0.5053838     9.303990      22.64998       9.326184  130.0988 62.59474 231.7251 82.40997 -101.6263      103.4867 
1 1 1 -19 13 11 o 128.1749 58.71771 2.912644       6.597219      -2.056084      8.878831      9.037067       9.857476  121.2066 58.98636 153.3753 70.81058 -32.16869      92.16034 
1 1 1 -19 13 12 o 195.6685 72.63278 16.33787       7.351434      14.22895       9.071057      20.37370       12.54856  168.3045 73.47533 171.9017 79.54961 -3.597122      108.2902 
1 1 1 -19 13 13 o 150.3079 65.43744 9.920915       7.150838      10.85057       8.341249      7.343226       13.88944  149.7159 67.57294 135.0592 67.21326 14.65674       95.30858 
1 1 1 -19 13 14 o 164.5824 66.11913 12.75505       6.459138      12.62217       8.630283      12.92426       9.739102  147.6734 67.46580 144.0849 67.78729 3.588562       95.63865 
1 1 1 -19 13 15 o 90.18778 44.83405 -4.880774      6.111376      -2.895475      7.949210      -7.750194      9.556705  101.7220 50.65948 99.48830 50.33126 2.233681       71.41161 
1 1 1 -19 13 16 o 98.66540 48.82391 -1.151193      6.937928      -2.499469      8.079397      2.634814       13.53880  99.27409 49.68949 111.5922 56.80550 -12.31815      75.47125 
1 1 1 -19 14 1  o 136.5649 60.92391 1.158328       6.566019      1.823797       7.362330      -1.428393      14.51531  144.5490 64.49718 165.2528 79.15982 -20.70380      102.1086 
1 1 1 -19 14 2  o 188.3815 69.24019 9.659051       6.651241      6.272842       7.482401      22.41110       14.52025  166.3785 69.46288 233.5764 97.07746 -67.19786      119.3697 
1 1 1 -19 14 3  o 287.7636 63.39437 21.50015       6.893311      19.00441       7.881825      29.61987       14.21666  254.3112 74.81027 263.5493 100.3172 -9.238083      125.1404 
1 1 1 -19 14 4  o 109.3997 51.82217 -3.472889      5.873730      -12.37084      8.039672      6.713915       8.602253  105.0709 52.09404 167.3378 72.30927 -62.26685      89.12025 
1 1 1 -19 14 5  o 120.9834 55.85102 -0.7579462     6.130463      -2.764371      8.158249      1.844575       9.291430  127.6847 60.65445 147.7608 68.40396 -20.07613      91.42245 
1 1 1 -19 14 6  o 414.1111 40.00294 38.55473       6.353240      40.82423       8.530615      35.72809       9.520315  401.4656 56.25966 349.6424 72.49249 51.82318       91.76225 
1 1 1 -19 14 7  o 254.1556 62.58700 18.03766       6.136553      15.35920       7.972502      21.93147       9.612576  209.3401 75.97792 238.6110 83.78493 -29.27087      113.1042 
1 1 1 -19 14 8  o 201.8094 67.95927 13.11059       6.304969      12.35422       8.750802      13.92711       9.092134  181.0102 75.30740 187.8505 77.32967 -6.840317      107.9402 
1 1 1 -19 14 9  o 144.5832 62.66066 5.670330       6.497951      -4.116265      8.835258      17.20049       9.590056  119.4644 58.29206 195.5312 79.82931 -76.06683      98.84676 
1 1 1 -19 14 10 o 106.9012 51.52739 -2.847315      6.373211      -5.485289      8.858668      -0.1704847E-01 9.175860  114.0202 56.18559 127.2078 61.44303 -13.18761      83.25903 
1 1 1 -19 14 11 o 201.0196 69.81013 15.64861       6.664577      15.53300       9.046922      15.78579       9.855128  175.4986 74.96487 171.5552 75.68452 3.943420       106.5264 
1 1 1 -19 14 12 o 253.7889 71.64984 24.59701       7.371141      31.19944       8.976871      10.93118       12.91490  265.4158 80.26303 142.6073 69.77504 122.8085       106.3518 
1 1 1 -19 14 13 o 91.60265 45.96669 -8.848228      7.128377      -12.47301      8.200651      2.357571       14.41879  91.98293 46.54490 124.6974 62.93350 -32.71443      78.27550 
1 1 1 -19 14 14 o 268.3523 63.26451 25.79622       6.485631      21.15205       8.417647      32.58073       10.17411  182.9655 74.75533 213.0686 83.83059 -30.10316      112.3206 
1 1 1 -19 14 15 o 121.3144 56.21266 6.214389       6.295871      4.814000       8.153750      8.282083       9.907776  115.7758 56.38345 122.1299 60.03292 -6.354126      82.35925 
1 1 1 -19 15 1  o 184.3855 67.61935 9.364397       6.338412      3.261750       7.123816      32.55270       13.88635  147.3059 64.68885 279.5895 100.4389 -132.2836      119.4681 
1 1 1 -19 15 2  o 167.1706 65.44839 7.248841       6.174610      9.166852       6.941831      -0.1779719E-01 13.51186  180.3093 69.72655 158.7173 76.12039 21.59203       103.2284 
1 1 1 -19 15 3  o 123.1452 56.82100 -0.6233339     6.333670      -0.5387264     7.103767      -0.9513218     13.98664  128.6719 59.65313 155.9865 75.46749 -27.31468      96.19687 
1 1 1 -19 15 4  o 165.6965 63.24294 7.456520       5.659952      5.074758       7.488128      10.63079       8.644617  153.0184 66.78089 182.1013 75.22885 -29.08289      100.5936 
1 1 1 -19 15 5  o 168.6444 63.86311 8.107804       5.743030      5.525948       7.436008      11.92443       9.040936  152.9272 66.64984 184.7979 76.68616 -31.87070      101.6020 
1 1 1 -19 15 6  o 186.2319 63.79010 10.36893       5.556029      6.466629       7.154524      16.29782       8.818759  154.8108 66.41015 206.7804 78.93784 -51.96964      103.1576 
1 1 1 -19 15 7  o 103.3791 49.81976 -4.037740      5.950780      3.299193       7.800912      -14.24957      9.203222  139.0552 63.75646 104.6797 52.48738 34.37548       82.58215 
1 1 1 -19 15 8  o 147.8473 62.94102 6.363935       6.338709      -3.311882      8.632964      17.68213       9.336945  119.9648 58.33138 199.0208 79.65731 -79.05605      98.73114 
1 1 1 -19 15 9  o 308.7595 56.26548 26.53508       6.498106      20.09961       8.793856      34.27552       9.644335  212.0384 79.29488 298.6365 81.07458 -86.59813      113.4053 
1 1 1 -19 15 10 o 306.8830 57.95974 27.46561       6.654426      28.07593       9.028262      26.73967       9.846436  254.5382 81.07846 228.8895 84.22786 25.64867       116.9104 
1 1 1 -19 15 11 o 98.89954 48.47617 -4.157768      6.317117      -4.414300      8.543238      -3.848309      9.383230  109.2972 54.10165 113.3312 56.20490 -4.034073      78.01269 
1 1 1 -19 15 12 o 118.4562 56.08351 2.739671       6.862157      6.516989       8.454958      -4.550980      11.74635  131.4459 62.23917 114.9058 57.84006 16.54005       84.96579 
1 1 1 -19 15 13 o 87.04092 43.88055 -10.06747      6.904139      -9.301292      8.059600      -12.17975      13.38213  94.11567 47.44255 107.1330 54.70666 -13.01738      72.41280 
1 1 1 -19 15 14 o 108.4207 51.89383 2.104993       6.209822      0.5876833      8.044179      4.342746       9.769011  108.2496 53.38054 117.2384 58.00051 -8.988747      78.82601 
1 1 1 -19 16 1  o 278.7352 58.78704 20.01435       6.163297      25.46852       6.886652      -1.933671      13.81469  316.1942 58.22784 153.1468 74.30916 163.0475       94.40515 
1 1 1 -19 16 2  o 321.1474 53.29802 25.49551       6.414217      23.69724       7.233199      32.11488       13.87752  293.8057 65.10534 260.3216 99.10748 33.48407       118.5791 
1 1 1 -19 16 3  o 85.76488 42.80001 -11.27396      5.797144      -13.04942      6.447411      -3.780110      13.24593  88.50152 44.31076 144.2856 70.61046 -55.78405      83.36234 
1 1 1 -19 16 4  f 166.3441 64.38373 8.052266       5.922869      7.334174       6.613848      10.96027       13.30950  160.6381 66.02032 173.4641 80.83482 -12.82602      104.3693 
1 1 1 -19 16 5  o 203.3703 62.37374 12.16508       5.395134      9.939614       6.681725      16.33408       9.145209  175.1880 68.22247 202.1176 79.49254 -26.92969      104.7538 
1 1 1 -19 16 6  o 173.3957 63.91883 9.464478       5.674078      -3.036059      7.299607      28.54811       9.019151  115.1340 55.40706 284.1498 78.91755 -169.0157      96.42574 
1 1 1 -19 16 7  o 225.3335 66.33537 16.31275       6.195143      12.61891       8.306325      20.94341       9.300182  176.7858 73.44484 217.3366 81.49274 -40.55080      109.7051 
1 1 1 -19 16 8  o 228.7146 66.16120 17.21926       6.210942      17.51034       8.453037      16.87774       9.156244  198.7396 76.91778 188.5190 77.60297 10.22064       109.2637 
1 1 1 -19 16 9  o 115.2641 54.19188 0.6675997      6.206600      -2.694907      8.567303      4.381532       9.003877  115.8097 56.69870 134.5780 63.86825 -18.76830      85.40431 
1 1 1 -19 16 10 o 85.23028 42.72050 -9.829737      6.071125      -22.11300      8.363476      3.852775       8.826997  84.33347 43.07920 129.1793 61.84034 -44.84586      75.36607 
1 1 1 -19 16 11 f 174.7990 66.64124 13.07067       6.280090      17.81982       8.464347      7.254772       9.366846  179.0767 74.24706 134.2700 64.12035 44.80669       98.10223 
1 1 1 -19 16 12 o 102.1812 50.25473 -2.595186      6.974130      -7.932220      8.163196      11.82680       13.41908  97.41923 48.92757 134.4652 66.77539 -37.04594      82.78200 
1 1 1 -19 17 1  o 191.6187 66.13637 10.89513       5.977144      8.809507       6.765902      18.30835       12.75590  172.4833 68.20304 202.4989 87.77705 -30.01564      111.1596 
1 1 1 -19 17 2  o 155.0141 63.21118 6.386388       6.003794      4.891993       6.568734      13.97029       14.79773  146.8869 63.33004 181.1900 84.70214 -34.30312      105.7598 
1 1 1 -19 17 3  o 124.5086 56.03982 1.533771       5.690633      1.408924       6.354764      2.039160       12.78565  127.5772 58.13210 150.1939 72.54156 -22.61677      92.96031 
1 1 1 -19 17 4  o 159.2377 62.20676 7.443769       5.568793      10.85959       6.111283      -9.274047      13.51994  183.8534 66.55231 131.1135 65.41972 52.73990       93.32175 
1 1 1 -19 17 5  o 117.1488 54.08926 0.4166734      5.753140      -4.376898      6.355336      22.17582       13.54035  104.6489 50.68832 194.0060 86.95037 -89.35709      100.6463 
1 1 1 -19 17 6  f 120.4310 54.80998 1.650859       5.627726      1.829557       7.429804      1.410341       8.619717  128.6325 60.09453 131.1606 62.31747 -2.528107      86.57263 
1 1 1 -19 17 7  o 179.4920 67.03307 11.70331       6.280295      8.992055       8.284607      15.36649       9.629760  154.5387 68.72269 177.6178 76.62910 -23.07919      102.9312 
1 1 1 -19 17 8  o 136.5802 59.36333 5.521617       5.865742      4.371874       7.870338      6.958287       8.797747  133.3503 62.14796 142.6361 66.21845 -9.285828      90.81438 
1 1 1 -19 17 9  o 99.79825 50.00087 -9.596622      8.275090      -9.596622      8.275090      0.000000       0.000000  99.79825 50.00087 ?        ?        0.000000       50.00087 
1 1 1 -19 18 3  o 156.5565 62.09497 7.154646       5.624223      7.582471       6.259773      5.362891       12.81047  158.5877 64.59247 153.8052 73.85828 4.782471       98.11846 
1 1 1 -19 18 4  o 138.9652 59.20688 4.812735       5.617014      4.073561       6.199083      8.203588       13.27726  136.1084 60.03735 157.0115 75.34319 -20.90311      96.33836 
1 1 1 -18 0  1  o 115.2087 74.87159 -0.1267667     8.034796      -0.1267667     8.034796      -0.1267667     8.034796  115.2087 74.87159 115.2087 74.87159 -0.000000      0.000000 
1 1 1 -18 0  2  o 389.8510 65.79080 32.60709       9.108877      32.60709       9.108877      32.60709       9.108877  389.8510 65.79080 389.8510 65.79080 0.000000       0.000000 
1 1 1 -18 0  3  o 218.4069 97.20938 13.99255       8.733566      13.99255       8.733566      13.99255       8.733566  218.4069 97.20938 218.4069 97.20938 -0.000000      0.000000 
1 1 1 -18 0  4  o 553.9390 47.25191 61.70376       9.994878      61.70376       9.994878      61.70376       9.994878  553.9390 47.25191 553.9390 47.25191 -0.000000      0.000000 
1 1 1 -18 0  5  o 663.2854 41.80727 87.39420       10.67105      87.39420       10.67105      87.39420       10.67105  663.2854 41.80727 663.2854 41.80727 0.000000       0.000000 
1 1 1 -18 0  6  o 238.5051 101.1112 16.41782       9.490607      16.41782       9.490607      16.41782       9.490607  238.5051 101.1112 238.5051 101.1112 0.000000       0.000000 
1 1 1 -18 0  7  o 215.9813 102.1635 14.08701       9.708993      14.08701       9.708993      14.08701       9.708993  215.9813 102.1635 215.9813 102.1635 0.000000       0.000000 
1 1 1 -18 0  8  o 116.1575 78.33500 -3.826221      10.22892      -3.826221      10.22892      -3.826221      10.22892  116.1575 78.33500 116.1575 78.33500 -0.000000      0.000000 
1 1 1 -18 0  9  o 804.5667 40.44281 128.0936       12.56378      128.0936       12.56378      128.0936       12.56378  804.5667 40.44281 804.5667 40.44281 -0.000000      0.000000 
1 1 1 -18 0  10 o 252.9928 110.5798 19.03862       11.30848      19.03862       11.30848      19.03862       11.30848  252.9928 110.5798 252.9928 110.5798 -0.000000      0.000000 
1 1 1 -18 0  11 o 203.6210 117.4243 12.21725       14.96004      12.21725       14.96004      12.21725       14.96004  203.6210 117.4243 203.6210 117.4243 -0.000000      0.000000 
1 1 1 -18 0  12 o 176.8179 112.5513 4.595155       16.98622      4.595155       16.98622      4.595155       16.98622  176.8179 112.5513 176.8179 112.5513 0.000000       0.000000 
1 1 1 -18 0  13 o 149.7574 101.5336 -5.675931      17.63763      -5.675931      17.63763      -5.675931      17.63763  149.7574 101.5336 149.7574 101.5336 -0.000000      0.000000 
1 1 1 -18 0  14 o 102.4546 73.06106 -16.86234      12.89979      -16.86234      12.89979      -16.86234      12.89979  102.4546 73.06106 102.4546 73.06106 0.000000       0.000000 
1 1 1 -18 0  15 o 309.3900 116.4259 27.55236       13.08387      27.55236       13.08387      27.55236       13.08387  309.3900 116.4259 309.3900 116.4259 0.000000       0.000000 
1 1 1 -18 0  16 o 112.0598 78.26353 -9.911943      12.49134      -9.911943      12.49134      -9.911943      12.49134  112.0598 78.26353 112.0598 78.26353 0.000000       0.000000 
1 1 1 -18 0  17 o 185.0998 116.2434 8.659091       17.44098      8.659091       17.44098      8.659091       17.44098  185.0998 116.2434 185.0998 116.2434 0.000000       0.000000 
1 1 1 -18 0  18 f 112.0557 80.82043 -26.47598      17.80034      -26.47598      17.80034      -26.47598      17.80034  112.0557 80.82043 112.0557 80.82043 0.000000       0.000000 
1 1 1 -18 0  19 o 102.8309 72.53265 -10.83336      11.55528      -10.83336      11.55528      -10.83336      11.55528  102.8309 72.53265 102.8309 72.53265 -0.000000      0.000000 
1 1 1 -18 0  20 o 95.91330 67.70485 -9.680224      10.13216      -9.680224      10.13216      -9.680224      10.13216  95.91330 67.70485 95.91330 67.70485 -0.000000      0.000000 
1 1 1 -18 0  21 o 172.7943 96.10727 10.56926       9.546495      10.56926       9.546495      10.56926       9.546495  172.7943 96.10727 172.7943 96.10727 -0.000000      0.000000 
1 1 1 -18 0  22 o 172.2672 94.28799 10.80831       9.022666      10.80831       9.022666      10.80831       9.022666  172.2672 94.28799 172.2672 94.28799 0.000000       0.000000 
1 1 1 -18 0  23 o 161.3496 93.51933 9.705524       9.563787      9.705524       9.563787      9.705524       9.563787  161.3496 93.51933 161.3496 93.51933 -0.000000      0.000000 
1 1 1 -18 0  24 o 110.3683 74.96169 -1.282693      9.701745      -1.282693      9.701745      -1.282693      9.701745  110.3683 74.96169 110.3683 74.96169 -0.000000      0.000000 
1 1 1 -18 1  1  o 227.0136 65.23170 11.26960       6.055826      11.79499       8.554556      10.74184       8.573938  233.0843 79.15675 225.4561 79.13114 7.628204       111.9264 
1 1 1 -18 1  2  o 188.1587 66.97919 6.990803       6.162004      18.84263       8.639834      -5.279121      8.790908  287.4603 76.17102 143.6702 66.51932 143.7902       101.1279 
1 1 1 -18 1  3  o 292.2721 57.23808 18.39769       6.264348      15.96465       8.684597      21.03665       9.044619  263.4061 78.78658 302.5970 76.82716 -39.19086      110.0443 
1 1 1 -18 1  4  o 259.5175 63.73859 14.94935       6.377176      -1.419206      9.085176      30.84738       8.953641  159.5224 71.37857 375.8283 63.61521 -216.3059      95.61273 
1 1 1 -18 1  5  o 195.5294 69.24937 7.914400       6.578764      -2.866502      9.543123      17.67771       9.081581  157.1093 71.45295 273.6764 80.24428 -116.5671      107.4461 
1 1 1 -18 1  6  o 217.5697 70.10326 10.61202       6.734716      15.93773       9.607339      5.466484       9.443429  258.1488 83.78593 191.9303 78.88584 66.21844       115.0785 
1 1 1 -18 1  7  o 960.8679 35.87337 186.4848       13.38640      186.4848       13.38640      0.000000       0.000000  960.8679 35.87337 ?        ?        0.000000       35.87337 
1 1 1 -18 1  8  o 670.5932 43.49794 93.19995       11.26693      0.000000       0.000000      93.19995       11.26693  ?        ?        670.5932 43.49794 0.000000       43.49794 
1 1 1 -18 1  9  o 432.8844 48.40854 39.86201       7.998742      32.33029       11.08537      48.04253       11.55297  362.4982 80.80639 458.8435 66.79388 -96.34528      104.8384 
1 1 1 -18 1  10 o 326.7196 68.00387 25.10983       8.347862      36.05404       12.20453      15.48792       11.44351  374.6311 85.73956 243.5799 90.58029 131.0512       124.7239 
1 1 1 -18 1  11 o 227.1213 96.79885 12.56620       15.02335      12.56620       15.02335      0.000000       0.000000  227.1213 96.79885 ?        ?        0.000000       96.79885 
1 1 1 -18 1  12 o 139.5213 67.50331 -10.38432      11.19229      -10.13585      16.77514      -10.58367      15.02556  169.6798 82.22694 160.9581 77.95676 8.721710       113.3072 
1 1 1 -18 1  13 o 233.4936 87.46859 16.30409       10.70923      11.66982       13.77510      23.38447       17.02676  209.8414 91.08812 250.2754 104.6624 -40.43399      138.7489 
1 1 1 -18 1  14 o 170.2438 73.96281 5.408980       9.097840      14.73802       12.62664      -4.663522      13.12012  214.4142 89.92924 155.8754 74.82400 58.53883       116.9867 
1 1 1 -18 1  15 o 264.5867 96.99600 27.58566       13.04036      27.58566       13.04036      0.000000       0.000000  264.5867 96.99600 ?        ?        0.000000       96.99600 
1 1 1 -18 1  16 o 158.1715 70.79905 5.060878       8.946644      2.946833       12.66648      7.165590       12.63849  160.5626 76.07011 171.5257 79.53711 -10.96307      110.0582 
1 1 1 -18 1  17 o 261.7404 86.53418 26.65308       10.23045      37.60448       12.74276      6.793797       17.15973  292.8100 96.56561 165.5730 80.88816 127.2371       125.9675 
1 1 1 -18 1  18 o 122.6264 61.54313 -12.24691      12.80010      8.323764       18.25824      -32.12855      17.94984  158.0456 78.38397 121.1242 61.97191 36.92134       99.92279 
1 1 1 -18 1  19 o 153.3821 70.25858 9.642537       9.442325      25.42183       17.78395      3.448031       11.14263  170.0006 82.89600 136.9734 66.52484 33.02719       106.2888 
1 1 1 -18 1  20 o 166.1261 68.73582 12.81392       7.232939      0.3954045      10.04186      26.20289       10.42684  121.5229 59.87053 201.4845 82.86138 -79.96161      102.2276 
1 1 1 -18 1  21 o 112.1601 53.64745 2.256063       6.611590      -0.6455874     9.765985      4.711287       8.983366  111.8943 55.79349 121.0683 59.00944 -9.174034      81.20977 
1 1 1 -18 1  22 o 103.7988 50.66980 1.586487       6.695940      19.80042       9.873702      -13.92283      9.111176  144.4947 68.06327 87.91338 44.91240 56.58129       81.54589 
1 1 1 -18 1  23 f 93.20631 46.31772 -0.3049684     6.499076      3.475476       9.770666      -3.304868      8.703743  102.5459 51.76006 93.09380 47.19920 9.452110       70.04904 
1 1 1 -18 1  24 o 87.82707 44.07271 -0.6873165     6.554222      -2.440978      9.603550      0.8416657      8.967268  90.06911 46.02149 92.83685 47.15578 -2.767738      65.89117 
1 1 1 -18 2  1  o 174.3799 65.92162 5.260908       6.112585      1.401125       8.956574      8.625991       8.362927  172.2597 74.11076 209.9072 77.55766 -37.64745      107.2735 
1 1 1 -18 2  2  o 488.3356 41.49766 48.46656       7.795352      47.99221       14.75586      48.65020       9.181103  454.4431 86.77467 484.8217 49.45481 -30.37857      99.87804 
1 1 1 -18 2  3  o 499.8700 48.37431 51.69151       9.273291      51.69151       9.273291      0.000000       0.000000  499.8700 48.37431 ?        ?        0.000000       48.37431 
1 1 1 -18 2  4  o 357.0348 49.74258 26.73449       6.709746      19.72096       9.592465      33.45341       9.388838  289.1669 81.77028 391.3110 63.99459 -102.1441      103.8349 
1 1 1 -18 2  5  o 167.2117 66.54661 4.199339       6.479793      0.4662668      9.453555      7.507415       8.899173  169.3169 74.43333 201.7498 78.68678 -32.43289      108.3140 
1 1 1 -18 2  6  o 490.8474 37.79021 48.99186       7.148282      44.41049       10.49261      52.95983       9.764959  451.1232 61.49291 501.5924 50.83128 -50.46927      79.78218 
1 1 1 -18 2  7  o 228.5960 71.12529 12.03965       6.986765      -2.222689      10.25023      24.41628       9.548593  162.9506 74.08765 320.2635 77.58967 -157.3129      107.2806 
1 1 1 -18 2  8  o 371.2306 54.32797 29.85886       7.600600      37.00786       10.96994      23.25845       10.54065  397.9362 73.69853 303.8250 85.64690 94.11118       112.9905 
1 1 1 -18 2  9  o 250.3373 75.26059 15.23943       7.909769      20.45436       11.89081      11.10037       10.59347  276.1770 93.32659 220.9746 85.94380 55.20239       126.8708 
1 1 1 -18 2  10 o 275.5161 80.89522 19.41916       9.223870      18.45615       15.59314      19.93751       11.44003  255.9865 102.7701 270.2426 91.53944 -14.25612      137.6269 
1 1 1 -18 2  11 o 392.5053 61.96004 35.50977       9.131261      49.90528       15.80696      28.29991       11.18660  418.2265 98.87933 323.4980 87.10503 94.72849       131.7741 
1 1 1 -18 2  12 o 149.6846 70.26093 -3.995519      10.36173      -2.611965      16.76545      -4.850632      13.18041  183.4936 87.10289 163.4110 77.47123 20.08260       116.5706 
1 1 1 -18 2  13 o 268.1035 84.98914 21.08958       9.929365      37.95278       12.93139      -3.136250      15.49938  355.1731 92.74628 172.8320 82.52055 182.3411       124.1431 
1 1 1 -18 2  14 o 187.3982 85.50627 7.177609       13.80786      7.177609       13.80786      0.000000       0.000000  187.3982 85.50627 ?        ?        0.000000       85.50627 
1 1 1 -18 2  15 o 171.3913 79.42164 4.860268       12.57098      0.000000       0.000000      4.860268       12.57098  ?        ?        171.3913 79.42164 0.000000       79.42164 
1 1 1 -18 2  16 o 108.1004 53.79637 -13.50715      8.896665      -2.124493      12.65186      -24.64107      12.51286  148.7302 71.91314 114.5931 57.92762 34.13717       92.34235 
1 1 1 -18 2  17 o 111.5239 55.74841 -14.00139      10.02026      -16.48867      12.34853      -9.206193      17.14573  119.7396 60.14304 143.8241 72.04610 -24.08451      93.85002 
1 1 1 -18 2  18 o 103.3356 52.80050 -30.69843      12.64316      -23.16566      18.32033      -37.54832      17.47021  127.6858 65.09683 116.0383 59.49633 11.64747       88.18963 
1 1 1 -18 2  19 o 156.7003 71.46548 10.88412       9.631030      18.32977       18.24901      8.009703       11.33868  158.1166 78.40987 146.5833 70.14993 11.53331       105.2099 
1 1 1 -18 2  20 f 125.3367 58.97184 3.961246       7.373581      11.67328       10.86589      -2.621395      10.03879  145.3461 69.31293 115.7731 57.53773 29.57307       90.08259 
1 1 1 -18 2  21 o 119.3468 56.55540 4.499550       7.008661      3.642008       10.45159      5.200273       9.447743  119.1304 59.12112 121.6689 59.56168 -2.538490      83.92200 
1 1 1 -18 2  22 o 132.9580 59.66115 9.986174       6.395172      6.312464       9.960588      12.56266       8.341550  114.3202 56.89664 131.7126 62.19985 -17.39238      84.29739 
1 1 1 -18 2  23 o 104.3788 50.75465 4.571978       6.537408      9.527785       9.879776      0.7121077      8.719193  110.3954 55.21017 97.98553 49.38727 12.40987       74.07608 
1 1 1 -18 2  24 o 79.93223 40.50038 -5.208670      6.340876      -4.808507      9.544342      -5.524841      8.483765  87.68322 44.88674 85.22899 43.52452 2.454231       62.52362 
1 1 1 -18 3  1  o 449.5097 37.48931 40.73126       6.484767      46.37255       8.995773      34.62840       9.356554  473.5299 49.65634 401.7869 61.95608 71.74295       79.39967 
1 1 1 -18 3  2  o 573.1636 29.50842 65.26351       6.546004      64.26736       9.062456      66.35026       9.465594  562.4556 41.78721 570.7961 43.01725 -8.340515      59.97212 
1 1 1 -18 3  3  o 116.9127 56.12138 -9.147773      7.381263      -28.13922      13.86943      -1.643233      8.718498  136.5055 67.80534 155.9185 69.83342 -19.41295      97.33587 
1 1 1 -18 3  4  o 445.8337 41.06805 40.59464       7.030641      26.07625       9.905349      55.33485       9.980735  335.6653 77.54681 514.8558 50.56964 -179.1905      92.57859 
1 1 1 -18 3  5  o 511.9047 35.30530 52.87133       6.975796      55.30266       9.903441      50.47713       9.827526  513.9619 50.25985 489.2322 52.54848 24.72964       72.71448 
1 1 1 -18 3  6  o 332.1915 55.72107 23.85527       6.933909      21.45039       10.11043      25.99085       9.527561  296.7690 83.95907 333.8925 75.27482 -37.12344      112.7627 
1 1 1 -18 3  7  o 179.5705 70.05529 5.765973       7.055341      8.994836       10.34348      2.956556       9.648278  212.7002 84.25776 179.2408 77.01153 33.45941       114.1497 
1 1 1 -18 3  8  o 315.0913 80.78110 24.40065       9.931396      0.000000       0.000000      24.40065       9.931396  ?        ?        315.0913 80.78110 0.000000       80.78110 
1 1 1 -18 3  9  f 188.9436 75.52007 6.708091       8.379598      19.64502       15.12061      0.9737908      10.06686  265.6796 102.8603 170.4798 75.78596 95.19983       127.7645 
1 1 1 -18 3  10 o 279.5680 78.68757 19.80021       8.904389      21.38632       16.09655      19.10082       10.68880  267.2529 105.3498 266.4339 88.46901 0.8189697      137.5694 
1 1 1 -18 3  11 o 466.6457 53.70729 48.27651       9.555496      55.54116       17.15438      45.00838       11.50582  433.8849 103.2928 431.6161 71.11987 2.268738       125.4090 
1 1 1 -18 3  12 o 152.4510 73.86703 -10.52780      13.52516      0.000000       0.000000      -10.52780      13.52516  ?        ?        152.4510 73.86703 0.000000       73.86703 
1 1 1 -18 3  13 o 133.4682 63.99662 -6.865329      9.538630      2.373142       13.24523      -16.81868      13.74814  177.2772 81.92831 139.8171 69.10346 37.46010       107.1799 
1 1 1 -18 3  14 o 188.6677 80.53133 9.207293       10.42659      18.73247       13.89995      -3.048141      15.76671  226.5431 94.63667 167.4455 80.79514 59.09760       124.4345 
1 1 1 -18 3  15 o 176.6198 75.04861 8.207902       8.981120      17.04183       13.35026      0.9048795      12.13848  210.9227 90.60543 158.8265 75.01273 52.09619       117.6276 
1 1 1 -18 3  16 o 140.8059 67.11882 -1.297510      10.16587      5.221079       12.74006      -12.72247      16.86638  164.7718 77.52317 144.7121 72.33688 20.05963       106.0305 
1 1 1 -18 3  17 o 130.4733 63.08075 -2.809896      9.730127      -1.587363      11.70218      -5.548377      17.51424  140.1787 68.10307 147.7440 73.83148 -7.565338      100.4446 
1 1 1 -18 3  18 o 173.1557 79.14880 14.66172       11.89754      23.15202       17.99336      8.065931       15.85931  177.6479 85.86273 155.2737 76.24911 22.37427       114.8318 
1 1 1 -18 3  19 o 155.5695 70.84668 10.77270       9.421523      4.341280       17.68107      13.32295       11.13387  141.2590 71.08739 159.6263 74.23486 -18.36731      102.7825 
1 1 1 -18 3  20 o 120.7580 57.50677 2.745797       7.424827      1.256603       10.87567      4.045774       10.16128  123.0064 60.91513 127.3719 62.22969 -4.365532      87.08150 
1 1 1 -18 3  21 o 105.2230 51.28848 0.2336075E-01  6.788355      1.502361       10.07462      -1.206514      9.187025  114.3940 56.98032 108.6508 54.16638 5.743103       78.61777 
1 1 1 -18 3  22 o 99.02648 48.48959 0.4426385      6.273430      5.732909       9.324879      -3.931622      8.479232  112.7199 55.92343 96.58590 48.68449 16.13402       74.14586 
1 1 1 -18 3  23 o 83.70872 42.11982 -4.554044      6.195220      -7.383410      9.348762      -2.338696      8.272378  89.34772 45.63288 92.77304 46.92134 -3.425323      65.45206 
1 1 1 -18 3  24 o 94.75773 48.24482 2.907791       9.799480      2.907791       9.799480      0.000000       0.000000  94.75773 48.24482 ?        ?        0.000000       48.24482 
1 1 1 -18 4  1  f 286.9093 55.64044 17.59295       5.975856      16.51353       8.191351      18.82106       8.737319  269.7397 75.31321 287.1145 76.84318 -17.37479      107.5963 
1 1 1 -18 4  2  o 200.3092 66.77034 8.477346       6.086402      16.89445       8.667983      0.2912454      8.548211  271.0442 78.08867 163.1061 71.26288 107.9380       105.7177 
1 1 1 -18 4  3  o 400.8756 42.90815 32.97128       6.576283      27.14114       9.193538      39.08023       9.410804  348.1193 70.42162 427.8093 58.15014 -79.69003      91.32712 
1 1 1 -18 4  4  o 253.3474 66.52508 14.42921       6.629056      6.266888       9.431961      22.39695       9.318866  197.6159 79.71939 310.0892 77.57660 -112.4732      111.2354 
1 1 1 -18 4  5  o 165.0735 70.45717 2.013048       7.980464      16.93881       15.75204      -3.140901      9.256326  266.3123 104.4589 153.3237 69.97825 112.9886       125.7324 
1 1 1 -18 4  6  o 190.5284 70.24632 7.327271       6.853471      9.242694       10.29597      5.803355       9.183660  215.0896 84.42504 191.6439 78.16689 23.44569       115.0550 
1 1 1 -18 4  7  o 232.0445 73.53127 12.57611       7.433094      -5.836161      11.28558      26.68298       9.878374  158.5513 74.06937 334.3495 77.57699 -175.7982      107.2588 
1 1 1 -18 4  8  o 220.0530 76.90644 11.27657       8.094514      6.498522       14.38502      13.49047       9.791850  213.0032 92.77048 236.0126 84.38816 -23.00940      125.4102 
1 1 1 -18 4  9  o 327.7931 70.63994 25.45275       8.727331      18.16527       16.22196      28.42122       10.35334  257.4749 104.3086 338.1500 80.07584 -80.67508      131.5006 
1 1 1 -18 4  10 o 352.8615 67.44945 29.34583       8.906022      30.05908       16.62551      29.05879       10.54693  304.4321 109.8361 337.0779 81.47213 -32.64578      136.7541 
1 1 1 -18 4  11 f 672.5009 45.93396 96.95284       11.92475      0.000000       0.000000      96.95284       11.92475  ?        ?        672.5009 45.93396 0.000000       45.93396 
1 1 1 -18 4  12 o 265.7037 74.88261 18.58737       8.058616      30.54555       12.47183      10.01635       10.55878  316.9217 94.32967 202.3636 83.32230 114.5580       125.8598 
1 1 1 -18 4  13 o 277.9368 82.95964 22.52660       9.636376      30.69968       12.81706      11.89960       14.61506  304.4960 96.56355 207.5429 91.83313 96.95309       133.2586 
1 1 1 -18 4  14 o 370.6782 73.94736 37.26328       10.27187      64.00722       13.96703      5.758408       15.15934  481.7460 77.26646 183.2875 85.69794 298.4585       115.3874 
1 1 1 -18 4  15 o 95.07737 48.03315 -21.15919      8.526109      -16.03509      12.82817      -25.21388      11.41129  128.9012 64.22128 109.5793 55.38441 19.32185       84.80452 
1 1 1 -18 4  16 o 167.8002 74.86067 7.802883       9.914437      11.48537       12.36869      1.184036       16.58228  180.8319 81.88926 161.3731 78.97943 19.45872       113.7700 
1 1 1 -18 4  17 o 175.0362 76.47187 11.49647       9.842582      0.3156280      11.90903      35.59419       17.48345  143.6078 69.51692 221.7497 99.13477 -78.14194      121.0797 
1 1 1 -18 4  18 o 103.3325 51.99007 -14.54244      9.429255      15.51813       16.61689      -28.81897      11.45150  165.0219 80.39384 98.50022 50.32336 66.52166       94.84518 
1 1 1 -18 4  19 o 119.7236 58.65140 -1.671417      9.209947      6.249549       15.68977      -5.835646      11.37614  141.0697 70.40125 119.0543 59.49586 22.01535       92.17426 
1 1 1 -18 4  20 o 121.4396 57.55437 3.391003       7.262953      -1.164769      10.33555      7.835342       10.20836  116.9830 58.17884 134.1610 64.80302 -17.17802      87.08737 
1 1 1 -18 4  21 o 107.9169 52.10336 1.577440       6.580826      5.183634       9.457984      -1.806901      9.162437  119.1741 58.59514 106.5642 53.27514 12.60992       79.19363 
1 1 1 -18 4  22 o 136.4876 60.67519 11.35268       6.452729      22.47486       9.243810      0.7820660      9.011692  154.1834 70.19994 103.5486 51.92271 50.63485       87.31552 
1 1 1 -18 4  23 o 92.18168 45.72205 0.1139850      6.217398      5.893822       9.155668      -4.832318      8.469790  104.1021 52.21899 89.52467 45.50901 14.57748       69.26682 
1 1 1 -18 4  24 o 78.03455 39.65863 -6.383580      6.404711      -8.591286      9.500548      -4.544412      8.671391  83.86546 43.05838 85.86958 43.86398 -2.004120      61.46603 
1 1 1 -18 5  1  o 293.2516 59.84250 18.63181       6.584456      27.45767       8.346861      4.090837       10.71374  355.9727 62.66669 195.8441 82.52489 160.1287       103.6218 
1 1 1 -18 5  2  o 128.8479 58.14326 -2.166612      6.172254      -7.928295      8.751756      3.535234       8.706193  134.4021 63.54371 179.8363 74.99190 -45.43419      98.29337 
1 1 1 -18 5  3  o 592.0960 43.05460 71.66773       9.832331      71.66773       9.832331      0.000000       0.000000  592.0960 43.05460 ?        ?        0.000000       43.05460 
1 1 1 -18 5  4  o 775.7726 25.92607 119.0165       7.810864      111.8833       10.83151      126.7448       11.27425  743.9214 37.61372 793.4684 36.58727 -49.54700      52.47304 
1 1 1 -18 5  5  o 514.7263 36.65722 53.69709       7.279758      39.49496       10.27987      67.98387       10.31046  422.8735 64.65003 572.1524 46.81210 -149.2789      79.81853 
1 1 1 -18 5  6  o 266.4327 86.74020 17.51113       10.29385      0.000000       0.000000      17.51113       10.29385  ?        ?        266.4327 86.74020 0.000000       86.74020 
1 1 1 -18 5  7  o 252.4141 76.44449 15.28889       8.138619      15.16419       15.82717      15.33371       9.489338  251.6358 102.6240 250.2128 83.37062 1.423035       132.2208 
1 1 1 -18 5  8  o 118.8045 56.98830 -8.376827      7.580673      -26.72816      15.22638      -2.329042      8.740997  143.0937 71.07220 149.0480 68.01733 -5.954330      98.37487 
1 1 1 -18 5  9  o 241.4285 78.61200 14.56180       8.454896      16.56469       16.18217      13.80973       9.916020  249.0500 102.9100 234.2887 84.77988 14.76128       133.3345 
1 1 1 -18 5  10 o 269.1199 74.86286 18.21383       8.109366      11.34696       13.06956      22.51247       10.34062  220.0368 91.82951 289.0914 85.85781 -69.05464      125.7148 
1 1 1 -18 5  11 f 355.1077 62.94160 29.69677       8.362341      26.30038       13.35917      31.88498       10.72297  289.5816 98.91603 348.4230 80.81377 -58.84137      127.7311 
1 1 1 -18 5  12 o 487.4724 44.95644 51.66257       8.414897      50.92428       13.20201      52.16777       10.92082  437.2056 80.72854 469.4943 61.36412 -32.28864      101.4034 
1 1 1 -18 5  13 o 638.3282 42.57613 88.58619       10.49396      80.98443       13.57407      99.87859       16.54422  578.5883 61.34632 626.8399 69.10999 -48.25165      92.40974 
1 1 1 -18 5  14 o 169.6494 74.48611 5.889556       9.440917      -1.371165      12.42565      15.80523       14.52079  156.8731 74.61764 209.4570 92.16051 -52.58385      118.5806 
1 1 1 -18 5  15 o 158.1139 72.70921 3.571830       10.24849      18.07098       13.16079      -18.76592      16.33542  210.6270 90.20470 139.0851 69.76467 71.54181       114.0351 
1 1 1 -18 5  16 o 213.1138 83.90749 18.06914       10.19951      19.15746       12.82624      16.19722       16.82149  204.5489 88.34216 186.8447 88.26373 17.70424       124.8792 
1 1 1 -18 5  17 o 154.3699 71.61990 6.377832       10.26752      11.72334       12.94138      -2.703019      16.86744  169.4932 79.22678 146.9511 73.28188 22.54208       107.9218 
1 1 1 -18 5  18 o 140.4840 66.22024 4.502464       9.376030      5.144686       17.32264      4.236360       11.15058  148.0644 73.90511 142.0513 68.39074 6.013138       100.6939 
1 1 1 -18 5  19 o 115.7461 56.88715 -2.509991      8.887055      -26.77479      15.52937      9.306566       10.83705  109.8561 56.31069 145.1474 69.21891 -35.29133      89.23089 
1 1 1 -18 5  20 o 140.0806 62.89108 8.752580       7.116482      11.11312       10.06319      6.391067       10.06526  140.1945 66.81403 129.0376 62.79889 11.15689       91.69414 
1 1 1 -18 5  21 o 203.3128 69.90627 20.16990       6.674908      19.45612       9.316748      20.92266       9.567748  156.1181 70.84704 159.1138 72.04138 -2.995682      101.0409 
1 1 1 -18 5  22 f 89.74711 44.82540 -3.290062      6.417603      2.211543       9.292960      -8.305993      8.873301  104.6616 52.51474 90.65936 46.13403 14.00223       69.90098 
1 1 1 -18 5  23 o 112.7589 53.43451 7.972086       6.257032      0.5541846      9.054108      14.75328       8.656816  95.99187 48.61053 120.6157 58.59325 -24.62379      76.13247 
1 1 1 -18 6  1  o 445.3896 37.25982 40.07607       6.385586      37.70515       8.741712      42.78851       9.350122  422.8352 54.50391 450.7520 54.52195 -27.91681      77.09293 
1 1 1 -18 6  2  o 421.4872 75.85137 40.26944       11.95927      0.000000       0.000000      40.26944       11.95927  ?        ?        421.4872 75.85137 0.000000       75.85137 
1 1 1 -18 6  3  o 265.9397 75.61811 16.38185       8.179977      23.78396       12.18007      10.30034       11.04021  309.1503 93.49369 226.0674 87.78944 83.08290       128.2500 
1 1 1 -18 6  4  o 354.8053 57.74780 27.23831       7.683393      55.36824       13.71032      14.35899       9.277044  494.3049 73.67129 247.5844 82.42982 246.7205       110.5538 
1 1 1 -18 6  5  o 301.8419 66.58901 20.63516       7.596217      17.61114       12.36417      22.46865       9.627461  265.9981 94.85695 306.1068 80.07040 -40.10867      124.1334 
1 1 1 -18 6  6  o 263.2672 73.63416 16.37844       7.823058      17.71879       13.45767      15.69434       9.614378  263.7858 98.20223 253.6793 83.88914 10.10645       129.1552 
1 1 1 -18 6  7  o 385.2598 55.59537 32.34878       8.077309      27.69532       15.87795      33.97350       9.382002  308.7140 107.7223 388.0090 64.52872 -79.29498      125.5709 
1 1 1 -18 6  8  o 708.3439 41.28623 104.0291       11.30812      0.000000       0.000000      104.0291       11.30812  ?        ?        708.3439 41.28623 0.000000       41.28623 
1 1 1 -18 6  9  o 654.1846 33.31066 87.14708       8.434752      69.62946       13.45479      98.48872       10.82623  551.6104 63.99738 687.7805 40.71340 -136.1702      75.85016 
1 1 1 -18 6  10 o 178.2162 72.46230 6.006804       7.860950      15.41409       12.99801      0.5817096      9.870708  236.0892 94.15846 163.4791 73.67170 72.61012       119.5547 
1 1 1 -18 6  11 o 218.8373 76.27477 12.50901       7.959518      27.28934       13.15569      3.974500       9.996798  293.2321 98.16952 174.5185 76.63523 118.7136       124.5400 
1 1 1 -18 6  12 o 220.9652 77.37168 13.46469       8.194592      27.97490       12.99787      3.892534       10.55699  289.2734 97.57526 172.7561 77.14713 116.5174       124.3889 
1 1 1 -18 6  13 o 274.4892 84.09483 22.99022       9.810059      17.53042       13.23730      29.64226       14.61127  224.2425 92.90154 274.9659 102.3325 -50.72334      138.2123 
1 1 1 -18 6  14 o 165.0212 77.64745 2.157109       12.78616      2.157109       12.78616      0.000000       0.000000  165.0212 77.64745 ?        ?        0.000000       77.64745 
1 1 1 -18 6  15 o 172.6806 76.87391 8.189397       10.39506      -1.853191      13.09890      25.27239       17.08417  151.1671 73.11099 217.5810 97.58157 -66.41393      121.9319 
1 1 1 -18 6  16 f 153.2650 71.35020 4.403855       10.32796      13.84664       13.26370      -10.13913      16.46043  182.2191 83.39532 142.2249 71.14886 39.99422       109.6218 
1 1 1 -18 6  17 o 119.2675 57.59655 -2.975957      8.053077      1.342372       11.93382      -6.586552      10.91217  142.3448 69.06734 124.5026 61.54016 17.84219       92.50669 
1 1 1 -18 6  18 o 153.6718 69.94391 9.185834       9.166902      7.666674       17.01744      9.806856       10.88043  148.3375 73.91489 153.7452 72.11291 -5.407669      103.2651 
1 1 1 -18 6  19 o 287.5189 78.58532 33.86370       9.025318      32.36659       16.16532      34.54172       10.87873  174.3879 83.53633 244.1970 88.73334 -69.80908      121.8685 
1 1 1 -18 6  20 o 147.4076 64.25050 10.61535       6.911770      9.454369       9.780704      11.77350       9.768745  133.9038 64.36327 139.9247 66.44057 -6.020859      92.50395 
1 1 1 -18 6  21 o 252.6193 68.27821 26.97187       6.858092      19.03893       9.174275      37.01966       10.32499  152.2850 69.56754 214.2461 84.40016 -61.96111      109.3756 
1 1 1 -18 6  22 o 102.8684 50.16803 2.966566       6.520100      1.671196       9.149318      4.303233       9.294012  102.3895 51.47468 106.3036 53.22048 -3.914108      74.04095 
1 1 1 -18 6  23 f 97.22009 47.86042 2.960264       6.376099      4.207954       8.809243      1.587411       9.240541  99.71078 50.17845 96.41795 48.85753 3.292831       70.03525 
1 1 1 -18 7  1  o 122.7070 57.44476 -5.458145      6.848153      4.649730       10.90772      -12.03449      8.798254  198.0800 83.35725 123.5752 59.80320 74.50483       102.5907 
1 1 1 -18 7  2  o 393.2180 50.59641 32.48409       7.547222      29.00533       11.76996      34.91328       9.835426  346.5576 87.45159 397.9924 65.94292 -51.43481      109.5274 
1 1 1 -18 7  3  o 341.0859 60.17822 25.39807       7.679958      32.39757       12.81362      21.47397       9.594187  362.0970 91.17722 300.5692 80.55645 61.52780       121.6660 
1 1 1 -18 7  4  o 324.1621 70.01128 23.99831       8.555942      36.30645       13.05070      14.72074       11.33065  383.9998 89.21577 249.3217 90.56342 134.6781       127.1267 
1 1 1 -18 7  5  o 136.8885 62.56680 -2.910039      7.432939      24.70775       13.45184      -15.04848      8.918025  304.6022 99.15631 116.6210 57.24988 187.9813       114.4968 
1 1 1 -18 7  6  o 340.2368 64.58907 26.19236       8.222161      28.32361       14.69116      25.22033       9.921550  317.9692 103.6290 321.7846 79.78769 -3.815460      130.7862 
1 1 1 -18 7  7  o 158.8003 67.68762 2.346698       7.347302      -2.876554      11.36396      6.098405       9.631051  165.7760 76.35525 191.4398 79.27162 -25.66382      110.0641 
1 1 1 -18 7  8  o 166.3812 68.88763 4.028832       7.271946      -0.7032779     12.26592      6.593510       9.030028  175.9129 80.39186 189.5068 77.42725 -13.59387      111.6146 
1 1 1 -18 7  9  o 179.2499 72.06135 6.138981       7.678063      6.089951       13.02460      6.165095       9.505319  199.0983 87.45042 186.7322 78.15430 12.36613       117.2846 
1 1 1 -18 7  10 o 244.0986 78.32263 15.76160       8.413228      15.58941       20.70926      15.79564       9.207262  234.9914 106.2292 241.4088 82.12038 -6.417343      134.2699 
1 1 1 -18 7  11 o 407.4399 53.79160 37.73359       8.303392      37.85531       13.80325      37.66457       10.39441  348.4920 97.92936 386.3792 71.91869 -37.88712      121.5009 
1 1 1 -18 7  12 o 303.4159 71.81229 24.21494       8.330301      51.85285       13.23154      6.066689       10.72199  433.4573 81.59657 179.6223 79.10862 253.8349       113.6493 
1 1 1 -18 7  13 o 291.7299 103.2093 33.87646       14.60960      0.000000       0.000000      33.87646       14.60960  ?        ?        291.7299 103.2093 0.000000       103.2093 
1 1 1 -18 7  14 o 165.3847 77.43890 3.509826       12.45505      3.509826       12.45505      0.000000       0.000000  165.3847 77.43890 ?        ?        0.000000       77.43890 
1 1 1 -18 7  15 o 413.5044 67.38885 47.25159       10.44896      67.13909       13.43422      16.79707       16.62450  477.4660 74.91623 192.1839 89.82059 285.2820       116.9623 
1 1 1 -18 7  16 o 123.8360 60.68518 -6.122546      9.882814      -8.759283      12.87409      -2.339358      15.42099  131.4931 65.31752 147.6124 72.99967 -16.11931      97.95576 
1 1 1 -18 7  17 o 129.2202 60.70831 1.363125       7.764566      13.34179       11.90769      -7.497413      10.24126  169.2627 78.03374 118.7509 58.86203 50.51186       97.74458 
1 1 1 -18 7  18 o 189.1023 77.65795 17.91898       9.142136      21.08957       16.83324      16.59255       10.88780  163.2876 79.84400 171.5518 77.33595 -8.264191      111.1572 
1 1 1 -18 7  19 o 143.9937 66.46399 9.705454       8.677063      23.48280       16.23874      4.199680       10.26546  154.1708 75.98997 128.4986 62.72958 25.67220       98.53667 
1 1 1 -18 7  20 o 116.6136 55.37276 3.699337       6.785830      19.91714       9.373106      -14.16317      9.836910  165.2703 73.31512 94.68874 48.22189 70.58155       87.75225 
1 1 1 -18 7  21 o 90.74869 45.15704 -3.617331      6.262592      4.949623       8.668089      -12.97247      9.058061  113.1117 55.70685 88.81465 45.32371 24.29708       71.81568 
1 1 1 -18 7  22 o 97.87267 48.00068 1.632630       6.222388      6.486649       8.541137      -3.857365      9.083450  108.6415 53.83379 93.97609 47.70623 14.66546       71.93025 
1 1 1 -18 7  23 o 108.6475 52.19450 7.642736       6.411973      7.306463       9.245189      7.954398       8.900433  102.7206 51.65516 104.0705 52.09944 -1.349953      73.36625 
1 1 1 -18 8  1  o 360.2108 52.61962 27.52857       7.143786      38.74583       11.97997      21.33890       8.899099  409.6662 78.15228 303.1243 75.79549 106.5419       108.8703 
1 1 1 -18 8  2  o 170.2372 69.32834 3.948326       7.210172      11.80387       12.21319      -0.2542063     8.932983  235.6918 92.10990 161.8933 71.70686 73.79854       116.7309 
1 1 1 -18 8  3  o 144.2177 64.49686 -1.233803      7.407500      8.886631       12.17162      -7.187222      9.335382  219.9418 89.88080 140.2962 66.11490 79.64561       111.5784 
1 1 1 -18 8  4  o 182.2351 71.01818 5.997942       7.244611      12.44961       12.57093      2.789681       8.864740  236.5824 93.15096 173.6775 74.19709 62.90489       119.0895 
1 1 1 -18 8  5  o 113.6421 54.40311 -7.662974      6.831990      -18.67702      10.58935      0.1907759      8.941994  123.7267 61.05619 161.5649 71.64330 -37.83820      94.13087 
1 1 1 -18 8  6  o 361.8520 60.25931 29.23181       8.170232      7.006767       11.34814      53.14992       11.77245  203.1320 85.22906 486.0655 63.91518 -282.9335      106.5324 
1 1 1 -18 8  7  o 294.7343 66.22979 20.31663       7.395988      19.32167       11.34615      21.05175       9.752763  267.8744 91.16100 286.2910 82.93246 -18.41660      123.2401 
1 1 1 -18 8  8  o 116.5266 56.07319 -8.312606      7.473025      -6.361894      11.59844      -9.697239      9.771702  154.4267 73.05428 133.0602 64.05206 21.36653       97.15757 
1 1 1 -18 8  9  o 310.1282 64.59844 22.85126       7.527581      29.86309       12.46713      18.82836       9.443233  320.9771 93.99242 264.0016 82.77857 56.97543       125.2472 
1 1 1 -18 8  10 o 151.4360 67.31638 1.210979       7.941436      -6.552286      12.50239      6.461764       10.28213  154.8566 73.98687 185.7670 79.64937 -30.91035      108.7110 
1 1 1 -18 8  11 o 239.6933 81.09444 16.48871       8.978168      -2.335403      20.94790      20.72471       9.937134  188.8292 91.59559 264.3802 85.15151 -75.55104      125.0621 
1 1 1 -18 8  12 o 142.6500 65.38467 -0.1867032     8.195826      -9.749106      13.73931      5.095671       10.21165  148.3919 72.46974 172.0323 76.40951 -23.64044      105.3104 
1 1 1 -18 8  13 o 163.3662 74.06388 4.013045       10.15076      -0.1574409     12.37525      12.58872       17.74577  158.6119 75.15884 197.3754 92.42327 -38.76341      119.1256 
1 1 1 -18 8  14 o 254.7311 96.11694 27.85971       12.97938      27.85971       12.97938      0.000000       0.000000  254.7311 96.11694 ?        ?        0.000000       96.11694 
1 1 1 -18 8  15 o 125.1591 60.95427 -5.734407      9.530554      -5.479440      12.11396      -6.148578      15.43954  137.0063 67.14933 146.1500 72.41258 -9.143723      98.75533 
1 1 1 -18 8  16 o 139.3120 63.87765 3.294206       7.832039      25.16047       11.90391      -13.39640      10.40012  223.0185 89.70210 112.6212 56.37095 110.3973       105.9441 
1 1 1 -18 8  17 o 123.9778 58.82758 0.4506998      7.632376      6.356210       11.10607      -4.834375      10.50648  147.2582 70.18330 122.5640 60.54494 24.69419       92.68973 
1 1 1 -18 8  18 o 141.8668 66.04144 7.427823       8.846921      -1.360217      16.13794      11.20364       10.57810  131.5907 66.43230 151.1624 70.96619 -19.57179      97.20829 
1 1 1 -18 8  19 o 90.04511 45.70714 -14.78917      8.326844      -21.45701      14.78290      -11.69044      10.07764  106.4167 54.57468 101.3247 51.30816 5.092003       74.90610 
1 1 1 -18 8  20 o 97.48341 48.09852 -2.439958      6.563023      -8.393910      9.041905      4.189769       9.541245  96.84725 48.99061 117.0595 57.80155 -20.21221      75.77003 
1 1 1 -18 8  21 o 89.28233 44.60090 -3.977033      6.365847      -13.69711      8.663527      7.429450       9.385033  85.52267 43.69948 115.0830 56.91910 -29.56038      71.75952 
1 1 1 -18 8  22 o 99.84250 48.66455 2.922235       6.110367      3.850618       8.284006      1.814385       9.049354  102.4502 51.13247 99.66064 50.24195 2.789574       71.68531 
1 1 1 -18 9  1  o 274.4331 61.23933 16.75348       6.361094      23.48757       8.639241      8.779783       9.400826  319.6726 71.39266 209.9148 81.15108 109.7577       108.0852 
1 1 1 -18 9  2  o 528.2924 35.23056 56.49032       7.186610      53.51411       10.26023      59.35677       10.06926  501.1487 53.54731 531.4777 49.34803 -30.32898      72.81857 
1 1 1 -18 9  3  o 397.7548 43.59852 32.92111       6.624285      37.09602       9.225883      28.47837       9.517216  411.3747 59.47529 350.1909 72.37320 61.18381       93.67598 
1 1 1 -18 9  4  o 160.6083 66.18600 3.354641       6.669309      14.87380       9.666170      -7.111438      9.213741  246.2009 84.14011 138.0551 65.24886 108.1458       106.4752 
1 1 1 -18 9  5  o 159.1175 66.74586 2.895681       6.957132      17.40258       10.20089      -9.720245      9.512845  260.8341 86.41747 132.8588 63.75886 127.9753       107.3926 
1 1 1 -18 9  6  o 288.4392 63.61528 19.22879       6.934528      19.09121       10.56339      19.33298       9.192675  268.7855 87.88618 276.0782 80.67231 -7.292786      119.2980 
1 1 1 -18 9  7  o 242.8709 77.05151 14.88179       8.160010      21.12224       11.01136      7.280401       12.15290  277.4861 89.66356 202.2780 86.65689 75.20805       124.6955 
1 1 1 -18 9  8  o 261.9753 90.90749 19.58323       11.30041      19.58323       11.30041      0.000000       0.000000  261.9753 90.90749 ?        ?        0.000000       90.90749 
1 1 1 -18 9  9  o 215.7107 75.54713 11.99881       7.812854      18.97736       11.85280      6.637133       10.38935  251.4227 92.42798 187.8099 80.28187 63.61275       122.4259 
1 1 1 -18 9  10 o 268.9314 70.99616 18.72471       7.523891      26.09499       12.49338      14.53047       9.424629  284.1101 95.66374 226.1908 82.52935 57.91928       126.3434 
1 1 1 -18 9  11 o 197.3951 81.41049 10.46418       10.10037      16.15969       12.80315      1.077881       16.43606  222.4372 91.68869 180.5411 85.85880 41.89610       125.6127 
1 1 1 -18 9  12 o 222.0050 84.09531 15.92521       9.960176      12.92924       13.01174      20.16509       15.47899  202.0857 88.11725 224.7248 97.05231 -22.63907      131.0870 
1 1 1 -18 9  13 o 160.4264 76.12803 1.212366       12.78620      8.637121       20.44306      -3.558457      16.38708  186.1541 90.34095 160.8895 78.69405 25.26459       119.8092 
1 1 1 -18 9  14 o 153.0096 73.36704 0.5622590      12.53694      0.5622590      12.53694      0.000000       0.000000  153.0096 73.36704 ?        ?        0.000000       73.36704 
1 1 1 -18 9  15 o 111.4471 54.26910 -5.909850      7.547469      0.9149158      11.33131      -11.35217      10.11878  144.9953 69.58404 116.0216 57.67873 28.97369       90.38127 
1 1 1 -18 9  16 o 141.2978 63.73274 4.626108       7.406348      8.358482       10.60363      1.070617       10.34932  157.1359 72.86057 137.1533 65.99609 19.98260       98.30639 
1 1 1 -18 9  17 o 120.7895 57.10060 0.8071426      7.062900      1.276888       10.05227      0.3491406      9.925824  130.7497 63.42930 128.4257 62.46888 2.324036       89.02605 
1 1 1 -18 9  18 o 132.2086 62.49963 5.402668       8.462232      -3.349071      15.37234      9.207823       10.13628  125.5024 63.53086 142.2251 67.57536 -16.72269      92.75020 
1 1 1 -18 9  19 o 106.3677 52.66496 -2.288792      8.114497      -12.09134      13.83590      2.850663       10.01836  108.5780 55.45930 119.6519 59.10927 -11.07388      81.05331 
1 1 1 -18 9  20 o 93.84167 46.65841 -3.564108      6.630513      -2.360114      8.800198      -5.145123      10.08436  102.6859 51.46458 101.7874 51.51833 0.8984833      72.81992 
1 1 1 -18 9  21 o 159.1611 65.11962 15.75611       6.398596      14.64519       8.625130      17.11582       9.542164  131.0229 62.27678 132.3192 63.59454 -1.296295      89.00935 
1 1 1 -18 9  22 o 105.9078 51.11389 5.589307       6.318765      8.352103       8.493617      2.165111       9.455785  108.7669 53.85790 98.95086 50.06001 9.816010       73.53011 
1 1 1 -18 10 1  o 181.9270 66.12243 6.737688       6.041433      14.90807       8.687879      -0.9125805     8.406806  249.1149 79.55489 153.3806 68.64397 95.73430       105.0760 
1 1 1 -18 10 2  o 352.2834 47.06131 26.23848       6.277523      22.25635       8.693177      30.57772       9.074618  306.4795 73.89870 367.3055 66.04510 -60.82596      99.11092 
1 1 1 -18 10 3  o 232.7526 67.91449 12.63828       6.519222      -0.2666746     9.240836      25.42514       9.198454  161.1702 72.06083 326.8172 74.17249 -165.6470      103.4133 
1 1 1 -18 10 4  o 429.5218 65.30567 42.00698       10.55026      42.00698       10.55026      0.000000       0.000000  429.5218 65.30567 ?        ?        0.000000       65.30567 
1 1 1 -18 10 5  o 497.1205 38.08151 51.00649       7.296064      54.96154       10.70332      47.57355       9.971852  499.5511 56.14346 464.1874 56.48060 35.36368       79.63759 
1 1 1 -18 10 6  o 145.0318 63.36887 0.9629740      6.759961      18.25216       11.21285      -8.909017      8.472883  257.7785 90.49210 124.2616 59.77303 133.5169       108.4511 
1 1 1 -18 10 7  o 274.3053 91.72758 21.61250       11.48564      21.61250       11.48564      0.000000       0.000000  274.3053 91.72758 ?        ?        0.000000       91.72758 
1 1 1 -18 10 8  o 92.36102 46.29363 -17.29170      7.127283      -5.687020      10.89536      -25.97215      9.423157  148.4730 70.40292 100.0208 50.52652 48.45222       86.65738 
1 1 1 -18 10 9  o 96.21651 48.37905 -20.14389      8.098263      -4.595280      10.85393      -39.66880      12.16286  149.0122 70.54561 104.4116 53.21442 44.60057       88.36548 
1 1 1 -18 10 10 o 176.4755 76.51180 5.914412       9.695652      11.91268       12.08075      -4.942034      16.25268  206.1399 87.28855 169.5858 81.87875 36.55406       119.6805 
1 1 1 -18 10 11 o 269.0453 85.21341 22.69606       9.983514      22.76785       12.61989      22.57599       16.32107  249.9868 94.66825 234.0234 100.3449 15.96341       137.9535 
1 1 1 -18 10 12 o 245.2993 85.37579 20.35885       9.970572      23.64840       12.86210      15.40556       15.78302  243.7866 94.73255 203.2648 92.23048 40.52174       132.2147 
1 1 1 -18 10 13 o 433.6454 62.02217 48.90912       10.14750      48.00997       12.80345      50.42804       16.64089  381.9008 88.11956 326.2009 110.4040 55.69995       141.2590 
1 1 1 -18 10 14 o 163.5342 72.03426 7.490755       8.893462      16.44921       12.62433      -1.335316      12.53070  193.9507 85.60764 145.9266 70.79795 48.02412       111.0901 
1 1 1 -18 10 15 o 151.0889 69.44702 5.672209       9.334951      36.35131       16.54461      -8.656116      11.30662  226.5555 99.05872 124.0145 61.53595 102.5410       116.6161 
1 1 1 -18 10 16 o 118.5679 56.12727 -0.2607787     6.867365      -4.042214      9.741774      3.474658       9.682342  121.5007 59.68383 138.6170 65.91461 -17.11632      88.92072 
1 1 1 -18 10 17 o 104.5447 50.98452 -3.538910      6.733115      -8.294620      9.167292      2.031500       9.921491  107.2309 53.56042 129.0317 62.69220 -21.80079      82.45623 
1 1 1 -18 10 18 o 121.1083 58.10556 2.906092       7.889989      23.01193       13.65013      -7.181654      9.668801  158.6947 76.21532 106.2512 53.34752 52.44349       93.03082 
1 1 1 -18 10 19 o 106.5486 52.59277 -0.7233982     7.874717      32.33705       13.72982      -16.93027      9.613025  162.2992 77.54024 90.64973 46.29587 71.64943       90.30945 
1 1 1 -18 10 20 o 87.89378 44.16852 -6.198405      6.700416      -9.771247      8.984151      -1.720251      10.05819  91.81656 46.69344 103.7121 52.36858 -11.89558      70.16228 
1 1 1 -18 10 21 o 136.1987 60.67254 12.48567       6.486628      16.14590       9.001567      8.531838       9.355627  129.7350 62.19661 112.3470 55.78545 17.38804       83.54900 
1 1 1 -18 11 1  o 162.5075 78.41565 -13.48813      14.85527      0.000000       0.000000      -13.48813      14.85527  ?        ?        162.5075 78.41565 0.000000       78.41565 
1 1 1 -18 11 2  o 178.4276 67.86295 6.280660       6.502754      -8.128932      8.849743      23.19115       9.587005  131.2045 62.56454 305.6139 79.88290 -174.4094      101.4672 
1 1 1 -18 11 3  o 208.6434 81.51247 9.550609       9.562145      9.550609       9.562145      0.000000       0.000000  208.6434 81.51247 ?        ?        0.000000       81.51247 
1 1 1 -18 11 4  o 437.7805 42.04809 40.20058       7.060813      49.61894       10.69914      32.93383       9.397920  469.7717 60.01717 375.8209 66.84008 93.95087       89.83127 
1 1 1 -18 11 5  f 317.9599 58.11303 22.95201       6.911424      25.02721       10.24016      21.21576       9.366609  308.5359 83.44937 285.7084 80.80526 22.82745       116.1606 
1 1 1 -18 11 6  o 159.9748 66.22682 3.942849       6.719819      21.75471       10.68111      -7.725651      8.645087  278.7051 88.12615 127.8147 61.19044 150.8904       107.2869 
1 1 1 -18 11 7  o 128.3530 59.61709 -3.122034      7.145138      1.262823       10.59792      -6.776128      9.674590  167.7154 75.88866 137.3089 65.45882 30.40645       100.2195 
1 1 1 -18 11 8  o 161.1749 71.16926 2.611286       8.733629      0.1402810      10.66665      7.637248       15.21251  162.0179 74.38356 200.4427 90.78910 -38.42485      117.3694 
1 1 1 -18 11 9  o 166.2805 72.93009 4.034121       9.029599      2.713799       11.16053      6.536236       15.36380  169.8731 77.26301 193.0099 88.85549 -23.13678      117.7492 
1 1 1 -18 11 10 o 276.3678 84.01705 23.30043       9.817293      20.70470       12.14799      28.18720       16.66806  242.9997 92.67532 255.5612 104.8939 -12.56149      139.9694 
1 1 1 -18 11 11 o 185.2752 82.59038 9.073214       12.04154      9.073214       12.04154      0.000000       0.000000  185.2752 82.59038 ?        ?        0.000000       82.59038 
1 1 1 -18 11 12 o 164.2118 73.56901 5.648328       9.683594      14.72261       12.39429      -8.569948      15.51454  199.7409 86.55275 149.3954 73.75681 50.34552       113.7165 
1 1 1 -18 11 13 o 97.98860 48.89710 -13.18557      7.561572      -7.741213      11.70198      -17.08850      9.907901  132.5566 65.17531 108.2052 54.28329 24.35145       84.82038 
1 1 1 -18 11 14 o 112.6700 55.33452 -7.508753      8.360052      -14.79676      11.06408      2.189083       12.76287  115.2626 57.75871 150.1128 72.49625 -34.85014      92.69183 
1 1 1 -18 11 15 o 179.7939 70.36219 11.79141       7.134388      19.19621       10.00893      4.143131       10.17215  202.3081 81.94259 143.8942 68.17215 58.41389       106.5928 
1 1 1 -18 11 16 o 130.4917 61.44847 2.966747       8.036536      -7.846056      12.58695      10.40828       10.44198  121.8304 61.12767 154.2938 71.80038 -32.46341      94.29680 
1 1 1 -18 11 17 o 80.14146 40.57829 -13.77562      6.295365      -6.054191      8.474965      -23.28106      9.403193  105.6791 52.57748 88.55064 45.26938 17.12845       69.38089 
1 1 1 -18 11 18 o 126.1941 59.81669 5.819246       7.850927      -2.502915      12.16123      11.76595       10.28011  115.2117 58.10220 138.9499 66.57539 -23.73819      88.36373 
1 1 1 -18 11 19 o 176.5354 73.21197 21.07021       8.232977      14.90619       13.15571      25.03836       10.55543  128.9313 64.36308 163.0697 74.54339 -34.13843      98.48515 
1 1 1 -18 11 20 o 115.0703 54.56779 6.147490       6.547569      9.028853       8.782197      2.541559       9.824553  118.7252 57.97224 106.8500 53.66567 11.87518       78.99864 
1 1 1 -18 12 1  o 245.3612 73.03038 14.64196       7.475502      9.551705       8.585885      30.59210       15.19839  206.3165 78.09615 320.0685 105.4559 -113.7520      131.2248 
1 1 1 -18 12 2  o 168.7052 69.72773 4.311565       7.431638      -1.122730      8.560909      20.93023       14.97085  150.5907 68.16728 267.4524 102.6714 -116.8617      123.2404 
1 1 1 -18 12 3  o 114.7326 55.90593 -11.18568      8.047468      -10.03402      9.536658      -14.03390      14.99754  130.4670 62.92303 158.4814 77.01880 -28.01433      99.45453 
1 1 1 -18 12 4  o 165.1363 71.14266 3.072973       8.276295      8.810067       10.14629      -8.334043      14.30696  201.5732 82.18289 164.4636 78.73107 37.10959       113.8095 
1 1 1 -18 12 5  o 156.6864 69.43748 1.345009       8.387348      1.625452       10.34139      0.8059306      14.33780  169.0749 75.86750 184.5152 85.26179 -15.44029      114.1291 
1 1 1 -18 12 6  o 243.7347 78.06759 15.90808       8.361343      6.552974       10.24994      34.51546       14.45572  186.7728 79.78745 327.1457 102.3923 -140.3729      129.8084 
1 1 1 -18 12 7  o 164.7663 71.15609 3.914594       8.320180      3.256035       10.26149      5.178399       14.21520  170.7371 76.16610 190.5038 86.85931 -19.76672      115.5241 
1 1 1 -18 12 8  o 204.0779 79.07171 11.34691       8.940805      16.43384       11.10413      1.969479       15.07642  229.8514 88.37947 180.7348 84.80872 49.11658       122.4886 
1 1 1 -18 12 9  o 173.8540 74.67482 6.327660       9.066839      -1.867248      11.28922      21.21935       15.21822  153.8501 72.56403 234.5384 98.56708 -80.68832      122.3969 
1 1 1 -18 12 10 o 330.0209 73.25472 29.97309       9.143718      34.50377       11.17770      20.80861       15.89735  334.5837 85.65766 223.5480 97.43959 111.0356       129.7371 
1 1 1 -18 12 11 o 481.4526 43.98125 52.42928       8.132544      60.19870       12.03681      45.90384       11.03118  475.4775 67.04705 405.7574 72.67372 69.72012       98.87759 
1 1 1 -18 12 12 o 291.1061 75.30566 25.83232       8.577839      18.37958       11.04555      37.15640       13.61542  214.3788 86.34392 291.9097 99.85949 -77.53091      132.0121 
1 1 1 -18 12 13 o 248.6594 77.64091 21.17602       8.317225      16.11223       10.95128      28.07778       12.78518  195.2419 82.91486 238.6099 93.94392 -43.36803      125.3010 
1 1 1 -18 12 14 o 143.9285 65.25469 4.791897       7.880775      8.792319       9.683100      -3.056668      13.56303  160.4004 72.56262 138.3808 68.43903 22.01961       99.74586 
1 1 1 -18 12 15 o 153.6601 65.70920 8.130046       6.964754      5.140893       9.419263      11.73562       10.34499  141.5675 66.62177 162.0162 73.95860 -20.44870      99.54061 
1 1 1 -18 12 16 o 131.5336 59.77840 4.829933       6.664235      -2.334700      8.793582      14.49711       10.21454  115.8290 56.85867 161.9289 73.75255 -46.09987      93.12543 
1 1 1 -18 12 17 o 137.8934 60.71273 7.473351       6.310837      0.5994235      8.214712      17.37273       9.858112  115.4728 56.31427 162.5756 73.41111 -47.10278      92.52290 
1 1 1 -18 12 18 o 117.0332 56.06989 3.928819       7.288459      -14.47901      10.93263      18.65534       9.778532  97.54038 49.77812 155.4860 71.32381 -57.94559      86.97670 
1 1 1 -18 12 19 o 112.7214 54.67684 4.407450       7.463502      10.09452       11.25558      -0.5539338E-01 9.970789  121.1003 60.30552 106.5784 53.60180 14.52194       80.68401 
1 1 1 -18 12 20 o 135.3248 60.83079 12.14114       6.680360      9.668585       8.831834      15.44739       10.21283  117.4652 57.52158 125.0718 61.37147 -7.606575      84.11414 
1 1 1 -18 13 1  o 218.7583 74.88165 11.75188       7.656072      15.57044       8.918091      1.051114       14.92895  245.2417 80.77972 191.0622 87.82170 54.17953       119.3232 
1 1 1 -18 13 2  o 383.8409 56.44892 33.11285       8.163304      31.70261       9.709558      36.51341       15.07745  360.9692 71.79002 344.9119 103.9566 16.05737       126.3360 
1 1 1 -18 13 3  o 146.8263 66.25684 -0.4523368     8.015319      6.985773       9.723162      -16.22626      14.15944  189.7427 79.19770 147.8192 72.47882 41.92354       107.3567 
1 1 1 -18 13 4  o 156.1142 68.13866 2.210198       7.797428      2.540961       9.384683      1.472808       14.01230  166.6733 73.67674 183.6616 84.66399 -16.98827      112.2330 
1 1 1 -18 13 5  o 208.0220 76.20618 11.14275       8.047362      3.721267       9.671893      27.83919       14.50702  171.3530 75.30914 286.0688 102.6704 -114.7158      127.3290 
1 1 1 -18 13 6  o 292.9876 73.65920 22.51488       8.372177      19.87282       10.16225      28.09662       14.77077  258.7264 86.27930 280.2144 103.1544 -21.48801      134.4803 
1 1 1 -18 13 7  o 121.2209 58.41811 -7.422209      8.182228      -6.832367      10.03999      -8.588719      14.11918  136.1539 65.38301 154.4625 74.98803 -18.30861      99.48941 
1 1 1 -18 13 8  o 166.0856 71.73051 5.095582       8.456159      2.936250       10.59259      8.889702       14.04099  165.2265 75.19663 192.5678 87.22265 -27.34131      115.1622 
1 1 1 -18 13 9  o 184.4842 70.70962 9.193532       7.093816      1.763881       10.85676      14.72860       9.370811  159.2453 73.79852 215.3788 81.57315 -56.13350      110.0018 
1 1 1 -18 13 10 o 187.8362 70.22918 10.08934       6.897300      10.55431       10.21336      9.699487       9.351970  186.6420 79.68607 182.8383 77.07634 3.803772       110.8631 
1 1 1 -18 13 11 o 151.9564 66.17340 4.798250       7.316875      7.213878       10.55269      2.561678       10.15406  168.2850 75.97455 152.0625 70.77589 16.22256       103.8333 
1 1 1 -18 13 12 o 144.6455 68.41142 1.469716       10.16054      0.000000       0.000000      1.469716       10.16054  ?        ?        144.6455 68.41142 0.000000       68.41142 
1 1 1 -18 13 13 o 136.9662 65.11409 1.125331       9.437640      1.125331       9.437640      0.000000       0.000000  136.9662 65.11409 ?        ?        0.000000       65.11409 
1 1 1 -18 13 14 o 127.0930 59.67157 1.467444       7.481729      1.049971       9.334379      2.217532       12.51203  131.6816 63.18436 140.6189 68.77588 -8.937317      93.39371 
1 1 1 -18 13 15 o 91.06582 45.48233 -9.460795      6.604239      -1.927068      8.954301      -18.44764      9.779811  118.7037 58.08363 97.23367 49.37447 21.46999       76.23351 
1 1 1 -18 13 16 o 147.7878 63.24468 8.915184       6.460681      8.674251       8.441831      9.255808       10.03752  141.0563 65.26544 140.4134 66.86601 0.6429443      93.43790 
1 1 1 -18 13 17 o 92.13782 45.67999 -5.055263      6.179523      -9.633464      7.887376      2.221797       9.944045  93.06623 46.91599 118.2827 58.51728 -25.21647      75.00255 
1 1 1 -18 13 18 o 93.17583 46.66813 -5.567662      7.182196      5.018543       9.801642      -17.84232      10.55440  117.1936 57.99952 91.65292 46.94059 25.54073       74.61477 
1 1 1 -18 13 19 o 71.54562 36.60186 -16.00091      6.246619      -17.27692      7.932600      -13.91815      10.13464  79.38938 40.66247 90.47638 46.31188 -11.08700      61.62976 
1 1 1 -18 14 1  o 188.9809 70.53442 8.187737       6.951459      5.774974       7.946278      16.05461       14.34854  176.3694 72.41167 236.5784 97.23779 -60.20891      121.2379 
1 1 1 -18 14 2  o 265.8264 69.97720 17.69768       7.322957      17.20855       8.489352      19.11986       14.47573  254.3930 78.27813 247.4792 99.13776 6.913773       126.3161 
1 1 1 -18 14 3  o 350.1824 58.71857 28.50492       7.702734      27.95125       9.180658      29.82142       14.15672  331.6997 73.22777 300.4107 101.8297 31.28897       125.4257 
1 1 1 -18 14 4  o 216.7313 69.59533 12.04346       6.641777      10.68314       9.461082      13.36525       9.326153  203.6031 80.60596 219.8669 81.77017 -16.26384      114.8202 
1 1 1 -18 14 5  o 398.3841 45.01776 34.80726       6.842693      41.12386       9.629697      28.36492       9.725067  413.9208 61.79850 323.2211 78.30164 90.69968       99.75069 
1 1 1 -18 14 6  f 139.4746 60.73689 1.886684       6.163794      -0.3640238     8.971767      3.898665       8.482625  147.7156 67.96534 162.1892 70.92225 -14.47359      98.23061 
1 1 1 -18 14 7  o 357.2807 51.72360 29.61426       6.967929      37.61937       9.671608      20.97496       10.04741  382.8871 67.51003 256.7648 85.79286 126.1223       109.1697 
1 1 1 -18 14 8  o 171.5826 67.91471 7.372505       6.715043      -0.3118510     10.27356      13.10413       8.872709  150.2941 70.35960 206.3820 79.08537 -56.08797      105.8535 
1 1 1 -18 14 9  o 125.1175 58.13313 -1.295481      6.802721      4.630278       10.07724      -6.256714      9.220715  162.4156 73.69601 126.5834 61.25006 35.83224       95.82626 
1 1 1 -18 14 10 o 137.9970 61.99135 2.172480       6.924873      -8.336670      10.10544      11.47635       9.508310  124.9704 61.26643 186.2245 78.06876 -61.25411      99.23864 
1 1 1 -18 14 11 o 115.4309 55.06640 -3.107704      6.870910      -3.992601      9.583277      -2.171661      9.856343  128.7749 62.34245 134.3231 64.57656 -5.548248      89.75919 
1 1 1 -18 14 12 o 128.9138 59.11794 1.647707       6.711510      7.854809       9.448927      -4.672560      9.534671  159.2690 71.89899 123.8303 60.45171 35.43869       93.93549 
1 1 1 -18 14 13 o 169.6989 70.04887 10.74710       7.486424      1.572252       9.189059      28.85832       12.91057  133.5238 63.69323 217.4184 91.04827 -83.89456      111.1153 
1 1 1 -18 14 14 o 203.6418 74.18355 17.40762       7.610507      17.96842       9.236037      16.22150       13.43218  188.8361 77.86122 162.1691 77.26058 26.66702       109.6885 
1 1 1 -18 14 15 o 111.0972 53.31826 -0.3017541     6.654370      -4.448469      8.731484      5.443853       10.27789  109.7675 54.39863 133.2608 64.52585 -23.49335      84.39666 
1 1 1 -18 14 16 o 117.8922 56.05363 2.917209       6.998408      1.522320       8.139994      6.870415       13.70342  116.1809 56.52620 129.1179 64.63965 -12.93703      85.86906 
1 1 1 -18 14 17 o 95.93004 47.12217 -2.459588      6.071798      3.539852       7.959785      -10.80869      9.390006  115.9453 56.29225 95.87936 48.65511 20.06591       74.40522 
1 1 1 -18 14 18 o 102.4489 50.05479 0.7000066      6.575846      3.725650       8.853346      -3.023219      9.821057  111.9724 55.36261 102.8058 51.89149 9.166603       75.87981 
1 1 1 -18 15 1  o 139.3618 61.55200 0.8221284      6.536534      -1.808775      7.489931      9.227906       13.38796  135.4307 62.23384 203.5541 89.05251 -68.12346      108.6435 
1 1 1 -18 15 2  o 120.6581 56.47004 -3.568938      6.609935      -3.571211      7.444083      -3.560467      14.37098  128.0374 59.92486 168.7875 80.27353 -40.75005      100.1740 
1 1 1 -18 15 3  o 125.8449 57.92693 -1.874620      6.526624      -0.4933670     7.435430      -6.511543      13.62337  138.7827 63.09978 157.6924 75.83884 -18.90964      98.65654 
1 1 1 -18 15 4  o 237.1357 64.79923 14.29828       6.137326      13.04277       8.390100      15.74329       9.001050  215.3075 77.97318 231.9974 81.09770 -16.68990      112.5018 
1 1 1 -18 15 5  f 351.7255 49.32459 28.17708       6.552192      31.15482       8.779966      24.43437       9.843333  349.6229 67.10454 285.6956 83.47733 63.92731       107.1050 
1 1 1 -18 15 6  o 198.8810 69.76572 10.82486       6.664100      10.90173       9.397357      10.74711       9.451800  194.9319 79.23982 194.0967 79.24865 0.8351593      112.0683 
1 1 1 -18 15 7  o 181.8129 67.68002 8.906050       6.391918      2.767048       9.232181      14.55811       8.858470  155.0784 70.43275 214.2939 79.69430 -59.21547      106.3577 
1 1 1 -18 15 8  o 183.5124 68.85242 9.570842       6.640836      18.38889       9.265347      0.2553957      9.523077  232.5340 82.20017 145.1985 67.89993 87.33545       106.6174 
1 1 1 -18 15 9  o 151.0555 63.98253 5.141370       6.493957      -11.25906      9.498857      19.53330       8.898222  115.5668 57.17699 237.7538 80.73114 -122.1870      98.92788 
1 1 1 -18 15 10 o 150.3862 64.43533 5.474412       6.720974      2.318203       9.339630      8.864338       9.679253  144.5684 67.48483 168.4973 74.63648 -23.92888      100.6221 
1 1 1 -18 15 11 o 150.8646 64.18432 6.255488       6.583911      9.544202       9.023275      2.510999       9.628253  166.2641 72.91419 141.9300 66.96375 24.33414       98.99809 
1 1 1 -18 15 12 o 194.0228 69.96404 13.53971       6.744500      18.38671       9.110533      7.662315       10.03228  203.6170 79.56000 152.7033 70.82830 50.91367       106.5197 
1 1 1 -18 15 13 o 214.3697 73.82460 18.31509       7.445581      30.48579       9.106902      -6.220466      12.93037  276.5813 80.14506 124.7424 62.49896 151.8389       101.6334 
1 1 1 -18 15 14 o 203.7449 72.24037 17.60741       7.161269      18.22899       8.377845      15.92121       13.79875  190.7463 75.74507 153.1328 74.29408 37.61353       106.0987 
1 1 1 -18 15 15 o 102.1745 49.78219 -2.152971      6.376918      -8.699922      8.379029      6.858707       9.830531  98.75045 49.59263 131.8314 63.65723 -33.08096      80.69493 
1 1 1 -18 15 16 o 120.7218 56.05915 4.742495       6.311667      -2.675902      8.009930      16.89322       10.25120  104.3212 51.76916 149.6800 70.13921 -45.35882      87.17542 
1 1 1 -18 15 17 o 127.6770 60.10380 8.599278       7.677412      6.435028       9.619451      12.39690       12.74244  119.6876 58.89485 126.2057 63.05432 -6.518097      86.28123 
1 1 1 -18 16 1  o 131.9521 59.11828 0.1407957      6.253606      2.202492       7.026955      -7.709635      13.71203  147.5429 64.53333 154.6895 74.81166 -7.146561      98.79948 
1 1 1 -18 16 2  o 197.6209 68.73782 10.17447       6.462628      5.010776       7.268739      29.65813       14.11932  162.7908 68.25228 284.0505 101.3587 -121.2597      122.1964 
1 1 1 -18 16 3  o 168.2502 66.86249 6.467400       6.532689      5.432970       7.219201      11.14340       15.34885  163.7977 68.29459 200.9039 91.07880 -37.10628      113.8398 
1 1 1 -18 16 4  o 192.1071 73.15215 10.12618       7.561499      10.78814       8.909425      8.421396       14.29768  195.0160 77.89800 189.0340 86.54017 5.982071       116.4358 
1 1 1 -18 16 5  o 206.2930 66.87782 11.61768       6.122160      16.48253       8.179474      5.420522       9.231812  233.2244 77.38835 166.3548 73.32822 66.86958       106.6114 
1 1 1 -18 16 6  o 148.4091 62.74117 4.239886       6.225269      5.346479       8.682905      3.069410       8.930015  162.1153 71.29961 153.6080 69.56924 8.507263       99.61684 
1 1 1 -18 16 7  o 203.5750 67.76249 12.01284       6.269437      11.22002       8.789428      12.83402       8.945271  188.0806 76.56449 196.8554 78.23746 -8.774826      109.4679 
1 1 1 -18 16 8  o 179.7777 66.55976 9.490581       6.165500      12.27324       8.377763      6.202832       9.106407  191.0087 75.77772 160.4377 71.64829 30.57095       104.2868 
1 1 1 -18 16 9  o 244.9308 65.94444 17.58244       6.411942      2.250270       8.829445      34.69012       9.326685  141.8540 66.01571 337.3808 73.28088 -195.5267      98.63145 
1 1 1 -18 16 10 o 139.4879 61.44174 4.278901       6.470110      20.21121       8.720976      -15.22690      9.649561  227.9444 79.81786 105.7754 53.13406 122.1690       95.88597 
1 1 1 -18 16 11 o 86.86177 43.56414 -11.93914      6.359734      -5.915714      8.618066      -19.14169      9.423904  113.5899 55.86554 97.56935 49.42983 16.02056       74.59401 
1 1 1 -18 16 12 o 304.8827 58.93333 26.97198       6.725384      25.33638       9.106943      28.93400       9.974399  238.8611 81.66974 247.2531 85.42967 -8.391953      118.1870 
1 1 1 -18 16 13 o 93.85180 46.78625 -8.394727      6.850615      -6.149559      8.165021      -13.73341      12.59071  105.4532 52.32020 111.7477 56.66885 -6.294533      77.12821 
1 1 1 -18 16 14 o 116.2122 55.58363 1.530229       7.096083      2.111763       8.289508      -0.6455804E-01 13.72754  120.5078 58.25331 124.3742 62.59624 -3.866463      85.50870 
1 1 1 -18 16 15 o 109.4470 52.17439 1.312083       6.145088      5.928954       7.949830      -5.541636      9.686059  126.3101 59.96452 106.0130 53.25081 20.29709       80.19596 
1 1 1 -18 17 1  o 199.8635 65.00829 10.47548       5.782442      11.54425       6.409300      5.799530       13.40617  206.6714 68.50085 180.7408 83.13101 25.93059       107.7178 
1 1 1 -18 17 2  o 242.2305 64.10273 15.31544       6.124117      16.79073       6.782441      8.803410       14.24966  249.5513 68.08987 188.5860 86.35699 60.96530       109.9716 
1 1 1 -18 17 3  o 270.5360 65.62720 19.36997       6.824501      9.271843       7.692776      56.68124       14.78709  183.6112 72.68623 417.2291 93.56764 -233.6179      118.4829 
1 1 1 -18 17 4  o 128.6138 58.22178 0.4251613      6.245925      1.017966       6.998688      -1.894407      13.84410  136.1136 61.62241 157.2151 75.82073 -21.10147      97.70417 
1 1 1 -18 17 5  o 189.5280 67.71387 10.30573       6.303413      10.75788       7.010792      8.398217       14.39989  190.4020 70.88010 178.2625 83.40409 12.13950       109.4542 
1 1 1 -18 17 6  o 269.9981 60.75222 19.32129       6.216151      22.54438       8.337768      15.28792       9.327127  267.9285 76.39972 206.5592 80.55823 61.36923       111.0250 
1 1 1 -18 17 7  o 287.2868 59.70465 21.96019       6.443737      26.98540       8.622525      15.60382       9.697551  294.0656 75.20486 201.6203 81.00990 92.44527       110.5368 
1 1 1 -18 17 8  o 126.6187 57.41550 1.532425       6.103798      12.54047       8.281516      -11.55908      9.031285  186.1046 74.83165 109.1009 54.27924 77.00364       92.44464 
1 1 1 -18 17 9  o 146.6982 62.46351 5.814211       6.245021      4.477746       8.164603      7.698582       9.694812  143.4243 65.56181 156.7149 71.56116 -13.29054      97.05334 
1 1 1 -18 17 10 o 155.6197 64.29829 7.873426       6.316363      15.65483       8.419283      -2.145022      9.553143  192.3469 76.07380 125.2927 61.02089 67.05422       97.52319 
1 1 1 -18 17 11 o 101.5904 49.44122 -4.074821      6.238884      -11.66755      8.242545      6.110534       9.546638  98.84637 49.57764 142.2797 66.99148 -43.43335      83.34147 
1 1 1 -18 17 12 o 107.4828 51.78676 -1.656633      6.422161      -1.588288      8.719870      -1.737653      9.494054  117.2754 57.37069 119.3450 58.68447 -2.069595      82.06865 
1 1 1 -18 17 13 o 182.4188 69.60773 14.82851       6.855428      5.381112       8.344815      34.44057       12.02326  130.5995 61.83667 214.7588 88.72020 -84.15933      108.1436 
1 1 1 -18 17 14 o 93.03986 46.38039 -6.649886      6.730595      -7.465781      7.939323      -4.565470      12.68991  97.73744 48.96948 115.0374 58.17392 -17.29997      76.04088 
1 1 1 -18 18 1  o 144.7834 60.16989 4.015653       5.577687      4.884849       6.148088      -0.2735379E-01 13.25969  152.6431 63.28191 160.2586 76.46415 -7.615509      99.25405 
1 1 1 -18 18 2  o 202.7545 63.58090 11.18037       5.570903      11.03598       6.091743      11.91804       13.76945  198.2376 66.80003 190.2567 86.25752 7.980972       109.0991 
1 1 1 -18 18 3  o 236.0606 63.08880 15.07475       5.894431      16.21282       6.573451      10.40413       13.31674  239.1685 67.71090 182.7815 83.61936 56.38699       107.5963 
1 1 1 -18 18 4  o 224.9953 65.15086 14.30166       6.019981      10.54648       6.689785      30.28749       13.80272  187.5026 69.34943 253.7066 98.26134 -66.20398      120.2690 
1 1 1 -18 18 5  o 158.3068 65.24963 6.623092       6.483424      5.293816       7.346696      11.30314       13.78509  152.2360 66.30128 178.1036 82.75252 -25.86758      106.0370 
1 1 1 -18 18 6  o 215.1753 64.81834 13.66921       5.862825      14.29419       7.598029      12.74949       9.217144  203.8492 74.14349 185.7586 77.28587 18.09056       107.0998 
1 1 1 -18 18 7  o 224.6663 65.19481 15.23032       6.022338      15.91597       7.863549      14.25766       9.365808  208.9219 75.51344 188.4092 78.10729 20.51271       108.6417 
1 1 1 -18 18 8  o 144.5625 60.96156 5.646336       5.853419      4.328501       7.835021      7.310935       8.805713  141.2565 64.43621 153.9683 69.46634 -12.71181      94.75018 
1 1 1 -18 18 9  o 192.0632 66.10580 12.50749       5.969613      15.68846       8.093287      8.711830       8.840761  194.4648 75.26323 155.4517 69.91908 39.01303       102.7289 
1 1 1 -18 18 10 o 115.2123 53.90609 0.5500947      6.016035      8.314806       8.265834      -8.196060      8.772686  150.2124 67.58076 107.4111 53.44796 42.80132       86.16173 
1 1 1 -18 18 11 o 133.1856 59.27879 5.143773       6.177547      0.9137860      8.238951      10.57563       9.336340  122.1755 58.81292 152.1317 69.75101 -29.95625      91.23685 
1 1 1 -18 18 12 o 111.8528 53.08767 0.6141891      6.223312      -1.829473      8.383916      3.612947       9.287462  113.2762 55.58790 127.6277 61.68668 -14.35158      83.03770 
1 1 1 -18 19 1  f 172.6352 62.39569 8.018749       5.368759      4.586495       5.902929      24.44954       12.91538  147.3847 61.62912 237.1076 94.08066 -89.72293      112.4692 
1 1 1 -18 19 2  o 137.5374 58.26593 3.521048       5.386745      0.4251987      5.922709      18.34129       12.95860  123.9877 56.35116 206.4599 88.98283 -82.47218      105.3252 
1 1 1 -18 19 3  o 103.1212 49.66917 -4.817186      5.896347      -1.798624      6.589075      -16.95108      13.21066  118.7468 55.83168 125.2432 62.81009 -6.496384      84.03739 
1 1 1 -18 19 4  o 224.3963 66.55793 14.97094       6.217202      18.06787       6.970480      2.920668       13.74977  242.8678 70.04219 156.2863 75.42075 86.58148       102.9281 
1 1 1 -18 19 5  o 121.9149 55.88024 0.6191428      5.986158      0.9999571      6.739655      -0.8039812     13.02874  127.7122 58.81546 144.9703 70.74835 -17.25810      92.00320 
1 1 1 -18 19 6  o 130.8868 58.66624 2.715191       6.165384      5.504914       6.953391      -7.542704      13.33353  146.7680 64.19452 132.4628 65.91029 14.30522       92.00600 
1 1 1 -18 19 7  o 218.0846 64.31162 14.74099       5.818495      17.17457       7.829947      11.73994       8.695070  212.0983 75.50188 172.7116 73.62635 39.38670       105.4579 
1 1 1 -18 19 8  o 91.44684 45.07011 -6.897991      5.708652      -6.050189      7.637752      -7.971097      8.592899  107.2160 52.70340 108.7151 53.89287 -1.499123      75.37964 
1 1 1 -18 19 9  o 123.9600 56.24486 2.735375       5.869106      1.585648       7.673162      4.356429       9.111200  125.5245 59.39338 137.0055 64.79327 -11.48106      87.89619 
1 1 1 -17 0  1  o 538.0404 39.57845 57.59154       8.167070      57.59154       8.167070      57.59154       8.167070  538.0404 39.57845 538.0404 39.57845 0.000000       0.000000 
1 1 1 -17 0  2  o 398.0704 57.77165 33.14787       8.383207      33.14787       8.383207      33.14787       8.383207  398.0704 57.77165 398.0704 57.77165 0.000000       0.000000 
1 1 1 -17 0  3  o 257.0807 89.63165 17.23749       8.091660      17.23749       8.091660      17.23749       8.091660  257.0807 89.63165 257.0807 89.63165 0.000000       0.000000 
1 1 1 -17 0  4  o 419.3130 53.63152 36.27050       8.342624      36.27050       8.342624      36.27050       8.342624  419.3130 53.63152 419.3130 53.63152 -0.000000      0.000000 
1 1 1 -17 0  5  o 126.8142 79.97487 1.775961       8.353338      1.775961       8.353338      1.775961       8.353338  126.8142 79.97487 126.8142 79.97487 -0.000000      0.000000 
1 1 1 -17 0  6  o 437.7968 56.07169 39.60598       9.105108      39.60598       9.105108      39.60598       9.105108  437.7968 56.07169 437.7968 56.07169 -0.000000      0.000000 
1 1 1 -17 0  7  o 92.57845 65.14728 -9.897648      9.153266      -9.897648      9.153266      -9.897648      9.153266  92.57845 65.14728 92.57845 65.14728 -0.000000      0.000000 
1 1 1 -17 0  8  o 192.6387 100.0107 11.18627       9.698203      11.18627       9.698203      11.18627       9.698203  192.6387 100.0107 192.6387 100.0107 0.000000       0.000000 
1 1 1 -17 0  9  o 706.6450 41.65317 98.95030       11.33990      98.95030       11.33990      98.95030       11.33990  706.6450 41.65317 706.6450 41.65317 0.000000       0.000000 
1 1 1 -17 0  10 o 588.1264 50.57814 69.65048       11.35556      69.65048       11.35556      69.65048       11.35556  588.1264 50.57814 588.1264 50.57814 0.000000       0.000000 
1 1 1 -17 0  11 o 146.0888 92.24489 2.611668       11.15175      2.611668       11.15175      2.611668       11.15175  146.0888 92.24489 146.0888 92.24489 -0.000000      0.000000 
1 1 1 -17 0  12 o 185.1695 105.6519 9.707165       11.92059      9.707165       11.92059      9.707165       11.92059  185.1695 105.6519 185.1695 105.6519 0.000000       0.000000 
1 1 1 -17 0  13 o 216.5446 115.5957 14.56603       13.24118      14.56603       13.24118      14.56603       13.24118  216.5446 115.5957 216.5446 115.5957 -0.000000      0.000000 
1 1 1 -17 0  14 o 169.7555 111.4305 -0.3382273E-02 18.45596      -0.3382273E-02 18.45596      -0.3382273E-02 18.45596  169.7555 111.4305 169.7555 111.4305 -0.000000      0.000000 
1 1 1 -17 0  15 o 164.5870 108.8068 -1.037904      18.09113      -1.037904      18.09113      -1.037904      18.09113  164.5870 108.8068 164.5870 108.8068 0.000000       0.000000 
1 1 1 -17 0  16 o 375.3702 107.2819 35.39461       13.55536      35.39461       13.55536      35.39461       13.55536  375.3702 107.2819 375.3702 107.2819 -0.000000      0.000000 
1 1 1 -17 0  17 o 147.5373 95.70171 1.350336       13.04522      1.350336       13.04522      1.350336       13.04522  147.5373 95.70171 147.5373 95.70171 -0.000000      0.000000 
1 1 1 -17 0  18 o 168.7432 103.2794 7.014773       12.92586      7.014773       12.92586      7.014773       12.92586  168.7432 103.2794 168.7432 103.2794 -0.000000      0.000000 
1 1 1 -17 0  19 o 207.4396 123.4640 14.03618       17.43479      14.03618       17.43479      14.03618       17.43479  207.4396 123.4640 207.4396 123.4640 0.000000       0.000000 
1 1 1 -17 0  20 o 159.8089 106.2660 0.6822052      17.66627      0.6822052      17.66627      0.6822052      17.66627  159.8089 106.2660 159.8089 106.2660 0.000000       0.000000 
1 1 1 -17 0  21 o 190.7725 107.6374 12.60748       12.19078      12.60748       12.19078      12.60748       12.19078  190.7725 107.6374 190.7725 107.6374 0.000000       0.000000 
1 1 1 -17 0  22 o 125.8420 83.98752 -0.6189257     11.21499      -0.6189257     11.21499      -0.6189257     11.21499  125.8420 83.98752 125.8420 83.98752 -0.000000      0.000000 
1 1 1 -17 0  23 o 94.53744 67.19776 -11.30762      10.58976      -11.30762      10.58976      -11.30762      10.58976  94.53744 67.19776 94.53744 67.19776 0.000000       0.000000 
1 1 1 -17 0  24 o 146.1433 90.48227 6.510912       10.18951      6.510912       10.18951      6.510912       10.18951  146.1433 90.48227 146.1433 90.48227 -0.000000      0.000000 
1 1 1 -17 0  25 o 93.55108 65.97184 -7.701383      9.542402      -7.701383      9.542402      -7.701383      9.542402  93.55108 65.97184 93.55108 65.97184 -0.000000      0.000000 
1 1 1 -17 0  26 o 145.6540 89.41862 7.532514       9.755472      7.532514       9.755472      7.532514       9.755472  145.6540 89.41862 145.6540 89.41862 0.000000       0.000000 
1 1 1 -17 1  1  o 669.3556 24.38074 87.91447       6.337702      94.38927       9.060830      81.71232       8.868008  690.2589 33.80088 640.5419 35.79243 49.71692       49.23005 
1 1 1 -17 1  2  o 558.5866 28.40442 61.64219       6.141451      63.73802       8.523782      59.37960       8.856411  563.7359 39.17731 542.5726 42.36721 21.16333       57.70478 
1 1 1 -17 1  3  o 120.5911 54.71257 -2.601039      5.552469      0.3082705      7.664262      -5.814602      8.055059  157.4236 68.13884 135.8232 63.15747 21.60036       92.90730 
1 1 1 -17 1  4  o 709.0487 24.77485 98.84865       6.822054      105.3722       9.943079      93.04622       9.377432  727.4937 35.19360 682.6339 35.49514 44.85980       49.98494 
1 1 1 -17 1  5  o 573.9028 29.70494 65.34099       6.597888      66.27246       9.273462      64.38610       9.389260  571.9921 42.04149 563.0685 43.26906 8.923584       60.32991 
1 1 1 -17 1  6  o 174.7376 66.42266 5.248721       6.227496      -1.474228      9.042426      11.31444       8.589070  160.0942 71.45267 229.0025 79.26678 -68.90826      106.7179 
1 1 1 -17 1  7  o 208.1870 78.82870 8.348792       8.749428      0.000000       0.000000      8.348792       8.749428  ?        ?        208.1870 78.82870 0.000000       78.82870 
1 1 1 -17 1  8  o 365.0711 49.18406 27.91256       6.795698      35.51960       9.385620      19.52989       9.852507  404.7180 61.66365 286.6317 83.44908 118.0863       103.7601 
1 1 1 -17 1  9  o 522.9301 36.38362 55.31201       7.342839      66.13456       10.43445      44.69489       10.33495  563.8524 48.11188 454.5563 60.01272 109.2961       76.91736 
1 1 1 -17 1  10 f 253.8117 71.69945 14.94597       7.379048      11.65000       11.06018      17.58995       9.906051  230.7087 88.32365 268.6609 84.85986 -37.95224      122.4837 
1 1 1 -17 1  11 o 161.5731 69.48251 1.827529       7.866494      4.769390       11.66010      -0.6300408     10.65722  197.5814 84.76966 170.8842 76.82233 26.69720       114.4009 
1 1 1 -17 1  12 f 440.1929 53.16718 41.79018       8.904854      42.18091       13.09206      41.45380       12.14763  413.1662 84.44466 416.1188 78.03710 -2.952606      114.9813 
1 1 1 -17 1  13 o 184.2143 78.43195 4.675245       9.844847      14.57762       16.42866      -0.8730770     12.29740  242.8419 102.2529 176.2716 80.53210 66.57034       130.1579 
1 1 1 -17 1  14 o 174.0269 80.51030 -1.664620      12.84008      -21.49136      18.91957      15.26488       17.48266  165.9673 81.84681 240.1046 103.4195 -74.13739      131.8882 
1 1 1 -17 1  15 o 249.5908 89.93256 18.00788       11.14105      21.16454       13.67112      11.76647       19.22347  259.7511 98.49239 223.6514 101.5988 36.09966       141.5029 
1 1 1 -17 1  16 o 247.2242 83.62143 17.81293       9.546400      17.79803       13.81625      17.82654       13.20573  233.7864 95.67510 235.0383 94.49985 -1.251938      134.4766 
1 1 1 -17 1  17 o 147.2625 71.46822 -7.637320      12.79558      0.000000       0.000000      -7.637320      12.79558  ?        ?        147.2625 71.46822 0.000000       71.46822 
1 1 1 -17 1  18 o 180.3966 75.99475 9.165524       9.081259      2.647337       12.85508      15.65894       12.83063  164.2663 77.46352 205.0167 88.45107 -40.75038      117.5763 
1 1 1 -17 1  19 o 179.8273 81.55698 11.43730       12.32258      24.92694       17.90000      -0.7144386     16.98917  206.3774 95.32971 158.4431 78.02387 47.93436       123.1888 
1 1 1 -17 1  20 o 116.1068 58.69414 -19.68673      12.85047      -25.07733      18.28301      -14.42359      18.06556  129.0179 65.70812 137.1093 69.34442 -8.091461      95.53118 
1 1 1 -17 1  21 o 96.28745 48.47062 -13.96216      8.254865      -11.41171      12.54365      -15.91053      10.96353  119.0981 59.92760 107.8242 54.47228 11.27387       80.98485 
1 1 1 -17 1  22 o 122.7554 58.43464 2.402930       7.650283      6.536487       10.77402      -1.800598      10.86482  136.3330 66.02587 120.8899 60.04261 15.44312       89.24422 
1 1 1 -17 1  23 o 155.2291 66.31572 12.56158       7.081504      4.826198       9.936801      20.54457       10.09458  122.7576 60.29660 164.3188 74.23421 -41.56123      95.63680 
1 1 1 -17 1  24 o 92.95983 46.27430 -3.307059      6.601162      3.349092       9.454578      -9.638004      9.220720  110.6779 55.14075 92.96819 47.28153 17.70971       72.63639 
1 1 1 -17 1  25 o 89.53820 44.94648 -2.974895      6.845184      -16.30627      9.517604      11.31020       9.852166  83.25098 42.76008 114.4040 56.88092 -31.15299      71.16083 
1 1 1 -17 1  26 o 97.70635 48.33660 4.003219       6.783585      9.343530       9.618135      -1.282588      9.568929  103.9032 52.30637 91.76575 46.80741 12.13749       70.19181 
1 1 1 -17 2  1  o 1013.771 19.54031 200.9215       7.693067      208.0004       11.01994      194.1920       10.74457  1028.019 27.60260 993.1866 27.85672 34.83258       39.21607 
1 1 1 -17 2  2  o 558.4534 27.66065 61.42130       5.998980      66.39961       8.496671      56.47294       8.471064  575.8243 38.21244 529.3754 41.53810 46.44891       56.44115 
1 1 1 -17 2  3  o 862.4594 21.64501 145.7590       7.249772      140.9029       9.898770      151.3777       10.64759  844.3568 30.18751 874.5789 31.34903 -30.22217      43.52066 
1 1 1 -17 2  4  o 305.1115 50.36980 19.43743       5.760100      19.69871       8.270779      19.19135       8.026726  297.5518 72.28824 294.1780 71.05719 3.373779       101.3643 
1 1 1 -17 2  5  o 259.6457 59.70756 14.59461       5.894899      5.487300       8.436049      23.28497       8.240678  190.5292 75.89754 325.7902 67.35727 -135.2610      101.4763 
1 1 1 -17 2  6  o 170.1321 65.53907 4.742287       6.114748      9.076173       8.942697      0.9367861      8.379840  214.5318 80.01505 165.1174 71.35905 49.41438       107.2125 
1 1 1 -17 2  7  o 531.5300 34.50757 56.68995       7.084577      57.51707       10.26100      55.93646       9.793550  525.6842 50.89904 519.5405 49.12202 6.143677       70.73673 
1 1 1 -17 2  8  o 251.2396 66.93338 14.18942       6.648146      18.13026       9.783327      10.80838       9.061866  276.2697 83.84581 224.0861 81.05264 52.18359       116.6175 
1 1 1 -17 2  9  o 173.1552 68.86324 4.681050       6.934278      -4.322879      9.906318      13.33117       9.709736  154.6076 71.24051 240.6340 84.22342 -86.02638      110.3123 
1 1 1 -17 2  10 o 347.8194 60.20477 26.56699       7.837842      13.95639       11.49885      37.51022       10.71172  244.3873 90.81517 406.6184 70.38181 -162.2311      114.8956 
1 1 1 -17 2  11 o 380.1945 53.85265 31.14536       7.729008      26.41953       11.89949      34.59403       10.16519  320.6917 91.21015 388.7016 69.91006 -68.00998      114.9204 
1 1 1 -17 2  12 o 226.6755 77.86250 12.19394       8.279762      15.73258       12.59793      9.503085       10.98566  249.3534 94.54810 214.4433 86.20113 34.91014       127.9452 
1 1 1 -17 2  13 o 156.9398 71.75262 -1.972546      9.784743      -13.09669      17.47541      3.107566       11.80948  174.8509 84.53665 187.0227 82.66154 -12.17180      118.2344 
1 1 1 -17 2  14 o 286.0770 96.44973 23.91454       12.69967      23.54730       17.18534      24.35637       18.84996  270.5674 108.1487 270.9501 111.4185 -0.3826904     155.2747 
1 1 1 -17 2  15 o 170.6714 77.00779 1.705105       10.82367      -9.014061      13.03174      25.54528       19.43465  153.5900 73.94328 263.4538 111.0884 -109.8637      133.4475 
1 1 1 -17 2  16 o 430.1715 58.85780 43.57310       9.574787      56.57770       13.76487      31.38214       13.32731  459.3731 80.06833 307.5690 98.56573 151.8041       126.9887 
1 1 1 -17 2  17 o 236.7735 81.05970 17.12895       8.971514      21.09069       12.53253      12.96482       12.84865  241.4421 93.59753 204.2711 88.32041 37.17101       128.6895 
1 1 1 -17 2  18 o 114.7954 56.48083 -10.48574      8.838280      -1.569293      12.53629      -19.29749      12.46247  152.9573 73.34811 122.5249 61.38351 30.43246       95.64455 
1 1 1 -17 2  19 o 160.4592 74.00826 5.801045       10.72868      14.35188       13.88957      -6.847352      16.89282  186.2817 85.28603 149.3644 74.29854 36.91733       113.1105 
1 1 1 -17 2  20 o 199.8433 86.43314 20.79281       12.31318      20.33768       18.36761      21.16429       16.59408  179.5181 86.76285 184.6650 87.36612 -5.146973      123.1285 
1 1 1 -17 2  21 o 148.9220 66.57091 7.520213       7.882152      1.291941       12.05566      12.17049       10.41709  135.9052 66.68565 162.4333 74.17496 -26.52808      99.74417 
1 1 1 -17 2  22 o 417.9744 48.74237 47.31018       7.763364      38.60788       11.56026      54.45871       10.47753  251.4903 91.45728 392.9432 71.28482 -141.4529      115.9567 
1 1 1 -17 2  23 o 217.7093 71.95399 21.76466       7.073620      20.31471       10.52397      22.95953       9.553512  158.8914 73.28992 178.5782 76.67693 -19.68681      106.0696 
1 1 1 -17 2  24 o 102.2425 50.21432 0.7463063      6.885514      9.927431       10.00564      -7.512894      9.489989  121.3257 59.77126 95.74353 48.61982 25.58218       77.04863 
1 1 1 -17 2  25 o 142.6734 63.37096 15.77666       7.024339      23.08759       10.04209      8.772492       9.829163  136.7646 65.60012 110.0195 55.02919 26.74503       85.62469 
1 1 1 -17 2  26 o 83.51220 42.21016 -3.725334      6.630033      -8.429940      9.371409      0.9890725      9.381166  84.94938 43.55746 93.75221 47.68132 -8.802834      64.58143 
1 1 1 -17 3  1  o 263.6264 63.73326 15.00623       6.453051      20.76981       11.69814      12.48528       7.736648  300.8056 91.77224 240.1834 74.86371 60.62222       118.4344 
1 1 1 -17 3  2  o 98.48026 48.42436 -12.57843      6.463951      0.9297094      12.68413      -17.31718      7.512677  198.5155 86.76849 100.2489 49.81428 98.26659       100.0512 
1 1 1 -17 3  3  o 982.8810 20.76034 189.1852       7.924345      186.3448       11.16301      192.0705       11.25093  971.2459 29.59540 986.1780 29.37685 -14.93207      41.69997 
1 1 1 -17 3  4  o 823.1634 22.70536 132.9881       7.258426      134.0564       10.04212      131.8193       10.50333  822.4616 31.43995 814.6241 33.20029 7.837463       45.72450 
1 1 1 -17 3  5  o 123.0115 56.18039 -3.083431      5.978332      13.97542       9.019354      -16.45142      7.984239  249.7667 81.18723 106.4152 52.60744 143.3515       96.74145 
1 1 1 -17 3  6  o 287.9611 58.13826 17.87432       6.277651      33.06993       9.351390      5.408726       8.469810  390.8127 63.81693 189.3933 75.84547 201.4194       99.12183 
1 1 1 -17 3  7  o 506.0442 36.10674 51.57590       7.049284      34.13476       10.15234      67.81291       9.795616  392.6193 69.10727 575.6671 44.15242 -183.0478      82.00762 
1 1 1 -17 3  8  o 504.6308 37.01913 51.49531       7.204217      58.32903       11.16045      46.61368       9.432698  524.6644 55.62199 470.7126 52.49440 53.95178       76.48181 
1 1 1 -17 3  9  o 434.9698 44.75621 39.16467       7.452428      47.02062       11.42529      33.34710       9.831923  461.7607 65.55257 386.0581 68.06530 75.70258       94.49881 
1 1 1 -17 3  10 o 340.6344 59.98394 25.50039       7.645242      24.28841       11.34294      26.50932       10.34927  311.2047 89.23303 332.2300 80.95487 -21.02536      120.4833 
1 1 1 -17 3  11 o 194.7705 74.44203 7.578300       7.848694      -2.114365      11.60231      15.75627       10.65726  171.7272 78.36540 252.4930 88.24496 -80.76573      118.0183 
1 1 1 -17 3  12 o 305.6150 76.66454 22.68568       9.083516      8.504030       16.50362      28.84883       10.87971  225.4985 98.75734 339.9793 83.10184 -114.4808      129.0695 
1 1 1 -17 3  13 o 318.4942 78.39387 25.26208       9.631063      8.957676       17.18901      32.72295       11.62768  224.1615 99.36913 357.0662 85.06518 -132.9047      130.8064 
1 1 1 -17 3  14 o 198.9443 81.14258 8.367616       9.895884      3.053364       15.77997      11.81229       12.70454  198.4114 90.86340 220.9035 91.22411 -22.49210      128.7556 
1 1 1 -17 3  15 o 196.5238 82.74355 8.349011       10.75636      13.60791       13.47806      -0.8756836     17.85074  222.9061 93.15953 190.0994 90.13376 32.80664       129.6256 
1 1 1 -17 3  16 o 146.6219 68.40711 -2.181100      9.576525      4.612238       13.43113      -9.206111      13.65823  183.7656 84.03590 151.9591 73.76833 31.80653       111.8204 
1 1 1 -17 3  17 o 148.7565 68.23637 0.7199079      8.950042      15.28932       12.59795      -14.12720      12.71744  212.5108 89.51469 134.5088 66.47665 78.00201       111.4990 
1 1 1 -17 3  18 o 181.3029 78.56181 9.649088       10.21101      14.93338       13.14072      1.595649       16.22245  199.5932 87.74950 167.8375 81.21915 31.75577       119.5681 
1 1 1 -17 3  19 o 131.1961 63.59457 -4.088067      10.05066      0.9119530      13.25276      -10.85679      15.41962  152.3418 73.64529 139.7115 69.73450 12.63023       101.4225 
1 1 1 -17 3  20 o 153.2542 73.12228 5.977684       12.12611      7.001240       18.26195      5.170491       16.21736  158.3666 78.51710 154.8723 76.25877 3.494324       109.4547 
1 1 1 -17 3  21 o 107.2768 53.01597 -6.542938      8.085785      3.677730       11.95315      -15.16544      10.97892  139.2312 67.90734 107.9840 54.54790 31.24726       87.10270 
1 1 1 -17 3  22 o 145.8776 64.52568 8.895285       7.209538      27.08943       11.13278      -4.246309      9.461535  196.7507 83.57838 112.0005 55.69500 84.75027       100.4354 
1 1 1 -17 3  23 o 97.19967 48.09504 -3.581386      6.727719      -2.555284      9.967164      -4.440146      9.118270  109.0480 54.67005 104.2348 52.26154 4.813255       75.63123 
1 1 1 -17 3  24 o 93.97575 46.54155 -2.018992      6.352425      -0.5132010     9.642182      -3.173791      8.443958  104.0358 52.37295 98.10877 49.34013 5.927071       71.95397 
1 1 1 -17 3  25 o 101.1857 49.43372 3.340812       6.409911      7.029552       9.190078      -0.1537025     8.944860  107.4034 53.64360 97.09486 49.06979 10.30850       72.70131 
1 1 1 -17 4  1  o 161.3606 61.17995 4.192992       5.274673      2.679863       7.126995      6.025602       7.843387  166.0163 68.41754 192.2047 74.17509 -26.18837      100.9104 
1 1 1 -17 4  2  o 259.3925 56.67611 14.33625       5.549732      16.47422       8.004604      12.35728       7.701200  272.5293 73.80923 238.4144 74.75420 34.11493       105.0523 
1 1 1 -17 4  3  o 179.0119 68.61201 5.279859       6.679169      3.313431       12.41560      6.080738       7.923409  205.1711 87.73413 192.1197 74.43739 13.05142       115.0574 
1 1 1 -17 4  4  o 766.3663 24.43437 115.4839       7.272194      110.6605       10.35285      120.1819       10.21736  744.8901 35.78820 777.3589 33.84458 -32.46887      49.25698 
1 1 1 -17 4  5  o 401.9795 63.85933 34.83055       9.635718      34.83055       9.635718      0.000000       0.000000  401.9795 63.85933 ?        ?        0.000000       63.85933 
1 1 1 -17 4  6  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -17 4  7  o 389.5138 70.17508 33.76998       10.22488      33.76998       10.22488      0.000000       0.000000  389.5138 70.17508 ?        ?        0.000000       70.17508 
1 1 1 -17 4  8  o 220.0217 70.81953 10.75888       6.874399      6.672059       10.54440      13.78002       9.065973  205.0413 83.70905 244.5687 81.48959 -39.52744      116.8236 
1 1 1 -17 4  9  o 447.4372 42.89824 41.24102       7.362800      42.61559       11.53994      40.29729       9.561907  434.9180 70.75564 432.0452 58.49233 2.872803       91.80257 
1 1 1 -17 4  10 o 182.8926 71.30338 6.002222       7.305199      -2.167179      11.73630      11.16925       9.333762  173.6093 79.06602 223.7760 82.05716 -50.16670      113.9509 
1 1 1 -17 4  11 o 210.3878 79.17862 9.558471       8.795259      7.677130       15.69079      10.42041       10.62063  223.2077 97.05321 220.0362 85.92162 3.171539       129.6220 
1 1 1 -17 4  12 o 308.5764 74.59283 22.94050       8.840150      6.692227       15.40155      30.92351       10.79554  215.5843 94.88412 354.6165 80.26048 -139.0322      124.2769 
1 1 1 -17 4  13 o 242.2713 82.05875 14.97618       9.193062      -18.29586      16.02793      31.28821       11.22255  157.9684 77.38409 349.3348 83.79822 -191.3664      114.0633 
1 1 1 -17 4  14 o 111.8425 55.29958 -15.61345      8.834829      -10.68194      13.45589      -19.35033      11.71326  154.5370 74.58516 127.7189 63.24324 26.81807       97.78883 
1 1 1 -17 4  15 o 190.6360 81.61862 7.264773       10.76878      4.323178       14.04529      11.46049       16.77423  189.8230 86.46739 216.3159 96.87582 -26.49297      129.8520 
1 1 1 -17 4  16 o 231.8798 88.59191 16.95470       11.11340      26.76836       14.09400      0.8225101      18.07030  270.7725 100.5576 185.2626 88.63361 85.50993       134.0438 
1 1 1 -17 4  17 o 203.6114 78.86864 12.49801       8.892989      27.74934       12.91981      -1.233845      12.25934  270.5988 96.91518 156.7833 74.44101 113.8155       122.2048 
1 1 1 -17 4  18 o 228.0144 85.27094 19.00960       10.16939      12.79888       13.34289      27.61753       15.70827  190.2533 85.70382 234.2594 99.38398 -44.00607      131.2338 
1 1 1 -17 4  19 o 128.8162 62.71557 -4.854889      10.06660      1.768242       13.03151      -14.65523      15.85198  152.3611 73.50061 135.5679 68.10001 16.79324       100.1996 
1 1 1 -17 4  20 o 122.0323 59.84804 -4.894698      9.671081      29.86316       18.32000      -18.32301      11.38701  192.4533 91.26749 109.7148 55.43776 82.73849       106.7853 
1 1 1 -17 4  21 o 132.1089 61.82459 3.633104       7.920342      -7.363633      11.52238      13.48334       10.90520  119.0967 59.57108 162.2216 74.74780 -43.12489      95.58215 
1 1 1 -17 4  22 o 107.8158 52.49192 -1.588757      7.052676      0.5281413      10.51047      -3.322587      9.512077  121.6220 60.16777 112.7868 56.04576 8.835197       82.22706 
1 1 1 -17 4  23 o 102.3094 49.87858 -0.5855622     6.429688      -0.1892684     9.414581      -0.9319767     8.802185  110.5441 55.06587 108.1277 53.76107 2.416382       76.95780 
1 1 1 -17 4  24 o 80.33170 40.69158 -9.465221      6.372897      -14.08456      9.439906      -5.596837      8.638586  87.97258 45.00483 94.54182 47.83164 -6.569244      65.67572 
1 1 1 -17 4  25 o 89.40177 44.70538 -1.834369      6.468674      -1.376216      9.357388      -2.253707      8.952228  95.47611 48.46281 93.91667 47.64346 1.559441       67.95987 
1 1 1 -17 5  1  o 341.7840 44.45428 23.86062       5.760890      25.11579       7.917536      22.44851       8.397927  343.5230 61.61162 320.7923 69.42433 22.73065       92.82095 
1 1 1 -17 5  2  o 342.6357 44.37164 24.01100       5.765594      33.27754       8.010954      14.05285       8.304529  400.3877 52.80855 252.1492 77.39374 148.2384       93.69382 
1 1 1 -17 5  3  o 524.3491 30.90461 54.60558       6.265379      51.26242       8.992337      57.75975       8.734459  500.8565 46.77208 534.1573 42.45575 -33.30075      63.16738 
1 1 1 -17 5  4  o 522.2194 46.59732 55.79836       9.350944      0.000000       0.000000      55.79836       9.350944  ?        ?        522.2194 46.59732 0.000000       46.59732 
1 1 1 -17 5  5  o 665.9036 31.23967 88.01389       8.078780      96.27902       15.41113      84.88192       9.486761  675.6537 59.33400 649.7233 37.76060 25.93042       70.33055 
1 1 1 -17 5  6  o 257.8282 63.71147 14.67026       6.342474      19.30029       9.475126      10.91148       8.537235  287.9200 81.21650 225.2666 78.96736 62.65341       113.2783 
1 1 1 -17 5  7  o 400.4081 45.03431 33.08678       6.881327      33.12482       10.77810      33.06061       8.940741  381.7578 75.37370 391.2138 60.82372 -9.456024      96.85412 
1 1 1 -17 5  8  o 431.9725 43.66541 38.43751       7.224654      46.90026       11.37670      32.71826       9.352551  462.4896 65.14639 385.4883 64.76979 77.00134       91.86500 
1 1 1 -17 5  9  o 157.7897 67.41727 1.667757       7.320210      -0.6249778     11.25416      3.349106       9.637515  176.6756 79.22079 182.4966 77.64879 -5.821030      110.9291 
1 1 1 -17 5  10 o 371.1196 59.99901 30.26023       8.352333      11.21057       15.58785      37.93218       9.892261  238.0530 99.88551 413.3865 63.66164 -175.3336      118.4480 
1 1 1 -17 5  11 o 134.7805 62.77118 -4.743226      8.006948      -5.520901      14.72854      -4.416971      9.539782  179.8787 84.22073 148.9827 69.09031 30.89604       108.9339 
1 1 1 -17 5  12 o 471.4596 51.23311 47.81918       9.229451      47.48304       15.82246      47.99254       11.36286  417.9514 99.00381 458.7917 65.64539 -40.84027      118.7900 
1 1 1 -17 5  13 o 164.6212 71.13639 2.617714       8.325694      -28.25096      13.75473      20.46735       10.45942  129.8958 64.98985 275.9436 87.20188 -146.0478      108.7559 
1 1 1 -17 5  14 o 171.2633 72.52243 4.466402       8.339591      -0.5594308     13.34545      7.686419       10.68215  176.8831 81.91887 195.7476 82.43933 -18.86443      116.2194 
1 1 1 -17 5  15 o 195.6568 82.81988 8.716329       10.86924      3.409232       14.34624      15.86761       16.65335  186.3314 85.81119 227.1410 99.34740 -40.80959      131.2763 
1 1 1 -17 5  16 o 152.3530 71.60782 -1.939321      10.82315      14.70329       14.17834      -25.17978      16.75472  214.1162 92.67731 141.3624 70.87202 72.75381       116.6702 
1 1 1 -17 5  17 o 118.0387 57.51418 -8.462108      8.514300      -2.142304      12.59745      -13.77684      11.55239  154.5061 73.94149 127.1736 62.94362 27.33254       97.10429 
1 1 1 -17 5  18 o 197.1271 80.87096 13.69739       9.901698      14.53543       12.62916      12.36033       15.95203  194.4903 85.74620 185.4586 87.09295 9.031708       122.2194 
1 1 1 -17 5  19 o 118.8956 58.48977 -7.811498      9.466754      -11.06014      11.82010      -1.999747      15.80970  124.6294 62.01983 149.7690 74.03745 -25.13955      96.58159 
1 1 1 -17 5  20 o 143.3605 67.47403 4.399621       9.667356      12.23270       16.91385      0.5990818      11.78145  161.5940 79.22935 138.3606 67.46843 23.23341       104.0638 
1 1 1 -17 5  21 o 105.1716 51.82216 -5.398267      7.532439      -9.942159      10.94651      -1.311791      10.38093  112.5497 56.54450 124.2244 61.13774 -11.67469      83.27727 
1 1 1 -17 5  22 o 120.6868 56.82643 3.346235       6.870296      -4.168382      10.00505      10.05128       9.450759  111.5384 55.74822 140.8526 66.42128 -29.31414      86.71592 
1 1 1 -17 5  23 o 126.5488 58.32591 7.150042       6.645826      9.517482       9.917812      5.220698       8.953260  127.2425 62.01521 118.8547 58.14117 8.387802       85.00755 
1 1 1 -17 5  24 o 211.8865 70.16459 23.50813       6.724985      34.28415       9.895780      14.26069       9.167095  191.6187 79.93210 128.8791 62.03926 62.73952       101.1831 
1 1 1 -17 5  25 o 196.2108 68.58167 22.84573       6.437058      28.58446       9.527531      18.02616       8.731251  153.6077 70.44019 129.8714 61.98841 23.73627       93.83167 
1 1 1 -17 6  1  o 498.0698 34.17144 49.44757       6.569722      44.74517       8.178571      58.00131       11.03052  469.0225 45.47218 529.6176 54.40276 -60.59503      70.90401 
1 1 1 -17 6  2  o 170.7718 63.69303 5.055826       5.666395      13.09150       7.930565      -3.324971      8.099076  244.1172 75.74799 145.3381 65.99358 98.77910       100.4635 
1 1 1 -17 6  3  o 379.3837 42.09489 29.28783       6.097506      37.78166       8.920414      21.83878       8.353798  424.9099 55.37394 314.5172 70.17506 110.3927       89.39134 
1 1 1 -17 6  4  o 219.0609 65.88233 10.41905       6.060478      22.28365       8.758358      -0.4810419     8.394815  315.6134 72.92210 159.2388 70.06898 156.3746       101.1301 
1 1 1 -17 6  5  o 82.78745 41.70469 -18.54455      6.171725      -4.886847      9.159690      -29.90074      8.352346  148.3967 68.42307 89.42554 45.43177 58.97119       82.13258 
1 1 1 -17 6  6  o 238.9769 73.52135 12.82587       7.489326      1.960339       13.71185      17.44552       8.940783  203.7452 89.60407 274.5203 79.37118 -70.77507      119.7024 
1 1 1 -17 6  7  o 443.1742 41.94455 40.18335       7.133134      54.30477       10.99391      29.91648       9.374147  505.5306 56.99312 366.7995 68.32136 138.7310       88.97204 
1 1 1 -17 6  8  o 386.3315 49.77822 31.36706       7.294669      28.87444       11.38648      33.10226       9.500258  346.4255 85.22137 386.8736 65.57433 -40.44806      107.5299 
1 1 1 -17 6  9  o 167.9302 70.84692 2.778630       7.911304      3.012767       15.21264      2.691833       9.262335  209.7654 93.21077 176.7052 75.67564 33.06023       120.0627 
1 1 1 -17 6  10 f 294.4571 72.69986 20.35191       8.263680      26.66012       14.72603      17.45237       9.983829  310.9708 103.8646 265.5430 85.33305 45.42776       134.4232 
1 1 1 -17 6  11 o 653.2483 36.96253 87.10455       9.338634      116.0546       17.25158      75.10527       11.10663  723.8246 61.96906 596.2108 48.38569 127.6138       78.62149 
1 1 1 -17 6  12 o 143.1845 66.07554 -3.301846      8.568755      -17.53361      15.53668      2.919376       10.27228  157.3823 76.90379 178.6676 78.08911 -21.28531      109.5997 
1 1 1 -17 6  13 o 463.1005 48.68589 46.32541       8.624912      43.56837       13.39619      48.27740       11.27195  406.8602 87.39011 455.1991 65.66209 -48.33884      109.3094 
1 1 1 -17 6  14 o 348.9487 65.03967 29.08526       8.489627      24.23489       13.60024      32.18186       10.86681  275.7021 99.36121 348.4119 81.72438 -72.70975      128.6527 
1 1 1 -17 6  15 o 252.6955 84.78672 18.82790       9.813537      21.15217       13.15513      15.91149       14.73588  251.2130 96.28979 224.8725 95.85500 26.34052       135.8672 
1 1 1 -17 6  16 f 164.5560 75.01669 2.850140       10.59788      -7.642915      13.66850      18.66661       16.78126  151.3337 73.54099 221.4508 98.17471 -70.11708      122.6644 
1 1 1 -17 6  17 o 280.6076 87.05151 26.48880       10.47470      16.78951       13.64561      40.40296       16.34373  208.8109 90.64990 293.1678 108.4027 -84.35690      141.3101 
1 1 1 -17 6  18 o 154.3945 70.98549 4.049490       9.762075      1.843626       12.45944      7.556602       15.71028  155.0301 74.01140 172.1290 82.42732 -17.09894      110.7788 
1 1 1 -17 6  19 o 216.7359 78.89766 17.93177       8.606293      -4.427408      12.12355      40.64545       12.21928  135.0539 66.39011 313.9154 93.35488 -178.8615      114.5547 
1 1 1 -17 6  20 o 290.3936 84.68749 34.02816       10.13945      31.34511       17.16530      35.46603       12.56601  192.3684 90.33992 251.0060 94.60707 -58.63760      130.8121 
1 1 1 -17 6  21 o 139.0756 66.88955 6.638308       10.60168      0.000000       0.000000      6.638308       10.60168  ?        ?        139.0756 66.88955 0.000000       66.88955 
1 1 1 -17 6  22 o 142.4978 62.82235 9.072095       6.778695      1.858990       9.564240      16.35281       9.608959  119.2266 58.67913 157.6164 71.68951 -38.38976      92.64246 
1 1 1 -17 6  23 o 96.50298 47.69632 -2.322402      6.550181      9.641891       9.657037      -12.51686      8.914202  125.5835 61.20399 90.47646 46.06017 35.10708       76.59940 
1 1 1 -17 6  24 o 97.37439 48.01216 0.4270764      6.501366      -5.801089      9.443786      6.038022       8.963634  94.37521 47.98277 110.2064 54.70238 -15.83118      72.76467 
1 1 1 -17 6  25 o 92.48583 45.94768 0.4686086      6.379437      7.849200       9.468720      -5.666460      8.632874  105.5432 52.96429 88.22684 44.95399 17.31635       69.46997 
1 1 1 -17 7  1  o 406.0418 37.25452 33.12125       5.809081      36.94849       7.800533      28.35602       8.704098  424.4788 48.17262 363.9146 63.92036 60.56415       80.04008 
1 1 1 -17 7  2  o 179.8438 78.04729 0.9046245      10.10815      0.000000       0.000000      0.9046245      10.10815  ?        ?        179.8438 78.04729 0.000000       78.04729 
1 1 1 -17 7  3  o 247.0309 63.32106 13.31695       6.102963      19.28815       8.427733      6.733141       8.849492  293.2691 73.99852 200.7150 78.41583 92.55418       107.8185 
1 1 1 -17 7  4  o 481.6993 34.81702 46.49238       6.469354      47.85136       9.364368      45.25158       8.947928  480.4837 50.96274 467.6558 50.04512 12.82788       71.42629 
1 1 1 -17 7  5  o 267.7510 63.90675 15.78636       6.552916      32.73026       9.942989      2.775756       8.712824  385.4722 68.95076 176.5529 74.40966 208.9193       101.4446 
1 1 1 -17 7  6  o 389.9943 46.12112 31.45742       6.850058      28.01598       10.42498      34.07224       9.087126  348.4224 78.88012 397.6533 60.77234 -49.23090      99.57585 
1 1 1 -17 7  7  o 240.9037 69.99390 13.13093       6.937730      -4.319461      11.13219      24.21267       8.871192  164.8607 75.79970 326.4728 71.91196 -161.6121      104.4841 
1 1 1 -17 7  8  o 676.1714 39.41800 92.98522       10.30605      0.000000       0.000000      92.98522       10.30605  ?        ?        676.1714 39.41800 0.000000       39.41800 
1 1 1 -17 7  9  o 517.2050 42.14820 55.08266       8.392207      31.38562       15.70807      64.54851       9.927851  336.8908 106.9075 556.8959 46.32465 -220.0050      116.5126 
1 1 1 -17 7  10 o 468.2470 47.35858 46.12825       8.493550      34.51419       15.41848      51.18802       10.17689  351.5715 104.9373 487.4122 54.70847 -135.8407      118.3421 
1 1 1 -17 7  11 o 614.5577 71.79930 87.76816       16.81303      87.76816       16.81303      0.000000       0.000000  614.5577 71.79930 ?        ?        0.000000       71.79930 
1 1 1 -17 7  12 o 368.4974 60.30693 30.73092       8.331753      36.77890       13.82408      27.28076       10.44120  364.1493 96.28338 326.5334 82.35031 37.61588       126.6967 
1 1 1 -17 7  13 o 179.5476 74.03797 5.889914       8.352184      6.379226       14.09575      5.625168       10.36834  201.6562 89.66011 186.3341 79.94000 15.32211       120.1222 
1 1 1 -17 7  14 o 264.8795 76.89417 18.72931       8.376254      15.42659       13.71406      20.69451       10.57873  228.4979 94.60355 265.6064 88.00360 -37.10844      129.2071 
1 1 1 -17 7  15 o 159.6467 72.63840 1.471700       9.876004      -20.25233      13.66654      25.21541       14.28771  133.5374 66.49113 262.0842 100.3747 -128.5468      120.4000 
1 1 1 -17 7  16 o 157.8866 72.84198 1.633258       10.40395      -15.83875      13.66815      25.70179       16.04217  136.2502 67.61588 242.5953 101.5330 -106.3451      121.9871 
1 1 1 -17 7  17 f 165.7104 74.04618 6.007489       9.741344      8.262100       12.66963      2.747360       15.23511  177.5036 81.33598 167.8949 80.60323 9.608734       114.5095 
1 1 1 -17 7  18 o 153.1255 70.44164 4.362805       9.631482      14.99578       12.33871      -12.22095      15.40933  190.1159 84.23775 138.2387 69.10715 51.87720       108.9578 
1 1 1 -17 7  19 o 99.87654 49.88743 -12.12890      7.953869      -7.121603      11.30427      -17.03853      11.19349  125.8831 62.29763 111.2988 56.07983 14.58433       83.82089 
1 1 1 -17 7  20 o 98.67352 49.80341 -15.43113      9.040379      0.7813573      15.98366      -23.05720      10.96230  140.1708 70.11970 100.0311 50.93904 40.13963       86.66925 
1 1 1 -17 7  21 o 105.3341 51.66962 -3.542312      7.220543      -1.858400      10.12175      -5.287223      10.30345  118.9272 58.87199 113.8735 56.86397 5.053696       81.85000 
1 1 1 -17 7  22 o 99.62392 49.00026 -2.713908      6.633972      -4.775256      8.889127      -0.1224521     9.966789  104.1675 52.13604 114.1101 56.81203 -9.942619      77.10884 
1 1 1 -17 7  23 o 124.1686 57.21832 7.424405       6.391746      10.64158       9.364954      4.618818       8.745403  125.8512 61.09186 113.6675 55.97557 12.18366       82.85819 
1 1 1 -17 7  24 f 82.15481 41.49869 -6.923754      6.350618      -13.08295      9.189484      -1.293121      8.786334  85.73132 43.89949 97.42940 49.16636 -11.69808      65.91279 
1 1 1 -17 8  1  o 322.3716 70.77038 22.86990       8.617201      0.000000       0.000000      22.86990       8.617201  ?        ?        322.3716 70.77038 0.000000       70.77038 
1 1 1 -17 8  2  o 175.0728 64.60226 5.521557       5.798582      3.951361       8.155293      7.127005       8.246332  180.3113 73.61575 200.3288 76.36673 -20.01756      106.0715 
1 1 1 -17 8  3  o 714.7023 34.81605 101.8011       9.663461      101.8011       9.663461      0.000000       0.000000  714.7023 34.81605 ?        ?        0.000000       34.81605 
1 1 1 -17 8  4  o 182.2803 69.56089 5.758380       6.846572      4.573532       8.958653      7.422166       10.61599  187.9758 76.99768 212.1901 84.93473 -24.21434      114.6410 
1 1 1 -17 8  5  o 271.7963 99.82043 17.26857       13.81983      17.26857       13.81983      0.000000       0.000000  271.7963 99.82043 ?        ?        0.000000       99.82043 
1 1 1 -17 8  6  o 175.6316 70.83526 4.378393       7.445086      21.80622       14.82063      -1.503971      8.610354  294.0934 103.9621 155.1908 69.46091 138.9026       125.0317 
1 1 1 -17 8  7  o 605.5620 37.11963 74.15257       8.687396      62.91980       16.23533      78.65910       10.28345  518.6899 83.42633 619.6045 43.00248 -100.9146      93.85715 
1 1 1 -17 8  8  o 172.1511 70.78620 3.901370       7.607756      -2.178730      14.97497      6.016534       8.832480  193.3485 88.53401 191.4348 77.17302 1.913635       117.4476 
1 1 1 -17 8  9  o 177.0389 74.29747 3.818027       8.626876      0.000000       0.000000      3.818027       8.626876  ?        ?        177.0389 74.29747 0.000000       74.29747 
1 1 1 -17 8  10 o 387.0833 63.04049 33.64384       9.150414      63.14724       21.57108      27.16993       10.10460  457.1773 119.9829 334.0342 79.11264 123.1431       143.7175 
1 1 1 -17 8  11 o 385.1679 55.25940 32.63152       8.028998      36.18559       13.08227      30.48388       10.16953  369.7320 91.58520 354.1379 76.20249 15.59406       119.1414 
1 1 1 -17 8  12 f 208.2714 75.32710 10.37666       7.826626      12.83241       13.18478      9.040493       9.725509  227.0859 93.25909 202.8518 81.25994 24.23415       123.6949 
1 1 1 -17 8  13 o 132.6036 62.26247 -4.449298      8.147551      -14.13934      13.47932      1.129170       10.22734  146.4927 71.59293 165.8412 74.83980 -19.34853      103.5690 
1 1 1 -17 8  14 o 227.9188 77.84443 14.28480       8.273720      9.965755       13.54948      16.85275       10.44772  203.5740 89.31100 237.7218 86.86960 -34.14780      124.5905 
1 1 1 -17 8  15 o 163.3792 73.67661 3.037385       9.891528      8.668559       13.07926      -4.486938      15.11881  191.4032 85.64346 163.8953 79.09112 27.50787       116.5770 
1 1 1 -17 8  16 o 153.9220 73.35516 -1.526837      12.12906      -1.526837      12.12906      0.000000       0.000000  153.9220 73.35516 ?        ?        0.000000       73.35516 
1 1 1 -17 8  17 o 288.4308 86.53886 28.97219       10.46579      22.49929       12.60357      43.34841       18.78307  227.5678 92.02979 264.3513 110.1851 -36.78352      143.5626 
1 1 1 -17 8  18 o 117.5257 57.97303 -8.776488      9.513753      -17.61418      11.92885      6.670047       15.77047  116.5050 58.59900 163.9745 79.52435 -47.46951      98.78241 
1 1 1 -17 8  19 o 138.0396 63.52339 3.650322       7.841597      -6.931478      11.47664      12.91630       10.73942  124.9672 62.00668 171.5908 77.13106 -46.62360      98.96478 
1 1 1 -17 8  20 o 127.7794 61.52021 1.482593       9.023359      -21.09727      15.78101      12.45076       10.99870  116.8086 59.62793 157.9904 73.57692 -41.18180      94.70509 
1 1 1 -17 8  21 o 134.0096 60.98229 6.481026       6.963879      9.731827       9.687309      3.004613       10.01783  141.4061 66.85474 125.3361 61.35171 16.07001       90.73912 
1 1 1 -17 8  22 o 109.9839 53.08367 1.733477       6.817085      7.805659       9.288454      -5.356250      10.03658  126.5194 61.28093 104.6967 52.79734 21.82267       80.88826 
1 1 1 -17 8  23 o 86.75749 43.56274 -5.945743      6.452387      -7.487599      8.777001      -4.132519      9.518093  93.28480 47.30694 99.17005 50.17728 -5.885254      68.96162 
1 1 1 -17 8  24 o 100.5923 49.10146 2.806721       6.285081      4.147585       8.958405      1.506938       8.820105  104.0582 52.11894 100.0931 50.35027 3.965126       72.46746 
1 1 1 -17 9  1  o 179.3016 69.30499 5.194513       6.855692      21.24773       11.61781      -3.382084      8.491821  301.0200 91.37196 148.5796 67.50753 152.4404       113.6050 
1 1 1 -17 9  2  o 512.5579 37.56129 52.81918       7.424656      59.46352       12.08449      48.79018       9.410234  530.8257 59.65338 485.8287 50.61906 44.99695       78.23564 
1 1 1 -17 9  3  o 480.0558 41.05228 46.75130       7.579840      49.87282       13.39761      45.28177       9.192481  473.6248 75.36436 466.7443 51.57545 6.880432       91.32258 
1 1 1 -17 9  4  o 205.7049 72.02614 8.777011       7.101368      19.31672       13.93193      5.077461       8.254132  283.5197 100.7354 185.9217 74.72555 97.59802       125.4254 
1 1 1 -17 9  5  o 486.5507 47.47679 48.96171       8.856619      45.67556       15.23581      50.63888       10.88455  434.7444 93.05064 487.3072 58.69563 -52.56277      110.0163 
1 1 1 -17 9  6  o 352.4839 67.78278 27.72183       8.941714      26.59111       15.54939      28.28048       10.92963  317.2505 106.7250 345.6143 82.56219 -28.36386      134.9324 
1 1 1 -17 9  7  o 394.3180 104.1561 41.03162       16.18765      41.03162       16.18765      0.000000       0.000000  394.3180 104.1561 ?        ?        0.000000       104.1561 
1 1 1 -17 9  8  o 218.1263 76.60645 10.68329       8.036157      24.10663       15.25366      5.526204       9.454660  297.3318 105.4309 191.0126 78.77020 106.3192       131.6071 
1 1 1 -17 9  9  o 132.3979 61.40193 -4.184460      7.535994      -31.98504      12.03078      13.76728       9.667632  115.6279 58.24562 238.8899 84.01659 -123.2621      102.2318 
1 1 1 -17 9  10 o 411.7207 49.15941 36.25620       7.704840      34.37213       13.17537      37.23538       9.498266  359.1769 93.53255 406.7921 62.09109 -47.61517      112.2659 
1 1 1 -17 9  11 o 293.6668 77.34254 21.66451       8.942874      24.26602       21.59353      21.12594       9.825062  271.4300 115.8760 284.1471 83.50712 -12.71713      142.8310 
1 1 1 -17 9  12 o 563.3576 40.11421 66.58421       8.718950      49.82458       14.36168      76.36682       10.97238  429.8812 88.95832 594.2162 47.95609 -164.3350      101.0612 
1 1 1 -17 9  13 o 243.8558 75.57146 15.81486       7.896460      22.66660       13.62085      12.34630       9.691210  262.4431 98.57993 214.5273 82.54598 47.91583       128.5762 
1 1 1 -17 9  14 o 309.1820 67.73576 24.28965       7.908314      25.13419       12.73504      23.75956       10.08946  270.8918 96.30450 282.6609 85.00507 -11.76913      128.4539 
1 1 1 -17 9  15 o 192.9592 84.86913 10.36487       12.30372      10.36487       12.30372      0.000000       0.000000  192.9592 84.86913 ?        ?        0.000000       84.86913 
1 1 1 -17 9  16 o 167.0783 77.34539 4.845247       11.87848      4.845247       11.87848      0.000000       0.000000  167.0783 77.34539 ?        ?        0.000000       77.34539 
1 1 1 -17 9  17 o 209.4444 81.79728 16.48146       9.626546      25.09384       12.02868      1.138656       16.05494  238.9704 91.96009 159.9261 78.15295 79.04436       120.6836 
1 1 1 -17 9  18 o 246.2736 89.25602 27.08589       10.99695      0.000000       0.000000      27.08589       10.99695  ?        ?        246.2736 89.25602 0.000000       89.25602 
1 1 1 -17 9  19 o 207.4423 79.37727 19.14941       8.930325      4.691548       16.62909      25.00900       10.58644  147.9299 73.60635 222.0518 86.03988 -74.12187      113.2288 
1 1 1 -17 9  20 o 139.1821 64.80604 6.648510       8.526575      -10.77364      15.58403      14.09232       10.18653  122.0002 61.98870 160.9600 73.44287 -38.95981      96.10648 
1 1 1 -17 9  21 o 117.5110 55.68973 2.846650       6.798316      2.589112       9.145926      3.164641       10.16282  120.4097 58.87254 122.6334 60.38124 -2.223663      84.33190 
1 1 1 -17 9  22 o 123.7752 60.39314 8.075850       9.481022      0.000000       0.000000      8.075850       9.481022  ?        ?        123.7752 60.39314 0.000000       60.39314 
1 1 1 -17 9  23 o 110.8077 52.75713 4.879628       6.242050      3.385574       8.724396      6.446523       8.934538  107.2774 53.36827 112.8000 55.74239 -5.522537      77.17116 
1 1 1 -17 10 1  o 207.1103 69.56263 8.998966       6.605813      14.16402       11.52001      6.468632       8.063137  254.0616 91.45920 194.4378 75.15926 59.62384       118.3795 
1 1 1 -17 10 2  o 613.0757 57.42615 78.99167       13.51332      78.99167       13.51332      0.000000       0.000000  613.0757 57.42615 ?        ?        0.000000       57.42615 
1 1 1 -17 10 3  o 191.0486 71.36434 6.835664       7.118855      10.83963       13.48294      5.288026       8.382513  239.2979 95.74239 187.9038 75.38120 51.39412       121.8562 
1 1 1 -17 10 4  o 392.3419 50.71781 32.24121       7.546854      52.57068       15.41409      25.83140       8.655215  473.1025 87.10427 341.1208 67.72330 131.9818       110.3340 
1 1 1 -17 10 5  o 403.6791 50.07833 34.16589       7.682202      40.25794       14.96414      31.98572       8.951895  401.3029 97.07516 382.9896 62.33028 18.31329       115.3631 
1 1 1 -17 10 6  o 216.9444 73.65795 10.43476       7.407300      2.344967       14.90909      13.08612       8.535257  207.4242 92.21828 238.1538 79.05494 -30.72960      121.4656 
1 1 1 -17 10 7  o 289.1940 93.55920 21.39402       11.98625      0.000000       0.000000      21.39402       11.98625  ?        ?        289.1940 93.55920 0.000000       93.55920 
1 1 1 -17 10 8  f 270.8329 68.16026 17.01435       7.163512      32.41951       11.17543      6.269724       9.333123  365.9530 80.79469 193.0056 78.77023 172.9474       112.8385 
1 1 1 -17 10 9  o 132.7971 60.82325 -2.731104      7.074067      -1.949289      11.63883      -3.189123      8.908382  170.4266 78.04308 147.1679 67.71761 23.25870       103.3267 
1 1 1 -17 10 10 o 324.7359 63.01239 24.25828       7.660001      17.18173       12.31156      28.72788       9.784455  251.8698 93.89569 342.7245 75.54727 -90.85468      120.5147 
1 1 1 -17 10 11 o 264.1819 72.81934 17.46855       7.711331      22.07547       12.81803      14.85547       9.653675  272.5533 96.64741 236.7339 83.88143 35.81944       127.9719 
1 1 1 -17 10 12 o 233.0539 75.66200 14.26076       7.834393      -25.05670      12.96504      36.87447       9.832575  126.1644 63.11900 390.2898 67.30203 -264.1254      92.26901 
1 1 1 -17 10 13 f 351.4258 71.13094 31.52329       9.374642      -2.196542      19.83771      41.21877       10.63735  186.9329 90.30354 404.0885 70.33953 -217.1555      114.4656 
1 1 1 -17 10 14 o 683.2820 40.59025 100.9457       10.72247      88.80088       13.24405      124.0507       18.26739  613.0432 56.25664 696.5348 68.41425 -83.49164      88.57380 
1 1 1 -17 10 15 o 251.8289 94.90157 24.81645       12.64332      24.81645       12.64332      0.000000       0.000000  251.8289 94.90157 ?        ?        0.000000       94.90157 
1 1 1 -17 10 16 o 185.4239 82.35090 11.63346       11.85915      11.63346       11.85915      0.000000       0.000000  185.4239 82.35090 ?        ?        0.000000       82.35090 
1 1 1 -17 10 17 o 364.5469 58.91380 35.11953       8.056149      30.77684       11.44007      39.39163       11.34673  271.7287 91.54207 332.2694 86.93237 -60.54068      126.2426 
1 1 1 -17 10 18 o 117.8607 56.46766 -2.107231      7.393189      6.385571       10.86330      -9.434694      10.09051  152.1441 71.58315 115.8885 57.61024 36.25555       91.88627 
1 1 1 -17 10 19 o 109.5460 54.22256 -6.509267      8.578184      -18.72896      16.68470      -2.118568      10.00127  121.7159 62.05939 123.5622 60.65126 -1.846268      86.77525 
1 1 1 -17 10 20 o 139.9361 64.75654 7.963868       8.315129      -4.053410      14.38838      13.98988       10.18882  122.9295 62.13889 155.1171 71.74660 -32.18763      94.91479 
1 1 1 -17 10 21 o 108.8529 52.39175 1.046809       6.532238      2.499645       9.035773      -0.5437658     9.454400  117.1167 57.52020 112.1205 55.74158 4.996185       80.09805 
1 1 1 -17 10 22 o 97.07718 47.72190 -1.181691      6.264576      -7.190369      8.497517      5.972118       9.271953  94.34438 47.69708 116.6150 57.46752 -22.27064      74.68284 
1 1 1 -17 10 23 o 112.4645 53.05375 5.815071       6.039555      8.585510       8.239724      2.598477       8.878434  116.0500 56.55268 104.2429 52.16369 11.80714       76.93671 
1 1 1 -17 11 1  o 401.4629 45.67918 33.19341       6.995029      30.16240       7.878700      44.47721       15.20159  377.5527 55.38013 430.7359 93.55427 -53.18320      108.7169 
1 1 1 -17 11 2  o 404.2216 41.03298 33.33409       6.352117      27.70182       9.133454      38.61050       8.840219  353.1360 69.07294 427.9326 54.42498 -74.79657      87.93832 
1 1 1 -17 11 3  o 307.7558 54.97850 20.28025       6.329815      27.46669       9.090777      13.51732       8.818837  350.6968 69.20592 243.4675 80.33540 107.2294       106.0341 
1 1 1 -17 11 4  o 258.8008 65.44739 15.03124       6.582073      22.83917       10.12891      9.324100       8.659721  309.4807 82.69734 212.5500 78.84475 96.93062       114.2600 
1 1 1 -17 11 5  o 118.7895 55.43937 -4.671887      6.297778      -12.07125      9.565052      0.9905421      8.367418  129.7441 62.68358 162.7920 70.82874 -33.04791      94.58298 
1 1 1 -17 11 6  o 355.3652 50.53903 26.85309       6.778247      29.72009       10.14576      24.54182       9.109529  356.3541 75.65094 324.1384 73.99523 32.21570       105.8223 
1 1 1 -17 11 7  o 398.0664 45.45142 33.23033       6.900398      37.23329       10.92649      30.57468       8.899696  400.1407 73.00370 368.5271 64.53546 31.61356       97.43903 
1 1 1 -17 11 8  o 205.5028 72.58472 9.560179       7.223044      30.01701       11.28277      -4.645909      9.402289  344.8330 84.83400 146.3116 68.10128 198.5215       108.7869 
1 1 1 -17 11 9  o 135.8280 63.66314 -5.081230      8.454021      -4.452519      11.36305      -5.860684      12.65216  159.2849 74.38216 163.5083 77.02784 -4.223465      107.0794 
1 1 1 -17 11 10 o 438.4503 46.31186 41.24096       7.766372      64.05652       12.59923      27.25906       9.863057  527.8043 62.69326 327.1549 78.60921 200.6494       100.5478 
1 1 1 -17 11 11 o 161.9641 68.98265 3.597507       7.620402      -1.147507      12.31346      6.542916       9.701397  168.9572 78.40323 185.8273 78.42866 -16.87010      110.8969 
1 1 1 -17 11 12 o 113.0952 54.94255 -9.107882      7.614094      10.53225       12.28804      -21.34833      9.700834  204.5899 87.37867 107.4895 53.89506 97.10035       102.6631 
1 1 1 -17 11 13 o 97.66155 49.48310 -26.62082      9.464198      -17.96037      11.71480      -42.89520      16.05894  124.8679 62.07409 121.6929 61.93953 3.175003       87.69093 
1 1 1 -17 11 14 o 181.8015 82.52795 7.425753       12.65481      12.79194       19.79722      3.718180       16.45570  200.3236 94.96389 179.1165 85.38444 21.20714       127.7053 
1 1 1 -17 11 15 o 291.2536 114.4955 48.21050       18.96380      48.21050       18.96380      0.000000       0.000000  291.2536 114.4955 ?        ?        0.000000       114.4955 
1 1 1 -17 11 16 o 109.6573 54.36982 -11.41910      8.760220      -5.322387      10.76460      -23.37432      15.07402  132.5901 64.61864 125.6200 63.51107 6.970078       90.60477 
1 1 1 -17 11 17 o 163.0502 73.82664 8.718292       10.04899      0.000000       0.000000      8.718292       10.04899  ?        ?        163.0502 73.82664 0.000000       73.82664 
1 1 1 -17 11 18 o 96.72913 48.05951 -9.078720      6.984589      -1.862633      10.04512      -15.83301      9.718382  127.0861 62.04281 102.7961 51.85346 24.29001       80.85847 
1 1 1 -17 11 19 o 139.1244 64.33031 6.452904       8.182310      7.442687       14.83175      6.019878       9.810230  141.4250 70.22664 138.0393 65.83714 3.385712       96.26167 
1 1 1 -17 11 20 o 96.27931 48.34821 -8.884027      7.956764      -0.9468929     14.26674      -12.46744      9.586082  122.1304 61.75155 98.64068 49.95927 23.48976       79.43037 
1 1 1 -17 11 21 o 118.7329 55.99632 4.864838       6.720176      10.46133       9.115538      -1.798133      9.946230  132.0899 63.12785 108.4029 54.38326 23.68707       83.32265 
1 1 1 -17 11 22 o 144.2512 62.47871 12.33756       6.452404      19.14738       8.626561      3.689546       9.721383  152.3629 68.74776 110.1398 55.03461 42.22314       88.06284 
1 1 1 -17 12 1  o 408.0106 43.92615 34.28558       6.850522      32.51318       7.731596      40.75964       14.77666  392.8666 51.94946 406.5003 95.26489 -13.63367      108.5087 
1 1 1 -17 12 2  o 236.2160 69.17745 12.60977       6.752957      8.783389       7.604226      26.88690       14.68862  205.5205 74.26188 320.6829 103.5520 -115.1624      127.4278 
1 1 1 -17 12 3  o 158.3735 65.13335 2.945365       6.442706      -5.506994      9.296065      10.75782       8.937248  145.6129 67.75587 222.0506 80.46623 -76.43770      105.1935 
1 1 1 -17 12 4  o 248.5996 66.21938 14.06208       6.507740      16.88123       9.746287      11.79395       8.742061  263.9087 84.25972 227.7560 79.90517 36.15268       116.1229 
1 1 1 -17 12 5  o 319.2545 54.76614 22.12597       6.545649      9.372026       10.09428      31.38013       8.598481  213.8542 83.69397 377.1399 60.77238 -163.2857      103.4310 
1 1 1 -17 12 6  o 214.2830 68.76116 10.54079       6.484375      6.986406       9.810751      13.29802       8.640839  198.2086 80.81200 235.5005 79.55699 -37.29193      113.4015 
1 1 1 -17 12 7  o 456.8780 41.07573 43.36423       7.210190      47.90730       11.01273      39.95583       9.538845  461.1503 63.15204 423.8649 59.59431 37.28534       86.83123 
1 1 1 -17 12 8  o 467.4394 40.75434 45.57457       7.324207      42.77903       11.87076      47.29293       9.306883  420.3485 75.49249 466.1943 52.30779 -45.84583      91.84345 
1 1 1 -17 12 9  o 123.0053 57.22470 -3.617350      6.625573      -6.085676      10.75292      -2.106690      8.412177  148.8266 70.38537 144.2802 66.17242 4.546356       96.60688 
1 1 1 -17 12 10 o 148.6043 72.25860 -12.25343      13.24946      0.000000       0.000000      -12.25343      13.24946  ?        ?        148.6043 72.25860 0.000000       72.25860 
1 1 1 -17 12 11 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -17 12 12 o 555.6479 48.23350 68.97516       10.30496      84.28921       12.80799      40.86521       17.35266  602.3476 55.37275 316.0779 112.4112 286.2697       125.3093 
1 1 1 -17 12 13 o 251.9948 84.31792 20.16636       9.705049      12.97336       12.07770      33.27502       16.30454  203.5272 86.76864 274.6290 106.6753 -71.10179      137.5079 
1 1 1 -17 12 14 o 197.2608 79.53475 12.34645       9.383032      14.74073       11.60975      7.836992       15.93302  204.3829 86.00317 182.1951 86.01643 22.18785       121.6362 
1 1 1 -17 12 15 o 143.5939 66.47273 1.584952       8.773121      16.48663       11.09880      -23.23229      14.32304  205.0830 85.02393 124.0867 62.63703 80.99629       105.6052 
1 1 1 -17 12 16 o 166.5696 76.01472 8.867163       10.91803      -10.88926      17.27577      22.00551       14.08813  142.0871 71.33596 203.1945 90.02319 -61.10741      114.8608 
1 1 1 -17 12 17 o 173.7388 68.40849 10.52881       6.779854      10.10770       9.622079      10.94403       9.554600  163.4935 73.28490 166.9107 74.03321 -3.417175      104.1710 
1 1 1 -17 12 18 o 128.2836 59.05054 3.215669       6.782682      6.496925       9.129403      -0.8268729     10.13327  142.8617 66.69914 126.0927 61.71828 16.76897       90.87311 
1 1 1 -17 12 19 o 126.2981 60.10600 3.772957       8.083476      4.897220       13.09729      3.081198       10.27365  132.2689 65.73337 127.2392 62.25081 5.029694       90.53197 
1 1 1 -17 12 20 o 87.03725 44.11388 -12.77011      7.561263      -18.86881      12.29596      -9.061460      9.588516  99.54755 50.95938 100.5959 50.83505 -1.048309      71.97959 
1 1 1 -17 12 21 o 119.0300 56.20795 5.795583       6.810346      -4.428254      9.166431      18.39272       10.17488  100.8028 50.78580 144.3907 68.34197 -43.58791      85.14590 
1 1 1 -17 12 22 o 96.78745 47.65025 -0.1523083     6.323355      -1.739239      8.742166      1.588965       9.157429  99.24923 49.95134 104.6494 52.45602 -5.400192      72.43460 
1 1 1 -17 13 1  o 652.5822 34.03373 85.72226       8.595388      79.07156       10.03776      104.0046       16.64256  621.1029 41.85866 691.0491 62.69551 -69.94623      75.38485 
1 1 1 -17 13 2  o 153.0836 65.30051 1.608871       6.847636      -0.3312062     7.811444      8.047651       14.23061  151.6049 67.10685 222.8307 94.56804 -71.22581      115.9588 
1 1 1 -17 13 3  o 316.4039 56.51687 21.87754       6.689790      11.18204       9.673150      31.68279       9.261831  223.6486 83.25754 375.1670 65.97747 -151.5184      106.2301 
1 1 1 -17 13 4  o 380.0768 46.38899 30.43041       6.705135      25.05605       9.582679      35.58574       9.385385  322.7966 77.43530 399.5262 62.54088 -76.72952      99.53687 
1 1 1 -17 13 5  o 160.2894 65.56111 3.608964       6.483155      -1.400926      9.547230      7.896008       8.831656  158.7133 71.90266 198.5955 78.11452 -39.88228      106.1691 
1 1 1 -17 13 6  o 256.3820 67.94029 15.57344       6.873255      36.07105       10.53281      0.3715042      9.070728  390.3536 72.13696 161.0611 71.74760 229.2925       101.7421 
1 1 1 -17 13 7  o 162.7528 66.86169 4.027677       6.779996      -0.1794930E-01 10.35929      7.059150       8.967352  166.4055 75.18684 190.8208 77.46667 -24.41531      107.9544 
1 1 1 -17 13 8  o 328.6843 80.16534 27.88863       10.14123      0.000000       0.000000      27.88863       10.14123  ?        ?        328.6843 80.16534 0.000000       80.16534 
1 1 1 -17 13 9  o 194.8584 77.79128 8.670598       8.880003      14.98155       11.11950      -2.440362      14.75413  231.5746 88.58271 176.6892 83.22005 54.88533       121.5421 
1 1 1 -17 13 10 o 472.8021 51.16924 50.03887       9.245528      60.87565       11.30154      28.11140       16.07614  512.8867 57.74431 276.1699 106.3015 236.7168       120.9727 
1 1 1 -17 13 11 o 282.2755 106.7005 31.47873       16.01320      0.000000       0.000000      31.47873       16.01320  ?        ?        282.2755 106.7005 0.000000       106.7005 
1 1 1 -17 13 12 o 152.3994 71.92668 -1.763693      11.12471      -1.763693      11.12471      0.000000       0.000000  152.3994 71.92668 ?        ?        0.000000       71.92668 
1 1 1 -17 13 13 o 140.9228 66.05159 -1.151279      9.100546      3.155167       10.98209      -10.59015      16.25868  162.0742 74.79657 151.8325 75.06204 10.24174       105.9662 
1 1 1 -17 13 14 o 94.67796 47.44749 -15.17867      7.473383      -15.08949      11.02107      -15.25458      10.16828  119.0193 59.33413 113.7944 56.77124 5.224861       82.11889 
1 1 1 -17 13 15 o 132.9277 62.23363 0.2032746      8.039793      5.569818       10.63887      -6.942019      12.27603  157.9474 73.14661 134.3428 66.18843 23.60468       98.64752 
1 1 1 -17 13 16 f 168.5329 68.78276 9.551202       7.116482      9.306228       9.815687      9.822659       10.33265  163.0492 73.47313 164.5008 74.63522 -1.451630      104.7316 
1 1 1 -17 13 17 o 198.2204 69.85069 14.46422       6.685423      17.29645       9.126253      11.18425       9.821181  192.2013 78.10451 161.2982 73.01357 30.90309       106.9172 
1 1 1 -17 13 18 o 122.2025 58.01155 2.003171       7.438580      -0.9596140     10.98687      4.510685       10.10754  123.8259 61.30398 133.1688 64.36187 -9.342834      88.88548 
1 1 1 -17 13 19 o 118.2059 56.44321 2.634237       7.254259      12.52822       11.17230      -4.577570      9.538476  142.0811 68.41824 108.8306 54.40054 33.25043       87.40981 
1 1 1 -17 13 20 o 106.5432 51.41904 1.068316       6.393338      3.216015       8.496458      -1.735024      9.707091  115.4719 56.51858 108.3859 54.28160 7.086029       78.36353 
1 1 1 -17 13 21 o 124.5731 57.23732 7.701495       6.332825      -3.689766      8.300250      23.56989       9.796518  97.85613 49.17274 158.5939 72.23129 -60.73774      87.38029 
1 1 1 -17 14 1  o 151.0331 65.57181 0.9208008      7.140917      4.704751       8.250171      -10.38114      14.25827  179.0583 73.68061 166.6463 79.45079 12.41202       108.3571 
1 1 1 -17 14 2  o 274.9138 76.13680 18.25530       8.407236      8.905089       10.38117      36.07517       14.33138  210.3638 84.06574 366.2954 98.57546 -155.9316      129.5537 
1 1 1 -17 14 3  o 308.2935 62.94890 21.60763       7.281785      20.51691       8.471063      24.69469       14.25130  291.7975 74.49628 295.4107 102.1131 -3.613190      126.3993 
1 1 1 -17 14 4  o 191.2386 68.79322 8.006586       6.516496      12.78922       9.297898      3.389385       9.135675  229.0520 82.19680 174.9134 75.03899 54.13858       111.2976 
1 1 1 -17 14 5  o 172.2426 71.43058 4.516755       7.837031      18.87480       9.715008      -22.23674      13.26129  269.1609 83.89046 135.4582 67.11431 133.7028       107.4334 
1 1 1 -17 14 6  o 337.7824 68.45563 27.18589       8.672410      23.61431       10.12409      37.03036       16.80824  299.1889 83.79630 337.8650 110.8802 -38.67609      138.9828 
1 1 1 -17 14 7  o 239.7136 78.17712 14.95331       8.360378      29.21673       10.48102      -9.998094      13.86243  334.1601 81.49511 157.7648 76.03138 176.3953       111.4550 
1 1 1 -17 14 8  o 152.7978 68.29778 0.8421589      8.294540      3.474408       10.01280      -4.914844      14.80780  173.0609 76.32131 170.6784 81.26105 2.382477       111.4823 
1 1 1 -17 14 9  o 171.1371 73.95262 4.645521       8.998097      5.051945       11.12982      3.878599       15.28882  180.7736 80.05611 189.6893 87.79015 -8.915741      118.8112 
1 1 1 -17 14 10 o 230.1639 78.96397 15.15074       8.514409      19.02211       10.53441      7.856937       14.45956  246.7744 87.60445 194.2800 88.20184 52.49432       124.3145 
1 1 1 -17 14 11 o 174.7715 73.42300 6.981725       8.439379      18.27328       10.39540      -14.84756      14.45387  236.7840 86.63285 142.6664 70.57499 94.11761       111.7411 
1 1 1 -17 14 12 f 204.6549 73.87612 12.35384       7.522730      11.91113       11.00264      12.74248       10.30873  195.0846 82.98449 199.7328 82.29507 -4.648209      116.8713 
1 1 1 -17 14 13 o 135.3978 61.84794 0.8986228      7.249287      -13.53198      10.22376      15.49002       10.28056  117.2726 58.24574 207.1872 83.35206 -89.91463      101.6864 
1 1 1 -17 14 14 o 342.5840 63.93857 32.06582       8.193762      30.37329       10.28677      35.00358       13.55250  292.6172 85.29035 272.2597 99.02265 20.35754       130.6902 
1 1 1 -17 14 15 o 128.8932 60.72627 0.1571158      7.866820      -10.82421      9.885378      19.12243       12.99110  114.2301 56.82403 192.3934 85.77265 -78.16329      102.8879 
1 1 1 -17 14 16 o 166.9657 67.45911 9.921722       6.765211      18.99960       9.445518      0.3594710      9.694236  202.2542 80.39148 131.2613 63.34023 70.99284       102.3464 
1 1 1 -17 14 17 o 122.8757 56.89262 2.519747       6.431062      -0.1392304     8.473842      6.131593       9.876149  121.0465 58.60627 139.4960 66.40082 -18.44951      88.56503 
1 1 1 -17 14 18 o 99.62917 48.45565 -2.620218      5.967200      -5.396376      7.634940      1.737406       9.565516  101.9394 50.57966 122.2694 59.87182 -20.33002      78.37688 
1 1 1 -17 14 19 o 116.4867 55.38406 3.298966       6.831410      4.276686       9.765913      2.362132       9.559539  121.3008 59.62054 117.5051 57.99073 3.795723       83.17171 
1 1 1 -17 14 20 o 110.8197 53.36129 3.027752       6.793537      -4.253329      9.267000      11.48681       9.988547  101.6581 51.19722 129.1209 62.77434 -27.46282      81.00477 
1 1 1 -17 15 1  o 317.7562 100.9610 28.68625       14.00588      0.000000       0.000000      28.68625       14.00588  ?        ?        317.7562 100.9610 0.000000       100.9610 
1 1 1 -17 15 2  o 245.4188 75.05536 14.77106       7.818378      14.72009       9.331786      14.89110       14.32087  241.6641 82.67155 242.2241 98.04947 -0.5600739     128.2509 
1 1 1 -17 15 3  o 595.0660 35.85846 72.59249       8.248053      67.43016       9.719099      85.88000       15.59282  565.3679 44.62852 609.7817 66.94646 -44.41376      80.45827 
1 1 1 -17 15 4  o 239.5428 75.63536 14.40142       7.870019      17.19901       9.225980      6.926729       15.08056  256.5390 81.98748 209.1997 92.88960 47.33928       123.8968 
1 1 1 -17 15 5  o 164.3062 69.98319 3.460746       7.843673      7.601392       9.511013      -5.342974      13.86838  193.1712 79.25510 168.4606 79.74989 24.71062       112.4341 
1 1 1 -17 15 6  o 259.3851 77.55457 17.68000       8.416288      25.09766       10.26704      2.484764       14.69485  303.5080 84.16686 189.6904 87.16871 113.8176       121.1711 
1 1 1 -17 15 7  o 171.0316 72.07549 5.020632       8.173463      4.045737       10.01013      6.970747       14.15764  174.4258 76.63821 198.2747 88.88359 -23.84882      117.3614 
1 1 1 -17 15 8  o 199.9569 76.24975 10.30824       8.222760      16.09028       10.18553      -0.5119187     13.93349  233.6514 85.71333 173.3556 81.40513 60.29584       118.2098 
1 1 1 -17 15 9  o 154.1682 68.08393 2.569218       7.995269      12.53031       9.804311      -17.20570      13.81405  209.1358 82.28986 138.3185 68.52563 70.81726       107.0859 
1 1 1 -17 15 10 o 97.21743 48.20595 -12.28318      6.891886      -11.07326      10.29730      -13.26495      9.275747  126.3272 61.91424 115.1223 56.87250 11.20490       84.07053 
1 1 1 -17 15 11 o 161.0821 67.18015 5.755124       6.988153      -8.771522      10.19400      18.63375       9.598352  128.2677 62.59346 237.1039 83.68056 -108.8362      104.5006 
1 1 1 -17 15 12 o 188.9110 71.18658 10.61871       7.113734      13.25717       10.07052      7.990893       10.05019  196.7077 81.22440 173.0361 76.37914 23.67166       111.4952 
1 1 1 -17 15 13 o 157.7603 66.77599 6.435404       7.065511      1.428372       9.991806      11.44311       9.992477  145.6411 68.56244 181.5448 78.19172 -35.90373      103.9940 
1 1 1 -17 15 14 o 126.7808 58.82075 0.6768746      6.925971      4.040376       9.668171      -2.868802      9.926544  147.6320 68.82987 130.2050 63.13435 17.42696       93.39967 
1 1 1 -17 15 15 o 176.6933 71.71027 11.98005       7.681744      3.541041       9.457140      28.34569       13.16985  140.0871 66.17730 214.1473 90.93425 -74.06023      112.4654 
1 1 1 -17 15 16 o 104.8167 51.52007 -5.247200      7.294237      -8.657333      8.842754      2.013731       12.90322  106.4365 53.07507 135.6463 67.02409 -29.20980      85.49380 
1 1 1 -17 15 17 o 96.20458 47.29597 -4.733029      6.156344      4.314349       8.162777      -16.66817      9.375411  128.6321 60.97833 95.03836 48.26831 33.59372       77.77009 
1 1 1 -17 15 18 o 135.8735 59.93896 7.421455       6.180109      17.94337       7.940759      -8.742676      9.842171  179.8442 72.93707 103.0503 52.00687 76.79391       89.57975 
1 1 1 -17 15 19 f 94.45249 46.82121 -3.873999      6.484116      0.7988833      8.682894      -9.765217      9.749326  110.6237 54.71975 98.02409 49.72629 12.59960       73.93886 
1 1 1 -17 16 1  o 282.5084 76.51553 20.04410       8.602118      7.404451       10.34805      48.31276       15.47547  197.1645 81.94886 417.6915 97.22398 -220.5270      127.1539 
1 1 1 -17 16 2  o 318.0755 57.36244 22.89370       6.825066      26.50919       7.814449      11.26610       14.01392  339.2541 61.58038 221.3871 93.89410 117.8670       112.2864 
1 1 1 -17 16 3  o 247.3149 69.99856 15.10989       7.026101      18.22137       8.129449      5.924205       13.96797  267.7276 75.12608 200.1268 89.10039 67.60083       116.5453 
1 1 1 -17 16 4  o 167.2410 68.76178 4.831575       7.178126      18.01798       8.282339      -34.96748      14.38885  263.2844 76.47074 124.2057 62.70703 139.0787       98.89361 
1 1 1 -17 16 5  o 138.6460 61.83850 0.1839455      6.760582      -2.089925      9.720921      2.314024       9.408544  151.0320 69.93549 165.1376 73.34542 -14.10556      101.3436 
1 1 1 -17 16 6  o 140.9684 61.81228 1.305737       6.482697      19.02064       9.159676      -16.47307      9.176183  260.3964 81.50643 111.3537 55.28467 149.0427       98.48702 
1 1 1 -17 16 7  o 225.1462 69.35371 13.23820       6.661919      21.50694       9.888183      6.365338       9.014997  269.8775 84.72021 177.5862 75.31217 92.29137       113.3554 
1 1 1 -17 16 8  o 214.2399 69.72319 12.27973       6.651288      20.06660       9.288180      4.083625       9.529130  259.5678 82.19033 166.6885 73.93456 92.87932       110.5512 
1 1 1 -17 16 9  o 151.9175 64.76609 3.948317       6.729040      0.5764464      9.478917      7.373909       9.554128  150.8737 69.57917 177.7436 76.50629 -26.86986      103.4141 
1 1 1 -17 16 10 o 205.5097 71.10574 12.18487       6.911168      12.64972       9.933890      11.74881       9.621338  199.0945 81.26179 194.8981 79.80949 4.196320       113.8992 
1 1 1 -17 16 11 o 162.0425 65.88358 6.656686       6.498064      3.417398       9.478970      9.528611       8.925301  154.2086 70.54807 179.1000 75.38812 -24.89137      103.2492 
1 1 1 -17 16 12 o 435.0179 43.33847 43.68959       7.224181      43.70484       10.28191      43.67472       10.15239  389.5322 70.56590 391.7017 69.27414 -2.169525      98.88605 
1 1 1 -17 16 13 o 135.4922 60.64859 3.099931       6.565475      6.794847       9.480753      -0.3048105     9.100863  156.7623 71.26575 133.3936 63.56351 23.36876       95.49413 
1 1 1 -17 16 14 o 127.3771 59.80872 1.090182       7.518169      3.858732       9.138891      -4.706367      13.22367  140.8630 66.07685 132.8737 66.03663 7.989243       93.41834 
1 1 1 -17 16 15 o 105.3725 51.74394 -5.248201      7.302932      -14.91677      8.539160      21.08150       14.09149  95.87564 48.39265 173.5760 81.62292 -77.70035      94.89020 
1 1 1 -17 16 16 o 135.5033 60.11382 5.950880       6.302419      11.12458       8.527564      -0.2766640     9.355841  153.9002 68.98743 120.7478 59.14484 33.15239       90.87012 
1 1 1 -17 16 17 o 168.4682 67.33619 13.08042       6.661866      11.17052       7.825085      18.11038       12.69889  149.4678 66.60709 150.9316 72.74648 -1.463837      98.63343 
1 1 1 -17 16 18 o 173.8031 70.61588 16.85223       7.458485      19.88084       9.061901      10.49193       13.13217  169.5929 73.74844 129.4611 64.57596 40.13179       98.02493 
1 1 1 -17 17 1  o 116.0402 55.97119 -8.404420      7.550640      -1.523052      9.183746      -22.75991      13.26452  150.8519 69.16953 132.2517 65.79455 18.60017       95.46385 
1 1 1 -17 17 2  o 181.4498 67.30786 7.448061       6.310863      7.539587       7.147789      7.124441       13.44053  183.9792 70.86324 199.4780 88.17504 -15.49886      113.1213 
1 1 1 -17 17 3  o 364.9363 50.58398 29.64712       6.976210      29.70113       8.098924      29.49182       13.73351  355.7227 60.81041 302.0788 100.2796 53.64398       117.2770 
1 1 1 -17 17 4  o 143.1776 62.58758 1.556008       6.601059      -0.4985546E-01 7.771288      5.716429       12.50856  144.1379 65.12393 188.1017 83.98956 -43.96376      106.2797 
1 1 1 -17 17 5  o 237.4792 69.44567 14.65567       6.809852      18.82726       7.724802      0.1085851      14.42528  267.0547 72.58356 175.8415 82.65475 91.21321       110.0008 
1 1 1 -17 17 6  o 266.5627 64.12804 17.85126       6.557765      25.15433       9.234541      10.42176       9.314131  300.7933 78.29325 197.5028 79.37930 103.2905       111.4940 
1 1 1 -17 17 7  o 187.1638 69.07156 9.141950       6.629014      5.169461       9.151999      13.52636       9.614797  168.4542 73.66447 211.6263 81.99750 -43.17204      110.2272 
1 1 1 -17 17 8  o 207.5181 78.94585 13.15371       8.801467      0.000000       0.000000      13.15371       8.801467  ?        ?        207.5181 78.94585 0.000000       78.94585 
1 1 1 -17 17 9  o 186.8652 68.38009 9.790001       6.476808      11.68151       9.023469      7.779888       9.302061  193.8141 78.04836 174.0145 75.19370 19.79959       108.3773 
1 1 1 -17 17 10 o 291.9675 61.47401 22.44080       6.749990      19.89400       9.456812      25.08591       9.637609  237.0117 83.11005 272.0765 83.35187 -35.06482      117.7065 
1 1 1 -17 17 11 o 116.4365 54.63242 -1.603973      6.254002      -2.500468      9.305117      -0.8653548     8.446136  131.5562 63.11388 131.9739 62.40448 -0.4176636     88.75630 
1 1 1 -17 17 12 o 164.4917 65.58677 8.295442       6.305056      13.30132       8.991179      3.452067       8.844032  185.3936 76.66621 143.5155 66.54369 41.87810       101.5173 
1 1 1 -17 17 13 o 182.8006 68.27644 11.68708       6.515800      16.07535       8.971858      6.789243       9.478462  192.8931 77.77298 150.6915 69.52396 42.20154       104.3179 
1 1 1 -17 17 14 o 158.8347 67.69616 9.596707       7.347945      15.44864       8.783529      -4.046871      13.41169  182.2360 75.60181 129.3683 64.64256 52.86772       99.47007 
1 1 1 -17 17 15 o 107.6680 52.26837 -2.317558      6.857935      -0.3579917     8.183257      -6.940762      12.56949  118.0869 57.27330 119.2234 59.99047 -1.136490      82.94026 
1 1 1 -17 17 16 o 130.6300 58.75497 5.679698       6.242974      0.3917965E-01  7.925366      14.90235       10.13416  114.5234 55.73284 155.1189 71.67933 -40.59547      90.79689 
1 1 1 -17 17 17 o 209.9570 66.96793 17.90640       6.157651      14.97639       7.713894      23.05272       10.22322  163.8351 69.58300 174.6864 77.07446 -10.85130      103.8377 
1 1 1 -17 18 1  o 225.3980 75.24593 13.52875       7.728835      7.064713       9.474240      26.38841       13.36310  184.8085 77.72514 282.4358 98.80861 -97.62724      125.7153 
1 1 1 -17 18 2  o 392.1176 42.96607 33.28899       6.435765      27.19593       7.178418      58.24978       14.52915  342.4936 55.89799 461.0720 84.24603 -118.5785      101.1038 
1 1 1 -17 18 3  o 168.8932 66.95824 6.198638       6.537004      0.5387729      7.337372      27.97875       14.39354  142.0523 63.81219 277.8407 101.8969 -135.7884      120.2288 
1 1 1 -17 18 4  o 386.8938 46.63944 33.36072       6.866387      35.92128       7.792101      24.46408       14.52445  395.7381 51.95687 255.1987 100.2401 140.5394       112.9052 
1 1 1 -17 18 5  o 131.4904 59.26255 0.1560650      6.389216      1.933072       7.232199      -6.161409      13.63633  145.3914 64.45308 154.2661 74.60643 -8.874741      98.59167 
1 1 1 -17 18 6  o 141.1741 62.81349 1.726749       6.930172      2.800776       8.098832      -1.210120      13.39236  152.1770 67.79213 161.3339 76.94083 -9.156876      102.5459 
1 1 1 -17 18 7  o 184.8685 67.41859 9.332313       6.288239      8.318390       8.581984      10.50775       9.240287  177.3038 74.23940 188.7834 77.86398 -11.47961      107.5839 
1 1 1 -17 18 8  o 421.9713 40.41832 39.59427       6.542490      38.04805       8.839228      41.46771       9.729694  384.7979 61.19922 394.7177 65.78800 -9.919800      89.85213 
1 1 1 -17 18 9  o 146.6043 62.39639 4.560489       6.226678      5.647758       8.500015      3.301331       9.147272  157.8190 69.92265 150.3758 68.98099 7.443176       98.22195 
1 1 1 -17 18 10 o 128.9392 58.20964 1.675093       6.194133      3.870495       8.541122      -0.7605085     8.996242  147.1740 67.19048 133.8224 63.60601 13.35153       92.52180 
1 1 1 -17 18 11 o 133.3052 59.56606 3.039945       6.303886      0.5146026      8.686489      5.849728       9.162638  133.0835 63.03506 151.5821 69.35178 -18.49861      93.71813 
1 1 1 -17 18 12 o 91.21014 45.27579 -8.875543      6.143722      -21.93095      8.476757      5.571218       8.917021  88.75111 45.15598 145.7700 67.31642 -57.01889      81.05901 
1 1 1 -17 18 13 o 119.9852 55.71003 1.413071       6.230130      8.268141       8.297001      -7.448545      9.433474  150.7841 67.78519 112.1740 55.75368 38.61002       87.76848 
1 1 1 -17 18 14 o 128.0756 59.08030 3.821475       6.840626      4.919492       8.159986      1.225335       12.54726  133.7147 62.63231 130.8774 64.92143 2.837311       90.20864 
1 1 1 -17 18 15 o 99.72787 48.61741 -3.036877      6.106320      -4.498659      7.661345      -0.4909612     10.11081  104.3403 51.57247 119.8121 59.22467 -15.47181      78.53204 
1 1 1 -17 19 1  o 185.7166 73.22459 8.664446       7.778002      8.954342       9.552981      8.094332       13.39673  189.2260 78.70092 191.6311 86.14228 -2.405151      116.6805 
1 1 1 -17 19 2  o 105.3085 50.45813 -5.483963      5.906115      -2.983761      6.616505      -15.28759      13.10191  120.6862 56.48795 136.1570 67.32562 -15.47081      87.88417 
1 1 1 -17 19 3  o 142.6629 60.95913 2.945821       5.985806      5.027049       6.751965      -4.695216      12.93739  158.6166 66.08362 153.2561 73.75546 5.360428       99.02985 
1 1 1 -17 19 4  o 196.6986 67.49653 10.50954       6.221143      13.47937       7.030321      -0.2096545     13.35645  217.8261 71.72097 162.7813 77.40863 55.04486       105.5272 
1 1 1 -17 19 5  f 174.2865 66.46970 7.969811       6.249200      11.78687       7.157930      -4.265261      12.81524  201.1760 72.12783 149.8513 72.43607 51.32474       102.2223 
1 1 1 -17 19 6  o 148.0495 62.58696 4.359659       6.194359      -0.8330123E-01 6.989845      20.61435       13.36967  130.6426 60.06565 220.7964 92.56822 -90.15378      110.3484 
1 1 1 -17 19 7  o 117.6713 54.33810 -0.8660859     5.809201      -6.331697      7.749052      6.146842       8.777662  114.7445 55.67075 161.7009 71.37767 -46.95641      90.52074 
1 1 1 -17 19 8  o 229.3245 65.88381 15.26240       6.178013      7.664470       8.369861      24.35700       9.157187  164.8363 71.27695 265.9758 81.20692 -101.1395      108.0508 
1 1 1 -17 19 9  o 411.4801 41.67185 39.15070       6.567334      40.50286       8.859846      37.50175       9.783993  386.3705 61.07666 347.2970 74.75499 39.07349       96.53325 
1 1 1 -17 19 10 o 115.4325 53.75444 -0.3590550     5.869331      13.11995       8.201656      -14.50791      8.402980  185.5005 74.51182 99.02187 49.71985 86.47858       89.57720 
1 1 1 -17 19 11 o 129.3669 58.44176 2.950202       6.255731      3.327873       8.549504      2.514986       9.177746  137.2075 64.21783 136.2137 64.59730 0.9938354      91.08644 
1 1 1 -17 19 12 o 127.4346 57.78206 3.190913       6.180842      -0.5482525     8.335894      7.756991       9.211630  122.1468 58.88952 148.3477 68.47616 -26.20097      90.31589 
1 1 1 -17 19 13 o 114.9228 54.17370 0.6570551      6.276230      7.022267       8.293905      -7.871897      9.600647  141.6494 65.23834 109.7710 54.82655 31.87837       85.21732 
1 1 1 -17 20 1  o 196.2784 73.42667 10.91740       7.541723      5.670761       9.650881      19.14686       12.08682  169.4860 74.82752 229.7134 91.05520 -60.22743      117.8567 
1 1 1 -17 20 2  o 119.6170 54.64716 -0.7395443     5.662027      2.090715       6.437009      -10.41625      11.90241  138.9030 61.22904 134.7651 66.15334 4.137909       90.14022 
1 1 1 -17 20 3  o 187.6873 66.01752 9.656986       5.969189      11.86493       6.732140      1.538544       12.90909  202.9278 70.18064 162.2276 76.84047 40.70026       104.0662 
1 1 1 -17 20 4  o 112.1604 52.63297 -2.483162      5.807854      -8.509152      6.471013      22.47913       13.17044  99.81038 48.95086 229.2862 93.57439 -129.4758      105.6047 
1 1 1 -17 20 5  o 141.2734 60.74705 3.603948       6.011826      7.597144       6.684463      -13.29564      13.75132  167.3633 67.25327 134.2637 66.82733 33.09958       94.80978 
1 1 1 -17 20 6  o 163.7741 65.09290 7.372377       6.192282      8.381906       7.007823      3.776569       13.22581  169.9303 68.65765 160.1924 76.41425 9.737930       102.7278 
1 1 1 -17 20 7  o 150.5658 62.57663 5.730449       6.033323      7.985118       6.752588      -3.193874      13.43435  165.0043 67.13294 143.9426 70.58220 21.06171       97.40985 
1 1 1 -17 20 8  o 326.8006 49.75804 26.53959       6.115644      30.98211       8.049709      20.47482       9.405311  328.9360 65.31805 225.4290 82.41530 103.5071       105.1605 
1 1 1 -17 20 9  o 165.9835 64.50314 8.726756       5.963421      1.279456       7.878444      18.71803       9.125393  130.9806 61.41240 211.0155 80.35941 -80.03487      101.1391 
1 1 1 -17 20 10 o 97.72135 47.53762 -4.795927      5.751135      -6.853586      7.442451      -1.745973      9.060995  104.7953 51.61248 124.5704 60.38281 -19.77513      79.43508 
1 1 1 -17 20 11 o 155.6156 63.45792 8.236037       6.050928      9.982819       7.822402      5.633679       9.547823  159.9085 69.02658 142.0238 66.90887 17.88478       96.13255 
1 1 1 -17 21 1  o 113.8467 54.63464 -5.147597      6.984774      -5.512468      8.792806      -4.523577      11.49891  125.9312 60.65532 142.7288 68.90194 -16.79761      91.79621 
1 1 1 -17 21 2  o 175.1761 64.17233 8.300916       5.706449      6.344397       6.440501      15.44623       12.30803  160.7284 65.49744 202.2326 86.93815 -41.50417      108.8492 
1 1 1 -17 21 3  o 130.2542 57.29199 1.991002       5.607430      7.076324       6.300162      -17.39357      12.30044  163.9836 65.50432 122.3675 61.25746 41.61616       89.68440 
1 1 1 -17 21 4  o 217.9733 64.97066 13.56388       5.913427      14.25810       6.614219      10.79872       13.20045  217.3733 69.41396 179.0256 82.39712 38.34766       107.7385 
1 1 1 -17 21 5  o 103.3800 49.87284 -4.889894      6.000735      -6.276405      6.732964      0.4647493      13.23153  105.6084 51.38856 151.4518 73.30465 -45.84344      89.52293 
1 1 1 -17 21 6  o 158.4190 63.16428 7.048006       5.847798      8.563694       6.502764      0.6405009      13.37019  168.0573 66.73337 149.3831 72.62565 18.67419       98.62975 
1 1 1 -17 21 7  o 141.6066 61.13677 4.668519       6.138497      3.946784       6.904523      7.390471       13.40865  139.9325 62.44689 159.9109 76.46275 -19.97838      98.72268 
1 1 1 -17 21 8  o 107.7069 51.47266 -2.698622      6.058985      -1.225406      6.717113      -9.130794      14.03551  116.8878 55.38331 130.8090 65.47632 -13.92121      85.75814 
1 1 1 -16 0  1  o 119.2192 73.66546 2.211008       6.719622      2.211008       6.719622      2.211008       6.719622  119.2192 73.66546 119.2192 73.66546 -0.000000      0.000000 
1 1 1 -16 0  2  o 117.3076 73.37957 1.709113       6.877013      1.709113       6.877013      1.709113       6.877013  117.3076 73.37957 117.3076 73.37957 0.000000       0.000000 
1 1 1 -16 0  3  o 853.9029 28.36829 142.5298       9.383873      142.5298       9.383873      142.5298       9.383873  853.9029 28.36829 853.9029 28.36829 -0.000000      0.000000 
1 1 1 -16 0  4  o 357.2707 60.87273 27.16661       7.709720      27.16661       7.709720      27.16661       7.709720  357.2707 60.87273 357.2707 60.87273 -0.000000      0.000000 
1 1 1 -16 0  5  o 406.6232 53.60023 34.09936       8.055369      34.09936       8.055369      34.09936       8.055369  406.6232 53.60023 406.6232 53.60023 0.000000       0.000000 
1 1 1 -16 0  6  o 173.1366 89.04748 8.831543       7.639724      8.831543       7.639724      8.831543       7.639724  173.1366 89.04748 173.1366 89.04748 -0.000000      0.000000 
1 1 1 -16 0  7  o 104.3593 70.63652 -3.891613      8.463700      -3.891613      8.463700      -3.891613      8.463700  104.3593 70.63652 104.3593 70.63652 0.000000       0.000000 
1 1 1 -16 0  8  o 273.4889 92.80539 19.25536       8.829978      19.25536       8.829978      19.25536       8.829978  273.4889 92.80539 273.4889 92.80539 0.000000       0.000000 
1 1 1 -16 0  9  o 244.6607 98.74388 16.67858       9.157468      16.67858       9.157468      16.67858       9.157468  244.6607 98.74388 244.6607 98.74388 0.000000       0.000000 
1 1 1 -16 0  10 o 1358.470 29.45832 360.4341       15.52475      360.4341       15.52475      360.4341       15.52475  1358.470 29.45832 1358.470 29.45832 0.000000       0.000000 
1 1 1 -16 0  11 o 1262.948 30.42490 311.7901       14.90298      311.7901       14.90298      311.7901       14.90298  1262.948 30.42490 1262.948 30.42490 0.000000       0.000000 
1 1 1 -16 0  12 o 128.9224 83.74382 -0.6648314E-01 10.03581      -0.6648314E-01 10.03581      -0.6648314E-01 10.03581  128.9224 83.74382 128.9224 83.74382 0.000000       0.000000 
1 1 1 -16 0  13 o 657.5219 49.09142 86.50098       12.37492      86.50098       12.37492      86.50098       12.37492  657.5219 49.09142 657.5219 49.09142 -0.000000      0.000000 
1 1 1 -16 0  14 o 382.8851 101.7454 35.18803       13.07179      35.18803       13.07179      35.18803       13.07179  382.8851 101.7454 382.8851 101.7454 -0.000000      0.000000 
1 1 1 -16 0  15 o 653.4556 58.50556 86.64298       14.57337      86.64298       14.57337      86.64298       14.57337  653.4556 58.50556 653.4556 58.50556 0.000000       0.000000 
1 1 1 -16 0  16 o 477.6919 128.1550 56.56490       20.54508      56.56490       20.54508      56.56490       20.54508  477.6919 128.1550 477.6919 128.1550 -0.000000      0.000000 
1 1 1 -16 0  17 o 397.3061 147.8873 45.52695       21.22764      45.52695       21.22764      45.52695       21.22764  397.3061 147.8873 397.3061 147.8873 0.000000       0.000000 
1 1 1 -16 0  18 o 225.6150 116.6120 16.29807       13.14055      16.29807       13.14055      16.29807       13.14055  225.6150 116.6120 225.6150 116.6120 0.000000       0.000000 
1 1 1 -16 0  19 o 355.7496 110.7025 33.02395       13.40295      33.02395       13.40295      33.02395       13.40295  355.7496 110.7025 355.7496 110.7025 0.000000       0.000000 
1 1 1 -16 0  20 o 95.54948 68.80744 -20.26889      12.66669      -20.26889      12.66669      -20.26889      12.66669  95.54948 68.80744 95.54948 68.80744 -0.000000      0.000000 
1 1 1 -16 0  21 o 130.6358 90.33759 -8.622278      15.59058      -8.622278      15.59058      -8.622278      15.59058  130.6358 90.33759 130.6358 90.33759 0.000000       0.000000 
1 1 1 -16 0  22 o 123.8755 86.85654 -12.02548      15.82983      -12.02548      15.82983      -12.02548      15.82983  123.8755 86.85654 123.8755 86.85654 -0.000000      0.000000 
1 1 1 -16 0  23 o 152.7576 94.66833 5.928486       11.18139      5.928486       11.18139      5.928486       11.18139  152.7576 94.66833 152.7576 94.66833 -0.000000      0.000000 
1 1 1 -16 0  24 o 103.0112 71.68159 -6.626322      10.22219      -6.626322      10.22219      -6.626322      10.22219  103.0112 71.68159 103.0112 71.68159 -0.000000      0.000000 
1 1 1 -16 0  25 o 133.2642 85.34309 3.593691       9.950229      3.593691       9.950229      3.593691       9.950229  133.2642 85.34309 133.2642 85.34309 0.000000       0.000000 
1 1 1 -16 0  26 o 162.2374 94.04232 9.762727       9.672401      9.762727       9.672401      9.762727       9.672401  162.2374 94.04232 162.2374 94.04232 0.000000       0.000000 
1 1 1 -16 0  27 o 151.4446 91.92039 8.411147       10.04694      8.411147       10.04694      8.411147       10.04694  151.4446 91.92039 151.4446 91.92039 -0.000000      0.000000 
1 1 1 -16 1  1  o 494.3010 27.72921 48.06569       5.301513      55.65477       7.741780      41.36430       7.274921  529.1444 37.92525 454.6495 41.66598 74.49487       56.34163 
1 1 1 -16 1  2  o 592.2226 24.10695 68.63968       5.544408      66.45975       7.681458      71.01057       8.010865  579.4677 34.28650 598.9439 34.58735 -19.47626      48.70163 
1 1 1 -16 1  3  o 321.6226 41.29478 20.88088       5.038726      27.63156       6.939537      13.35328       7.327990  367.8148 49.86752 249.7267 71.75668 118.0880       87.38301 
1 1 1 -16 1  4  o 321.1664 42.96710 20.91180       5.224804      21.99385       7.499060      19.89103       7.283627  322.7281 62.08735 306.0859 63.36117 16.64215       88.71007 
1 1 1 -16 1  5  o 309.9320 46.67027 19.67601       5.443177      24.88302       7.547159      14.03144       7.857867  344.7292 58.46278 254.4382 74.65353 90.29103       94.82113 
1 1 1 -16 1  6  o 162.9383 62.55896 4.064369       5.558602      -0.9847116     8.122169      8.512610       7.623598  156.4390 68.87743 209.2441 74.49881 -52.80507      101.4602 
1 1 1 -16 1  7  o 465.1472 35.39823 43.20535       6.346407      41.01115       9.169141      45.22322       8.793019  445.0456 54.16857 470.2372 48.86317 -25.19165      72.95096 
1 1 1 -16 1  8  o 566.6384 30.49739 63.66811       6.686442      85.32552       9.958982      45.89281       9.022360  651.7843 39.53123 472.3854 49.93789 179.3989       63.69075 
1 1 1 -16 1  9  o 923.6564 22.48956 167.4673       8.067135      152.1488       11.31062      183.3285       11.50928  874.7948 33.29293 961.8685 30.81091 -87.07373      45.36222 
1 1 1 -16 1  10 o 163.0492 67.27416 2.828811       6.900845      5.439707       10.08434      0.5293820      9.463736  198.8031 81.59233 171.6219 74.98280 27.18117       110.8139 
1 1 1 -16 1  11 o 616.9597 32.34861 76.08891       7.723685      81.81871       11.00583      70.52852       10.84189  631.4057 45.18205 583.8234 48.25089 47.58234       66.10269 
1 1 1 -16 1  12 o 951.5037 24.86910 178.8512       9.189640      185.4850       13.44627      173.0370       12.58834  959.9971 36.06649 928.2477 34.92019 31.74933       50.20171 
1 1 1 -16 1  13 o 387.1980 56.24001 32.37040       8.209476      15.71253       11.64726      48.81652       11.57300  254.5370 91.91751 469.0886 65.29859 -214.5516      112.7508 
1 1 1 -16 1  14 o 359.2863 64.25282 29.00080       8.636124      32.02594       12.00073      25.75139       12.43763  358.0874 87.12569 313.2428 94.42004 44.84460       128.4758 
1 1 1 -16 1  15 o 313.9897 86.63665 25.25730       10.90891      40.18497       18.15549      16.82277       13.64716  361.6024 114.9543 254.4931 97.94652 107.1093       151.0232 
1 1 1 -16 1  16 o 710.6612 53.35115 109.7035       14.61683      103.1428       19.89565      117.3974       21.54542  647.2103 80.92498 688.3405 82.22535 -41.13013      115.3684 
1 1 1 -16 1  17 o 202.2151 89.86251 6.317297       14.14193      7.633060       19.87930      4.969166       20.12234  219.4063 101.0318 213.9240 99.59023 5.482391       141.8649 
1 1 1 -16 1  18 o 315.1391 79.62481 26.61769       9.748642      23.03795       13.95639      30.02845       13.62298  263.4200 99.60307 304.3046 99.82048 -40.88461      141.0138 
1 1 1 -16 1  19 o 458.2023 55.16730 49.03990       9.619448      41.55061       13.89032      55.94193       13.33460  356.9930 97.45706 454.0357 78.46236 -97.04272      125.1168 
1 1 1 -16 1  20 o 212.4928 90.65308 16.98083       13.19969      16.98083       13.19969      0.000000       0.000000  212.4928 90.65308 ?        ?        0.000000       90.65308 
1 1 1 -16 1  21 o 194.2970 84.19463 14.67218       11.72837      22.41887       17.16593      7.889909       16.06190  205.1480 94.25024 173.5096 83.15604 31.63841       125.6902 
1 1 1 -16 1  22 o 121.1831 60.42203 -11.24736      11.44734      -21.09944      16.25927      -1.563842      16.11959  127.3069 64.54176 148.1530 73.50695 -20.84612      97.82081 
1 1 1 -16 1  23 o 214.3851 77.30970 19.23665       8.235203      34.72762       11.64688      3.748558       11.64579  258.4600 92.07542 140.8774 68.32627 117.5826       114.6576 
1 1 1 -16 1  24 o 148.7695 65.91997 9.467793       7.556593      13.01580       10.66954      5.896951       10.70382  152.1326 71.37381 134.5645 65.31960 17.56802       96.75159 
1 1 1 -16 1  25 o 140.2219 62.67959 9.706352       6.986933      11.79299       10.06057      7.762310       9.710741  136.5759 65.54961 127.7628 62.06348 8.813080       90.26974 
1 1 1 -16 1  26 o 162.1486 66.96609 16.25862       6.846986      13.41955       9.647189      19.14035       9.719418  128.9147 62.44402 143.2708 67.49974 -14.35614      91.95363 
1 1 1 -16 1  27 o 96.18952 47.65031 0.8782438      6.674627      10.84272       9.394410      -9.279199      9.484938  114.2076 56.56802 88.73394 45.37137 25.47363       72.51553 
1 1 1 -16 2  1  o 769.2064 20.59243 115.5343       6.151464      113.2023       8.659216      117.9103       8.740320  759.2192 29.36861 774.9426 29.04222 -15.72333      41.30334 
1 1 1 -16 2  2  o 401.1735 33.50097 31.94137       5.171608      37.81254       7.284568      25.97514       7.343301  433.5658 43.86704 354.7927 55.08141 78.77313       70.41505 
1 1 1 -16 2  3  o 272.9131 49.76039 15.39361       5.079628      22.84390       7.324314      8.489278       7.050847  330.4608 59.24800 208.1231 71.83145 122.3377       93.11327 
1 1 1 -16 2  4  o 199.0780 61.05831 8.206581       5.169948      14.23200       7.505228      2.765735       7.131873  256.7096 72.23700 167.8391 68.71912 88.87051       99.70206 
1 1 1 -16 2  5  o 449.3124 33.84462 40.13491       5.862260      37.01690       8.727859      42.69782       7.912900  423.7528 54.28343 459.5603 44.91091 -35.80750      70.45339 
1 1 1 -16 2  6  o 233.5472 61.35884 11.67940       5.637461      19.24950       8.289618      5.165979       7.689327  296.2770 72.61124 186.1837 72.99638 110.0933       102.9605 
1 1 1 -16 2  7  o 202.7214 65.37298 8.547848       5.855600      15.67189       8.922215      3.157709       7.760851  265.4977 79.95793 173.8761 71.49512 91.62166       107.2605 
1 1 1 -16 2  8  o 234.6203 66.10764 11.98612       6.281339      5.161519       9.195813      17.95552       8.600362  194.3342 78.60284 282.8391 76.46697 -88.50494      109.6613 
1 1 1 -16 2  9  o 635.6799 29.42034 79.94348       7.262967      70.66302       10.31297      89.07577       10.23031  588.6287 45.46674 664.8599 39.80450 -76.23120      60.42866 
1 1 1 -16 2  10 o 530.4650 34.80138 56.42928       7.129628      56.25317       10.76563      56.56684       9.515359  518.1738 54.30476 524.2359 47.24567 -6.062134      71.98028 
1 1 1 -16 2  11 o 654.3494 31.02198 85.21405       7.883284      107.0433       11.79710      67.60162       10.59657  724.9746 42.08207 571.4274 48.20026 153.5472       63.98567 
1 1 1 -16 2  12 o 556.9438 37.22170 62.83036       8.004376      54.36047       11.74244      70.18208       10.93991  500.3257 61.74327 580.1864 49.01190 -79.86069      78.83145 
1 1 1 -16 2  13 o 332.5244 66.02705 24.90369       8.225832      9.081331       11.90023      39.38092       11.38315  219.2854 89.15814 413.8902 73.51187 -194.6048      115.5559 
1 1 1 -16 2  14 o 305.5878 72.40283 21.92635       8.460705      23.70906       12.24099      20.29568       11.70733  300.4832 94.25137 280.0155 92.56949 20.46765       132.1077 
1 1 1 -16 2  15 o 476.3617 57.44559 49.78023       10.41282      65.67612       18.38861      42.27724       12.63350  497.9262 98.58288 416.2227 81.07249 81.70349       127.6375 
1 1 1 -16 2  16 f 199.4907 88.81802 4.447002       13.87995      18.09793       18.92771      -11.43348      20.41497  254.5548 108.5752 189.2428 91.46481 65.31201       141.9661 
1 1 1 -16 2  17 o 548.4194 60.59295 68.72349       12.68959      54.14346       15.72122      95.98153       21.49583  442.0121 94.45090 585.6530 97.97259 -143.6408      136.0867 
1 1 1 -16 2  18 o 258.8145 84.15941 19.10776       9.691488      25.27987       14.08450      13.55751       13.35616  273.5740 100.7267 219.9147 92.37651 53.65930       136.6722 
1 1 1 -16 2  19 o 251.6048 80.55404 18.64912       8.903164      23.00086       13.23669      15.05382       12.03138  252.3348 96.61910 217.3703 89.15661 34.96448       131.4692 
1 1 1 -16 2  20 o 213.7380 80.05406 14.69468       8.969825      23.80227       13.08652      6.624413       12.31876  242.2638 95.15222 175.5931 80.36538 66.67065       124.5493 
1 1 1 -16 2  21 o 196.9208 85.12067 15.68738       11.92843      8.550672       17.73679      21.58075       16.11787  174.7673 84.65800 204.5591 92.96621 -29.79178      125.7366 
1 1 1 -16 2  22 o 130.5625 63.12931 -2.057693      9.750370      -10.52462      16.70002      2.321287       12.00993  138.1315 69.45714 146.7806 70.74569 -8.649033      99.14256 
1 1 1 -16 2  23 o 124.8147 59.50186 0.6120775      7.993450      0.8893730E-01  11.23393      1.148562       11.37630  132.4348 64.85672 134.7370 65.83163 -2.302216      92.41319 
1 1 1 -16 2  24 f 129.7017 60.73276 4.805322       7.661818      -7.964035      10.68681      18.31066       10.99047  110.8035 55.69474 166.0072 75.95275 -55.20371      94.18452 
1 1 1 -16 2  25 o 155.8846 66.44984 13.11878       7.082016      25.55374       9.920523      0.1960520      10.11322  183.1023 78.36417 113.4029 56.58252 69.69934       96.65674 
1 1 1 -16 2  26 o 108.5268 52.46051 3.544160       6.721839      5.360217       9.355475      1.606237       9.664276  112.7691 55.95925 106.9360 53.64178 5.833054       77.51696 
1 1 1 -16 2  27 o 120.4509 56.70303 9.972491       6.833694      7.942249       9.354501      12.29588       10.00708  109.0305 54.40372 114.8992 57.15944 -5.868675      78.91113 
1 1 1 -16 3  1  o 275.2123 45.74595 15.48899       4.717677      21.41641       6.409375      8.480584       6.969353  322.2901 53.05492 208.1475 71.43932 114.1426       88.98540 
1 1 1 -16 3  2  o 615.2027 24.09793 74.08900       5.757395      72.89122       8.110845      75.30548       8.173893  606.6923 34.56776 616.7935 34.25900 -10.10114      48.66837 
1 1 1 -16 3  3  o 489.2508 29.37183 47.22937       5.554885      49.79066       7.757484      44.53399       7.957940  498.9338 40.38225 470.3659 44.07900 28.56793       59.78030 
1 1 1 -16 3  4  o 877.1042 20.85554 150.3863       7.103961      153.6450       10.12943      147.2321       9.965609  883.6030 29.51887 864.9078 29.66921 18.69519       41.85243 
1 1 1 -16 3  5  o 131.8695 56.80777 -0.1164106E-02 5.276457      -9.918771      7.877618      8.068663       7.105974  121.8776 58.36470 203.9700 71.99938 -82.09240      92.68414 
1 1 1 -16 3  6  o 112.8230 52.31662 -4.156591      5.468145      -1.853301      8.230612      -5.976503      7.316157  153.4498 68.35160 127.9022 59.71295 25.54761       90.76111 
1 1 1 -16 3  7  o 475.0283 34.00485 44.98393       6.231696      42.95840       9.313347      46.62594       8.385411  455.5303 53.67575 478.7920 45.65014 -23.26163      70.46291 
1 1 1 -16 3  8  o 444.5815 38.37577 39.79560       6.560836      36.58125       10.03328      42.19677       8.671766  413.1183 64.65797 452.3490 50.21066 -39.23068      81.86430 
1 1 1 -16 3  9  o 676.0162 28.35150 90.31834       7.443225      89.40409       11.24381      91.03151       9.930686  663.2711 43.89926 672.9534 38.15548 -9.682312      58.16344 
1 1 1 -16 3  10 o 146.1258 63.81578 -0.1002465     6.848213      -4.640497      10.02473      3.872509       9.377321  156.3178 71.89359 186.3163 77.77277 -29.99849      105.9117 
1 1 1 -16 3  11 o 188.4779 70.97594 6.664616       7.069408      7.000425       10.99783      6.428160       9.228582  209.2935 85.47261 197.7888 79.18327 11.50475       116.5142 
1 1 1 -16 3  12 o 364.4404 57.25043 28.67214       7.835650      33.48359       12.08211      25.17946       10.29400  373.1260 85.24554 324.7979 81.68829 48.32809       118.0668 
1 1 1 -16 3  13 o 517.8218 41.28963 55.09592       8.234249      46.24855       12.24222      62.40534       11.12742  449.7941 72.55260 541.4174 53.62706 -91.62335      90.22051 
1 1 1 -16 3  14 o 201.0670 77.64857 8.174010       8.599776      -6.609014      12.80647      20.31505       11.60582  166.3324 78.08675 280.0787 92.14697 -113.7463      120.7833 
1 1 1 -16 3  15 o 277.0705 86.65923 19.81717       10.35665      25.28311       17.51210      16.87715       12.84341  289.5825 111.0731 254.1694 95.67570 35.41312       146.5984 
1 1 1 -16 3  16 o 529.6857 70.96019 66.21174       14.23002      80.43765       20.43628      52.82258       19.82616  538.9093 101.3674 402.6969 118.7036 136.2124       156.0958 
1 1 1 -16 3  17 o 217.6523 100.2778 7.823141       19.61931      0.000000       0.000000      7.823141       19.61931  ?        ?        217.6523 100.2778 0.000000       100.2778 
1 1 1 -16 3  18 o 158.3112 71.11969 1.435346       9.115344      21.05752       13.74961      -13.95123      12.17553  251.7490 97.91303 136.9079 67.14507 114.8411       118.7241 
1 1 1 -16 3  19 o 191.8270 77.27233 9.831505       8.847926      24.30915       12.92021      -2.954101      12.14175  259.2274 96.27739 155.1417 73.78419 104.0857       121.2990 
1 1 1 -16 3  20 o 171.8681 75.90495 6.948051       9.939060      -11.84676      12.69449      36.71852       15.97678  135.0222 66.67139 278.9825 106.3092 -143.9603      125.4859 
1 1 1 -16 3  21 o 181.5916 81.27312 11.86217       11.78613      11.04391       18.23169      12.44966       15.44822  177.7832 86.04901 180.9537 85.20621 -3.170441      121.0972 
1 1 1 -16 3  22 o 173.0643 75.38322 11.55246       9.500310      44.38342       17.97545      -1.172691      11.19101  237.3198 103.5228 136.6002 66.41865 100.7196       122.9976 
1 1 1 -16 3  23 o 251.2656 76.07918 24.02963       8.061697      21.87665       10.82355      26.71232       12.08188  197.5532 83.07997 206.7927 87.41368 -9.239487      120.5962 
1 1 1 -16 3  24 o 157.1195 67.31837 11.33956       7.335489      11.62571       10.44384      11.06094       10.30544  146.7739 69.39980 145.5303 68.85065 1.243637       97.75860 
1 1 1 -16 3  25 o 132.6675 60.29799 8.173092       6.782109      13.32325       9.456267      2.717770       9.732394  140.7189 66.38338 116.3739 57.62949 24.34501       87.90855 
1 1 1 -16 3  26 o 111.1016 55.26842 4.813582       9.352661      4.813582       9.352661      0.000000       0.000000  111.1016 55.26842 ?        ?        0.000000       55.26842 
1 1 1 -16 3  27 o 158.5569 66.58156 18.82359       6.934920      21.12272       9.714072      16.43387       9.903589  133.1804 64.04769 121.9217 59.94865 11.25871       87.72655 
1 1 1 -16 4  1  o 284.8117 53.84616 16.86079       5.737601      19.63234       9.680253      15.35982       7.123785  299.3014 81.21301 267.7437 68.29436 31.55765       106.1116 
1 1 1 -16 4  2  o 412.5083 49.01833 34.60775       7.698988      0.000000       0.000000      34.60775       7.698988  ?        ?        412.5083 49.01833 0.000000       49.01833 
1 1 1 -16 4  3  o 1033.786 18.89932 208.6365       7.587610      203.7053       10.61817      213.7820       10.84647  1018.729 26.83880 1043.654 26.76110 -24.92487      37.90089 
1 1 1 -16 4  4  o 760.8709 22.26836 113.2987       6.580018      118.5717       9.477012      108.3907       9.143071  775.3610 31.47310 741.2203 31.76266 34.14063       44.71490 
1 1 1 -16 4  5  o 391.1343 37.39966 30.66078       5.611708      27.24075       8.116095      33.79347       7.767673  359.7426 60.22213 405.9155 50.35656 -46.17288      78.50152 
1 1 1 -16 4  6  o 113.5682 52.62104 -4.110590      5.516150      -6.509662      8.382345      -2.278100      7.325963  137.2199 64.01369 142.4915 63.90308 -5.271561      90.45085 
1 1 1 -16 4  7  o 294.5449 53.96391 18.25854       5.945328      23.60369       9.118837      14.30644       7.841024  326.5544 73.65876 254.4564 74.54913 72.09799       104.8007 
1 1 1 -16 4  8  o 241.7012 65.39319 12.77980       6.287028      13.34359       9.822586      12.38854       8.182757  247.0343 84.80991 237.9624 77.32935 9.071915       114.7717 
1 1 1 -16 4  9  o 178.7402 67.70390 5.573025       6.455647      2.652505       10.03950      7.631918       8.429440  185.6806 79.13342 203.4084 77.28874 -17.72777      110.6149 
1 1 1 -16 4  10 o 504.0993 38.14914 51.36191       7.413117      35.01403       11.03895      64.78986       10.00465  394.0927 74.86498 561.4567 46.29648 -167.3640      88.02346 
1 1 1 -16 4  11 o 107.0226 51.96099 -10.21860      6.782675      -10.08711      10.18993      -10.32320      9.088573  140.8289 67.14866 130.3846 62.50497 10.44429       91.73774 
1 1 1 -16 4  12 o 359.9970 54.45616 27.75820       7.375462      58.87662       11.93963      8.556597       9.378877  521.8190 60.00987 209.0632 80.99060 312.7558       100.8001 
1 1 1 -16 4  13 o 179.8973 72.48698 5.135247       7.788340      3.834255       11.93030      6.101480       10.28146  196.1002 84.94617 198.0038 81.94018 -1.903564      118.0256 
1 1 1 -16 4  14 o 272.4215 83.46004 18.47716       9.662560      20.51027       16.38937      17.39398       11.96272  274.3343 106.8433 260.8174 93.27290 13.51682       141.8285 
1 1 1 -16 4  15 o 382.6775 73.22243 34.69749       10.48545      48.95049       18.63187      28.09113       12.68483  402.2819 114.0332 321.4091 95.00666 80.87280       148.4245 
1 1 1 -16 4  16 o 207.5132 91.00874 7.017478       14.05914      5.233151       19.26119      9.052216       20.56839  216.6334 99.64136 228.5849 104.3228 -11.95157      144.2624 
1 1 1 -16 4  17 o 217.9891 87.45147 12.18091       11.28204      21.03232       13.84442      -5.318084      19.46593  260.0708 98.99466 189.2394 90.91934 70.83142       134.4108 
1 1 1 -16 4  18 o 201.4842 78.91013 10.55195       8.978296      32.42959       12.85499      -10.28375      12.54514  320.5008 95.85253 145.2046 70.53753 175.2962       119.0095 
1 1 1 -16 4  19 o 296.3121 79.95537 25.50495       9.413655      40.64668       14.19328      13.61285       12.57837  339.7948 100.5128 207.3637 88.48009 132.4310       133.9087 
1 1 1 -16 4  20 o 202.8161 80.96210 13.71491       9.618004      10.90655       12.33270      18.07458       15.36592  187.0787 83.47477 207.3530 92.80096 -20.27431      124.8201 
1 1 1 -16 4  21 o 171.5146 78.54201 9.303217       11.78849      32.37445       18.44648      -6.623836      15.32660  219.9375 99.76247 145.1613 71.96291 74.77625       123.0090 
1 1 1 -16 4  22 o 189.1894 78.40771 15.25946       9.434016      16.60699       17.75524      14.72938       11.13604  171.7358 83.53898 179.5416 79.76661 -7.805771      115.5053 
1 1 1 -16 4  23 o 154.7451 67.60863 9.201797       7.693701      0.6210817      10.96094      17.53526       10.80187  130.8418 64.07388 177.0562 78.61637 -46.21449      101.4199 
1 1 1 -16 4  24 o 171.4875 68.17690 13.34203       6.794621      17.87604       9.936582      9.360179       9.311901  167.0323 74.70004 140.8071 66.25696 26.22519       99.85029 
1 1 1 -16 4  25 o 145.8607 63.48019 11.22989       6.725021      15.33337       10.04669      7.898647       9.052113  141.8996 67.37857 125.7775 60.81838 16.12208       90.76755 
1 1 1 -16 4  26 o 98.02393 48.42996 -0.2011615     6.731483      -0.2710653     9.639177      -0.1346178     9.404664  102.9324 51.88655 102.8306 51.76086 0.1017914      73.28985 
1 1 1 -16 4  27 o 142.9407 63.17627 15.96701       6.897704      9.486320       9.487806      23.23231       10.04574  110.1750 54.94528 134.6415 64.84622 -24.46651      84.99422 
1 1 1 -16 5  1  o 164.2364 59.78373 4.681841       4.941363      12.29635       6.934626      -3.172340      7.042919  240.2773 70.02612 136.6322 61.84067 103.6450       93.42337 
1 1 1 -16 5  2  o 521.0189 39.60889 54.22900       7.954443      0.000000       0.000000      54.22900       7.954443  ?        ?        521.0189 39.60889 0.000000       39.60889 
1 1 1 -16 5  3  o 420.9369 40.59368 35.58698       6.553685      21.72946       11.96116      41.53185       7.834324  310.0274 92.40117 453.3323 45.09830 -143.3049      102.8194 
1 1 1 -16 5  4  o 532.2185 28.83922 55.90837       5.938510      49.15046       8.472366      62.43508       8.326184  493.2678 44.71363 559.0231 38.58830 -65.75531      59.06239 
1 1 1 -16 5  5  o 1061.321 19.50976 220.1700       8.041307      227.3898       11.55336      213.3862       11.19916  1075.009 27.67377 1041.372 27.69182 33.63672       39.14938 
1 1 1 -16 5  6  o 389.2628 38.42094 30.49508       5.732386      35.58733       9.246013      27.31557       7.305996  411.3599 59.61407 362.2951 53.53933 49.06479       80.12675 
1 1 1 -16 5  7  o 431.9902 37.98529 37.53692       6.307840      27.70364       9.875134      44.31432       8.198323  353.6365 74.26816 466.0851 45.88816 -112.4486      87.30110 
1 1 1 -16 5  8  o 171.6372 66.08128 4.768818       6.213579      -4.525095      9.900306      10.80888       7.981230  156.7860 71.86355 225.0733 76.45810 -68.28732      104.9296 
1 1 1 -16 5  9  o 420.7058 43.72269 36.21850       7.039190      27.57953       11.20704      41.84738       9.046300  343.5402 84.56879 447.3378 53.10995 -103.7976      99.86264 
1 1 1 -16 5  10 o 373.8354 47.52656 29.04444       6.743961      25.14277       11.07585      31.34324       8.501625  324.6191 86.35120 382.0104 59.22292 -57.39130      104.7086 
1 1 1 -16 5  11 o 531.7040 37.63609 57.25537       7.721241      62.45501       11.81366      53.37784       10.20178  541.5298 57.03122 503.3315 52.98663 38.19833       77.84692 
1 1 1 -16 5  12 o 732.1766 30.28300 106.8928       8.610786      87.29339       12.44897      124.8711       11.92303  645.7004 50.03556 784.5082 39.13462 -138.8077      63.52225 
1 1 1 -16 5  13 o 134.0063 63.00015 -6.277399      8.386250      2.561422       15.44267      -9.974325      9.987247  207.7106 92.99162 137.7258 65.89149 69.98474       113.9699 
1 1 1 -16 5  14 f 237.2808 80.42901 13.55538       8.831594      19.27896       15.35354      10.72516       10.79654  268.1473 103.6960 221.3064 86.57130 46.84091       135.0831 
1 1 1 -16 5  15 o 162.9399 73.01858 -0.6288995E-02 9.545963      0.9962740      16.53762      -0.5072499     11.69012  201.4528 92.53657 174.4263 79.23392 27.02647       121.8238 
1 1 1 -16 5  16 o 120.7086 60.18140 -22.67400      11.34825      -9.014938      14.47266      -44.47806      18.28550  164.9702 79.02947 137.9954 69.78931 26.97482       105.4334 
1 1 1 -16 5  17 o 146.5131 69.81500 -6.718337      10.97896      -6.781164      13.55148      -6.598330      18.72903  161.0878 76.98191 183.0353 88.25181 -21.94757      117.1093 
1 1 1 -16 5  18 o 240.4574 82.19904 16.83414       9.225352      20.69219       12.81348      12.68194       13.29296  248.3022 95.06507 211.2112 90.56110 37.09100       131.2962 
1 1 1 -16 5  19 o 184.8278 75.68359 9.082939       8.651954      32.59407       12.56897      -12.09005      11.92763  305.6940 95.44381 133.4489 65.64995 172.2451       115.8423 
1 1 1 -16 5  20 o 128.7230 62.51898 -6.491365      9.842315      -8.588257      12.48254      -3.045160      16.00242  137.5847 67.57965 158.4860 77.57059 -20.90126      102.8796 
1 1 1 -16 5  21 o 158.1236 74.31056 5.324787       11.64924      35.92595       18.02874      -16.60892      15.26344  228.0498 101.3974 131.5040 66.16188 96.54587       121.0736 
1 1 1 -16 5  22 o 154.2690 70.39482 7.589416       9.360618      18.91444       17.44132      3.007652       11.09369  173.2190 83.91815 142.9419 68.66547 30.27711       108.4306 
1 1 1 -16 5  23 o 83.73351 42.53816 -17.68351      7.316649      -18.27889      10.79596      -17.17774      9.950301  102.3212 51.94942 99.66032 50.52178 2.660843       72.46512 
1 1 1 -16 5  24 o 103.7703 50.61405 -2.003582      6.642298      -10.59898      10.18946      4.348162       8.759200  103.2895 52.22068 125.4416 60.44975 -22.15211      79.88223 
1 1 1 -16 5  25 f 129.6710 59.23674 8.079952       6.651762      11.10338       9.915854      5.606232       8.969241  129.8800 63.00507 119.0248 58.21774 10.85516       85.78429 
1 1 1 -16 5  26 o 206.0427 70.48245 23.15122       6.782884      30.63744       9.947067      16.64492       9.273234  173.0768 76.21260 133.9321 63.91462 39.14478       99.46577 
1 1 1 -16 6  1  o 400.1116 34.00028 31.83441       5.233082      34.48132       7.172473      28.82160       7.652190  412.8377 45.49166 373.8046 54.30083 39.03308       70.83834 
1 1 1 -16 6  2  o 154.5093 59.71707 3.445076       5.089685      0.1813736      7.138868      6.819009       7.258423  153.2045 66.03765 195.7476 72.26894 -42.54308      97.89674 
1 1 1 -16 6  3  o 438.2927 32.93836 38.15758       5.565531      43.81171       7.966248      32.76640       7.778800  465.6498 44.59759 399.5262 51.32137 66.12366       67.99139 
1 1 1 -16 6  4  o 239.1900 65.47156 12.31699       6.259120      8.892969       11.78748      13.66152       7.386494  230.1798 90.33807 250.6666 72.04715 -20.48680      115.5498 
1 1 1 -16 6  5  o 500.4220 35.41503 49.95702       6.838138      47.44108       13.15944      50.88768       8.003562  466.9766 75.10903 502.6794 41.36528 -35.70279      85.74644 
1 1 1 -16 6  6  o 271.8530 58.51168 15.79642       5.994435      20.58281       9.167616      12.22162       7.922792  302.9376 77.58436 237.4516 75.98613 65.48604       108.5966 
1 1 1 -16 6  7  o 362.7047 45.76659 27.00434       6.303077      31.12699       10.21605      24.47046       8.009190  375.7978 72.62861 336.9153 63.54260 38.88242       96.50169 
1 1 1 -16 6  8  o 244.2797 63.93161 13.08290       6.135497      0.9572155      10.00354      20.39490       7.768174  178.2096 77.49045 304.1732 67.52244 -125.9637      102.7816 
1 1 1 -16 6  9  o 338.5573 53.03932 24.19024       6.744600      25.75914       11.01471      23.24913       8.530938  330.6915 85.23061 322.7505 70.07072 7.941010       110.3366 
1 1 1 -16 6  10 o 167.9614 68.42635 3.604488       7.026995      8.719056       11.17182      0.2563838      9.038970  219.1145 87.32350 166.1543 72.91906 52.96021       113.7655 
1 1 1 -16 6  11 o 173.0962 70.00712 4.263335       7.293923      9.794283       11.76338      0.8086681      9.296839  224.9933 89.62473 169.5647 74.19509 55.42859       116.3508 
1 1 1 -16 6  12 o 131.0897 60.92713 -4.708409      7.481764      -19.16001      11.65342      5.425643       9.758587  132.4820 65.11856 192.9794 79.84261 -60.49741      103.0304 
1 1 1 -16 6  13 o 190.5800 76.75582 6.215217       8.728289      -15.72182      15.59977      16.21241       10.53097  164.6308 79.66200 256.2759 87.82219 -91.64510      118.5697 
1 1 1 -16 6  14 o 315.8537 73.11207 23.68703       8.790892      7.504495       16.65477      29.93676       10.35014  223.3994 98.48119 352.2048 77.75012 -128.8054      125.4736 
1 1 1 -16 6  15 o 437.5458 58.46714 42.63931       9.686397      76.35395       18.10809      29.12527       11.46452  546.9521 88.25440 333.5946 87.43234 213.3575       124.2306 
1 1 1 -16 6  16 o 391.3001 114.7832 50.40070       18.57826      0.000000       0.000000      50.40070       18.57826  ?        ?        391.3001 114.7832 0.000000       114.7832 
1 1 1 -16 6  17 o 261.3000 89.54442 20.28902       10.94805      33.25190       13.46278      -5.021482      18.81199  326.2760 98.20851 183.9127 88.61713 142.3634       132.2797 
1 1 1 -16 6  18 o 118.8398 57.90379 -9.740081      8.629240      -10.84336      12.54682      -8.749778      11.88706  141.9990 69.32681 142.4821 69.08755 -0.4831543     97.87389 
1 1 1 -16 6  19 o 215.6956 79.17410 14.46707       8.692538      9.615736       11.58071      20.72756       13.15553  187.0145 82.29421 230.8536 93.78877 -43.83910      124.7745 
1 1 1 -16 6  20 o 133.4690 64.13928 -3.613050      9.699650      6.388383       12.19463      -20.83871      16.00389  168.2126 78.04577 133.7990 67.37096 34.41354       103.1018 
1 1 1 -16 6  21 o 192.5555 85.01807 17.38780       12.46048      15.64649       19.39935      18.61076       16.25758  176.9836 86.36218 186.1611 87.58269 -9.177521      123.0006 
1 1 1 -16 6  22 o 166.0676 73.55475 11.28039       9.399009      8.218501       17.26937      12.56913       11.20374  154.2825 76.46732 166.6792 76.41645 -12.39667      108.1052 
1 1 1 -16 6  23 o 132.2395 60.95796 4.775071       7.263240      6.796456       10.53253      2.942168       10.02947  139.7488 67.07166 130.5084 63.32259 9.240433       92.24076 
1 1 1 -16 6  24 o 139.8591 62.10604 8.598903       6.742806      15.15412       10.18955      3.492178       8.993580  149.9301 70.15168 121.5667 59.20635 28.36346       91.79679 
1 1 1 -16 6  25 o 95.09610 47.00441 -2.506747      6.365525      -1.188337      9.616697      -3.534862      8.492227  106.1471 53.28247 100.2780 50.29944 5.869102       73.27383 
1 1 1 -16 6  26 o 95.19123 47.11049 -0.4839056     6.466803      6.618872       9.386903      -6.900119      8.921700  110.8222 55.16846 91.88551 46.70893 18.93672       72.28613 
1 1 1 -16 7  1  o 255.4380 56.26084 13.75673       5.430271      14.97222       6.806759      11.62884       9.006121  263.8773 66.45872 237.6562 81.21661 26.22116       104.9424 
1 1 1 -16 7  2  o 506.9294 28.70561 50.71569       5.628016      47.11764       7.909897      54.40490       8.009468  483.9074 42.52156 521.2888 39.86597 -37.38135      58.28704 
1 1 1 -16 7  3  o 889.7272 20.76921 154.8307       7.176372      140.1905       9.855330      171.3555       10.47042  843.2795 30.09343 932.8564 28.90156 -89.57697      41.72427 
1 1 1 -16 7  4  o 143.2681 59.46632 1.546522       5.438344      9.691094       8.351151      -4.450581      7.166102  220.1897 78.01780 131.8542 60.69506 88.33543       98.84669 
1 1 1 -16 7  5  o 266.5454 59.04048 15.19723       5.950489      21.59698       8.980625      10.18866       7.944782  311.8671 75.05655 221.9171 76.26870 89.94995       107.0065 
1 1 1 -16 7  6  o 166.8931 66.82935 3.632534       6.575197      7.643435       12.39484      2.061827       7.756530  224.0806 91.03693 167.0942 70.30382 56.98637       115.0233 
1 1 1 -16 7  7  o 114.3889 53.49149 -4.988438      5.909901      -5.709623      9.759986      -4.570924      7.426109  151.7049 70.18672 133.2534 61.49956 18.45152       93.31866 
1 1 1 -16 7  8  o 377.6740 45.43434 29.35090       6.530203      27.19916       10.54388      30.68984       8.317397  344.1735 80.34618 379.7689 58.25438 -35.59540      99.24254 
1 1 1 -16 7  9  f 705.2703 27.09952 98.32217       7.422414      113.5703       12.11459      89.15839       9.391562  747.8563 41.88054 665.9635 36.45110 81.89276       55.52172 
1 1 1 -16 7  10 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -16 7  11 o 349.2709 69.99828 27.58585       9.163898      0.000000       0.000000      27.58585       9.163898  ?        ?        349.2709 69.99828 0.000000       69.99828 
1 1 1 -16 7  12 o 416.7209 50.99688 36.78400       8.080872      55.82797       16.00639      30.26984       9.361469  477.8460 89.54388 365.8349 68.40668 112.0111       112.6835 
1 1 1 -16 7  13 o 172.8537 73.12084 3.297327       8.463868      5.566722       16.07042      2.426189       9.956702  217.9283 96.36921 178.0903 77.37349 39.83798       123.5867 
1 1 1 -16 7  14 o 432.7141 101.2892 51.09926       16.72045      51.09926       16.72045      0.000000       0.000000  432.7141 101.2892 ?        ?        0.000000       101.2892 
1 1 1 -16 7  15 o 164.8318 71.35130 2.500970       8.405369      -16.15756      13.55646      14.15357       10.71320  146.9057 71.79532 234.8337 87.58012 -87.92801      113.2468 
1 1 1 -16 7  16 f 159.6609 72.80954 -0.5001256     9.994007      -8.568888      12.62498      13.04231       16.35594  153.3474 73.55421 226.5198 98.78217 -73.17242      123.1590 
1 1 1 -16 7  17 o 414.6989 66.79431 42.10384       10.39189      43.78633       12.89388      38.98521       17.55454  396.2621 86.23603 316.9142 113.0254 79.34793       142.1668 
1 1 1 -16 7  18 o 105.5198 52.62885 -16.53478      8.713705      -25.99126      12.51265      -7.630551      12.14180  118.3156 59.57421 144.6979 70.08055 -26.38228      91.98027 
1 1 1 -16 7  19 o 110.8379 55.26928 -15.89062      9.587978      -3.879873      12.13821      -35.81851      15.63508  147.5602 71.12173 121.4750 61.75882 26.08520       94.19370 
1 1 1 -16 7  20 f 141.2135 66.46702 0.3475723      9.383232      0.6252450      11.48768      -0.2090483     16.26467  149.2677 71.20670 158.7689 77.81394 -9.501129      105.4770 
1 1 1 -16 7  21 o 135.6469 64.82142 0.1365477      9.606281      -11.43484      16.37870      6.204332       11.86046  136.7064 68.74672 155.9421 73.80264 -19.23569      100.8610 
1 1 1 -16 7  22 o 112.6841 54.87321 -3.628681      7.718233      4.320116       11.22940      -10.74622      10.62603  141.6756 68.31631 113.1973 56.70613 28.47831       88.78458 
1 1 1 -16 7  23 o 131.0184 60.33195 5.047015       7.089257      16.54839       10.23002      -5.579389      9.833197  165.8410 74.84373 112.1115 55.91508 53.72947       93.42420 
1 1 1 -16 7  24 o 122.2192 57.13412 4.936117       6.732552      4.796564       9.913165      5.055595       9.172451  122.6033 60.22162 122.9557 59.86300 -0.3524246     84.91303 
1 1 1 -16 7  25 o 116.5015 54.80817 5.487659       6.365594      -5.319428      9.669733      13.75280       8.456397  99.47047 50.35698 137.5271 64.20353 -38.05663      81.59607 
1 1 1 -16 7  26 o 88.11186 43.87432 -2.669186      5.952606      -4.945330      8.661307      -0.6317381     8.194580  92.69360 47.00572 97.58829 49.01371 -4.894691      67.91084 
1 1 1 -16 8  1  o 106.0880 49.81731 -5.030250      5.218153      0.2619667      7.089306      -11.28764      7.708709  152.9180 65.86137 116.3763 56.23672 36.54167       86.60421 
1 1 1 -16 8  2  o 859.3765 23.26455 144.7060       7.764368      154.0615       9.837636      129.2513       12.64410  884.6767 28.63375 803.8752 40.63335 80.80151       49.70876 
1 1 1 -16 8  3  o 520.5128 30.01260 53.60893       6.041121      60.93301       8.661642      46.67145       8.429938  550.8224 40.78099 479.5648 45.82127 71.25766       61.34067 
1 1 1 -16 8  4  o 103.9362 49.52727 -6.609590      5.525583      -4.402462      8.149509      -8.487617      7.517417  142.1435 65.16986 121.6738 57.92124 20.46967       87.18934 
1 1 1 -16 8  5  o 491.9331 33.45195 48.22192       6.352839      48.40034       9.492689      48.07719       8.549668  484.7437 51.20013 485.8347 45.85642 -1.090973      68.73328 
1 1 1 -16 8  6  o 165.3193 64.46727 4.112072       5.972670      8.400752       9.628473      1.429684       7.614762  214.8105 82.36825 162.2125 69.01963 52.59801       107.4627 
1 1 1 -16 8  7  o 321.2430 72.44987 23.04913       8.823095      0.000000       0.000000      23.04913       8.823095  ?        ?        321.2430 72.44987 0.000000       72.44987 
1 1 1 -16 8  8  o 160.5080 77.65114 -17.80869      14.80313      -17.80869      14.80313      0.000000       0.000000  160.5080 77.65114 ?        ?        0.000000       77.65114 
1 1 1 -16 8  9  o 440.9394 40.00621 39.54998       6.776112      42.13662       10.89879      37.92007       8.651484  439.2116 65.93230 424.1866 53.72173 15.02505       85.04760 
1 1 1 -16 8  10 o 588.7949 42.90486 70.95775       9.743161      0.000000       0.000000      70.95775       9.743161  ?        ?        588.7949 42.90486 0.000000       42.90486 
1 1 1 -16 8  11 o 265.0007 72.89364 16.28117       7.736429      25.65486       16.38475      13.59173       8.776375  307.2759 109.2365 241.7109 80.16035 65.56505       135.4928 
1 1 1 -16 8  12 f 248.9512 76.28402 14.65954       8.071954      4.155301       16.59883      17.91302       9.237823  217.4217 96.94057 271.6614 81.25760 -54.23972      126.4922 
1 1 1 -16 8  13 o 236.1385 79.22670 13.38409       8.568659      -7.086156      15.63651      22.16932       10.24365  180.8577 85.33218 296.7021 84.70972 -115.8444      120.2386 
1 1 1 -16 8  14 o 594.1525 37.30324 72.46777       8.563732      43.95948       13.14643      93.48196       11.28700  419.3145 83.66329 668.4803 43.71804 -249.1658      94.39710 
1 1 1 -16 8  15 o 310.5942 70.11069 23.35837       8.256309      28.02347       12.40495      19.64839       11.06241  313.8310 94.22815 265.9285 90.01627 47.90247       130.3145 
1 1 1 -16 8  16 o 507.7455 52.89294 57.61531       10.27660      47.05007       13.33374      73.07355       16.12844  418.4839 84.94543 530.0082 80.92331 -111.5243      117.3214 
1 1 1 -16 8  17 o 210.5139 83.32355 12.51571       10.10772      13.56958       12.88477      10.82946       16.29840  214.2907 90.41022 206.5356 93.71830 7.755081       130.2195 
1 1 1 -16 8  18 o 115.1763 56.63193 -11.36893      8.838011      -10.21235      13.25456      -12.29481      11.85919  143.4867 70.30725 132.8255 65.36601 10.66119       95.99909 
1 1 1 -16 8  19 o 142.8479 67.15289 -0.4460321     9.525893      3.904892       11.94586      -8.044319      15.78645  163.4900 76.31900 150.7743 74.43060 12.71576       106.6044 
1 1 1 -16 8  20 o 125.6699 60.81945 -4.405437      9.102171      -9.463948      11.33580      4.775029       15.27119  126.5612 62.58887 162.7652 78.77363 -36.20399      100.6114 
1 1 1 -16 8  21 o 133.2072 63.47162 0.6430673      9.072248      11.20173       15.71850      -4.631325      11.10946  163.7779 79.42081 128.6106 63.28682 35.16730       101.5524 
1 1 1 -16 8  22 o 114.1522 54.99599 -1.540947      7.239533      -11.54989      10.11214      8.983313       10.36919  108.2736 54.38947 150.0242 70.37741 -41.75058      88.94489 
1 1 1 -16 8  23 o 163.3906 67.47688 12.21571       6.951521      13.53181       9.925423      10.94857       9.739098  152.5018 70.63413 145.1346 68.12267 7.367203       98.13194 
1 1 1 -16 8  24 o 157.6089 66.01910 13.18397       6.790704      8.270198       9.765516      17.78467       9.449299  127.0453 61.83526 154.7830 70.66746 -27.73772      93.90149 
1 1 1 -16 8  25 o 109.1077 52.27374 3.772093       6.335568      3.339537       9.387647      4.133899       8.585662  109.4884 54.61109 110.6346 54.66687 -1.146202      77.27119 
1 1 1 -16 9  1  o 276.7448 51.75577 15.97435       5.357957      20.04356       7.467761      11.65732       7.691798  305.7340 64.90226 234.2083 74.86199 71.52568       99.07887 
1 1 1 -16 9  2  o 150.9644 60.12078 2.823418       5.292077      4.853685       7.420648      0.7221619      7.549264  182.2396 71.62796 159.2152 68.25632 23.02434       98.94185 
1 1 1 -16 9  3  o 136.8591 63.67449 -6.061697      8.205693      -6.061697      8.205693      0.000000       0.000000  136.8591 63.67449 ?        ?        0.000000       63.67449 
1 1 1 -16 9  4  o 262.7501 65.08144 15.01562       6.606401      11.42822       8.984137      19.23924       9.748302  233.4406 81.05415 291.3078 82.45144 -57.86722      115.6201 
1 1 1 -16 9  5  o 185.3054 65.13393 6.705615       5.809987      13.17278       8.923174      1.946092       7.654978  245.1644 80.80509 165.5146 69.75134 79.64975       106.7460 
1 1 1 -16 9  6  o 755.4016 25.67053 112.3668       7.530795      114.1756       11.56645      111.0357       9.921982  753.2781 39.67812 746.8955 34.20665 6.382629       52.38749 
1 1 1 -16 9  7  o 533.7481 33.96415 56.97739       7.003592      42.39000       10.35530      69.27529       9.508006  445.4051 61.50705 584.2669 42.18716 -138.8618      74.58467 
1 1 1 -16 9  8  o 254.1634 63.89597 14.26890       6.300045      1.248619       10.08462      22.60290       8.068184  178.9057 77.79851 319.5529 67.14745 -140.6472      102.7686 
1 1 1 -16 9  9  o 415.6279 56.51237 36.78060       8.885192      0.000000       0.000000      36.78060       8.885192  ?        ?        415.6279 56.51237 0.000000       56.51237 
1 1 1 -16 9  10 o 299.6818 65.04156 20.04514       7.352393      26.06777       16.70504      18.59817       8.188123  311.0546 110.3290 283.6914 73.66676 27.36322       132.6622 
1 1 1 -16 9  11 o 134.5712 62.48566 -4.698017      7.839368      15.68127       16.14283      -10.98733      8.967815  259.1256 104.3768 126.6857 61.07860 132.4399       120.9344 
1 1 1 -16 9  12 o 139.8565 64.65742 -4.071297      8.260359      -10.00891      16.06333      -1.936677      9.631409  178.0067 84.71868 158.7648 72.04249 19.24191       111.2087 
1 1 1 -16 9  13 o 491.7075 54.25382 52.39913       10.18762      0.000000       0.000000      52.39913       10.18762  ?        ?        491.7075 54.25382 0.000000       54.25382 
1 1 1 -16 9  14 o 228.3058 77.58073 12.90279       8.217353      10.11635       12.34942      15.11680       11.00809  215.9789 89.62569 240.5598 88.96227 -24.58098      126.2816 
1 1 1 -16 9  15 o 170.6191 71.44865 4.686724       7.950191      -16.65084      11.91572      21.80619       10.67316  133.1597 65.52876 278.6097 88.09307 -145.4500      109.7926 
1 1 1 -16 9  16 o 187.9171 78.36716 7.716110       9.508487      10.93810       11.98432      2.241764       15.62131  206.9405 87.24529 187.0222 87.29387 19.91823       123.4178 
1 1 1 -16 9  17 o 142.4045 66.64405 -2.222463      9.204072      4.434034       12.05254      -11.53569      14.25627  176.0394 80.15397 148.3435 72.73393 27.69597       108.2353 
1 1 1 -16 9  18 o 191.9832 79.13151 10.98612       9.535789      13.55458       12.19483      6.944211       15.29797  201.1868 86.51441 182.0100 85.41429 19.17683       121.5744 
1 1 1 -16 9  19 o 159.1375 72.16006 5.083147       9.640805      2.001179       12.21542      10.17372       15.69921  156.3696 74.26292 179.8809 85.06430 -23.51122      112.9200 
1 1 1 -16 9  20 o 291.7710 72.27004 26.36234       8.146403      37.38677       11.67301      15.89489       11.37431  307.2380 91.21580 190.6753 82.76959 116.5628       123.1711 
1 1 1 -16 9  21 o 138.9096 65.16511 3.627667       8.891087      -2.864138      15.62161      6.738200       10.81336  139.2588 69.61175 150.1672 70.88536 -10.90845      99.35054 
1 1 1 -16 9  22 o 156.0761 66.38770 9.746389       7.041036      9.975831       9.943294      9.515629       9.971826  149.4859 69.73039 148.0575 69.31448 1.428391       98.32001 
1 1 1 -16 9  23 o 121.7567 56.89403 4.031474       6.664925      -3.572212      9.367805      11.82583       9.484532  109.7268 54.70179 144.2455 67.55210 -34.51878      86.92280 
1 1 1 -16 9  24 f 119.2264 55.96008 5.368766       6.570969      5.050126       9.314947      5.684387       9.270716  117.8140 57.96949 119.0850 58.44157 -1.270912      82.31573 
1 1 1 -16 9  25 o 100.1395 48.92661 1.143429       6.282915      7.418968       9.054048      -4.685340      8.725808  114.9336 56.66793 95.49791 48.28654 19.43573       74.45029 
1 1 1 -16 10 1  o 111.1870 51.20013 -3.451934      5.105677      -9.162195      6.891254      3.496934       7.601990  112.8247 54.17697 175.1905 71.24842 -62.36575      89.50688 
1 1 1 -16 10 2  o 340.5803 47.18612 23.80838       6.073439      20.33777       8.504607      27.42049       8.676243  303.9511 72.97137 358.1374 64.76520 -54.18634      97.56716 
1 1 1 -16 10 3  o 123.8498 55.97341 -2.441664      5.745590      -8.046550      8.127172      3.158585       8.123810  129.4495 61.21204 176.5091 72.92379 -47.05956      95.20920 
1 1 1 -16 10 4  o 478.3688 33.44547 45.62331       6.174286      48.13592       9.133088      43.50845       8.379076  484.2787 49.24697 461.0854 47.47216 23.19330       68.40226 
1 1 1 -16 10 5  o 269.4236 65.77235 15.90941       6.821823      16.04376       9.269813      15.75068       10.07550  266.2540 81.77557 263.9651 85.80939 2.288940       118.5348 
1 1 1 -16 10 6  o 293.1345 62.56807 18.67850       6.905909      14.84743       9.651173      22.69821       9.885917  256.4115 84.01380 314.4109 80.59013 -57.99939      116.4177 
1 1 1 -16 10 7  o 292.4175 66.57829 18.91381       7.391266      5.849179       14.32052      23.65789       8.629519  222.0746 94.57428 325.8579 70.25903 -103.7834      117.8161 
1 1 1 -16 10 8  o 506.9523 40.08781 52.18098       7.827985      62.22702       15.77021      48.89645       9.017309  522.5181 80.28418 485.8348 48.43833 36.68323       93.76471 
1 1 1 -16 10 9  o 460.7968 45.68495 43.87510       8.067685      11.96327       15.79217      55.14480       9.384737  247.5304 101.9076 515.8908 47.37126 -268.3604      112.3797 
1 1 1 -16 10 10 o 450.0739 47.57811 42.27127       8.190020      43.74542       16.85377      41.81555       9.370851  405.8888 105.8300 442.0377 55.83253 -36.14890      119.6547 
1 1 1 -16 10 11 o 384.9403 60.55034 32.59241       8.752927      0.000000       0.000000      32.59241       8.752927  ?        ?        384.9403 60.55034 0.000000       60.55034 
1 1 1 -16 10 12 o 156.4479 67.46635 1.601685       7.457954      -11.82105      12.18299      9.646451       9.431699  149.0600 71.69492 211.6277 81.43243 -62.56769      108.4961 
1 1 1 -16 10 13 o 288.1688 69.02138 19.71609       7.622488      22.90499       11.99001      17.55303       9.874892  288.7756 93.58950 260.2724 84.96757 28.50317       126.4060 
1 1 1 -16 10 14 o 106.8724 52.45784 -12.07375      7.480356      -1.867120      12.00576      -18.55031      9.563583  168.3168 77.86230 113.0052 56.16168 55.31155       96.00349 
1 1 1 -16 10 15 o 281.6760 73.38468 20.38879       8.108049      13.92417       12.70717      24.82815       10.53022  223.6884 91.67306 296.5161 86.25549 -72.82774      125.8728 
1 1 1 -16 10 16 o 149.0310 68.26588 -0.2187181     8.914464      14.39063       11.60140      -21.27948      13.92939  218.7445 88.35348 134.0146 66.79303 84.72987       110.7594 
1 1 1 -16 10 17 f 215.8914 87.72487 15.52589       11.51184      15.52589       11.51184      0.000000       0.000000  215.8914 87.72487 ?        ?        0.000000       87.72487 
1 1 1 -16 10 18 o 161.7556 72.12148 5.181099       9.187599      13.14679       11.84669      -6.840616      14.55354  195.3000 84.62376 149.4756 73.32917 45.82436       111.9748 
1 1 1 -16 10 19 o 175.5495 75.36486 9.947865       9.226808      14.82714       11.44988      0.9108888      15.58242  192.5836 83.32063 157.8058 77.09099 34.77776       113.5136 
1 1 1 -16 10 20 o 151.3190 67.16966 6.264118       7.879947      11.46146       12.27314      2.619049       10.27822  168.7341 78.29089 143.1849 68.03590 25.54927       103.7224 
1 1 1 -16 10 21 o 176.9384 74.02689 13.83072       8.523250      33.17606       15.01990      4.642473       10.35131  204.8910 91.72099 140.5549 67.20051 64.33609       113.7042 
1 1 1 -16 10 22 o 109.9683 53.27655 -1.259825      7.030574      -6.508345      9.601983      4.805976       10.32254  109.5042 54.71379 131.8912 64.05042 -22.38705      84.23808 
1 1 1 -16 10 23 o 150.5207 63.77789 10.79153       6.456028      18.83280       9.058034      2.488791       9.204124  167.3898 73.23991 117.7518 57.87703 49.63797       93.34792 
1 1 1 -16 10 24 o 92.02817 45.69576 -3.547319      6.276836      3.004228       8.844121      -10.19656      8.909817  111.3442 55.10268 92.33807 46.91265 19.00616       72.36783 
1 1 1 -16 10 25 o 133.0757 59.40725 10.75006       6.254452      6.629067       8.505449      15.60207       9.229056  112.1895 55.23891 130.4864 62.66818 -18.29694      83.53824 
1 1 1 -16 11 1  f 291.0249 83.71394 19.07638       9.968822      11.80502       15.47041      24.23949       13.03616  257.6739 102.7375 322.3006 96.55617 -64.62677      140.9897 
1 1 1 -16 11 2  o 592.3661 32.47858 69.66616       7.443133      73.35181       13.73455      68.13367       8.856391  592.3307 60.55818 582.8151 39.35958 9.515625       72.22514 
1 1 1 -16 11 3  o 354.3233 53.14844 26.17927       7.087806      30.68036       13.32628      24.40372       8.369829  360.9503 94.10184 335.6405 66.56261 25.30981       115.2638 
1 1 1 -16 11 4  o 278.2824 66.59264 16.97216       7.100637      18.62370       13.92635      16.39198       8.254145  284.4143 100.7513 270.4691 75.63126 13.94522       125.9798 
1 1 1 -16 11 5  o 219.9657 69.58168 10.45744       6.658277      11.98365       13.17700      9.934149       7.715748  246.4880 95.85651 217.6804 75.14135 28.80760       121.7978 
1 1 1 -16 11 6  o 157.0217 65.67014 2.056733       6.704051      31.15558       13.51210      -7.445585      7.721464  358.1820 95.42270 126.0676 59.62875 232.1144       112.5215 
1 1 1 -16 11 7  o 463.3511 53.31505 45.02213       9.418844      47.44836       15.92695      43.71727       11.68019  442.4944 95.48391 445.3234 69.83430 -2.828949      118.2963 
1 1 1 -16 11 8  o 112.1444 54.55295 -11.61741      7.572967      1.469627       15.04833      -16.05578      8.763537  207.6064 92.45238 114.2469 56.21688 93.35943       108.2025 
1 1 1 -16 11 9  o 591.8440 37.96605 71.03526       8.680279      69.88670       16.68579      71.46143       10.16388  548.9386 80.67671 588.7902 44.78568 -39.85162      92.27399 
1 1 1 -16 11 10 o 230.9479 72.00337 12.28648       7.156240      34.92200       12.16630      0.3120893      8.848910  379.3561 84.72172 162.6679 71.74266 216.6883       111.0170 
1 1 1 -16 11 11 o 125.9732 58.92255 -5.001441      7.178201      -26.41952      11.50130      8.664859       9.187181  118.8063 59.43952 205.7536 80.03280 -86.94734      99.69105 
1 1 1 -16 11 12 o 176.5693 70.18449 5.596833       7.199471      -15.65306      11.82266      18.12125       9.076438  137.5123 67.17143 268.3732 80.60600 -130.8609      104.9253 
1 1 1 -16 11 13 o 282.7796 78.86745 20.46207       8.987899      33.50847       20.53345      17.36995       9.996425  303.2437 119.1618 255.1303 85.57327 48.11340       146.7048 
1 1 1 -16 11 14 o 521.3043 41.84288 57.61758       8.399736      62.46328       12.92108      54.07095       11.05424  512.1803 66.53160 484.4078 60.04840 27.77246       89.62290 
1 1 1 -16 11 15 o 167.5538 70.23976 5.092877       7.696543      -0.4955856     12.15624      8.831894       9.943325  166.3299 77.42432 193.4077 80.35410 -27.07777      111.5854 
1 1 1 -16 11 16 o 199.9268 91.28748 10.51411       15.77327      0.000000       0.000000      10.51411       15.77327  ?        ?        199.9268 91.28748 0.000000       91.28748 
1 1 1 -16 11 17 o 181.5177 81.36275 8.404261       11.85965      8.404261       11.85965      0.000000       0.000000  181.5177 81.36275 ?        ?        0.000000       81.36275 
1 1 1 -16 11 18 o 125.6533 61.01269 -6.119328      9.358005      -1.516734      12.00159      -13.25744      14.94614  147.8435 71.12222 138.6901 69.13354 9.153397       99.18576 
1 1 1 -16 11 19 o 100.4931 49.95914 -11.16450      7.591803      5.048829       11.20665      -24.91601      10.32084  155.2444 72.93429 99.46347 50.52854 55.78091       88.72735 
1 1 1 -16 11 20 o 139.7320 64.84770 3.958311       8.426601      -4.761117      16.57075      6.999568       9.786441  139.4418 69.98808 151.3877 70.12508 -11.94586      99.07501 
1 1 1 -16 11 21 o 115.2857 56.46481 -2.833127      8.522066      -14.24685      15.43034      2.176421       10.22259  120.5112 61.27712 130.8392 63.58563 -10.32804      88.30638 
1 1 1 -16 11 22 o 107.2498 51.86328 -0.7567982     6.585664      -3.603478      8.984746      2.548363       9.681280  109.6998 54.50466 122.8841 60.18559 -13.18429      81.19769 
1 1 1 -16 11 23 o 168.6651 66.26993 14.15656       6.349947      14.91257       8.752471      13.31641       9.226645  148.5597 67.89830 140.7140 66.13046 7.845657       94.78089 
1 1 1 -16 11 24 o 136.7296 59.99646 10.16958       6.117043      3.619060       8.136822      18.68336       9.276370  110.1197 54.18283 145.9868 67.84789 -35.86706      86.82808 
1 1 1 -16 12 1  o 470.2462 59.64376 46.36808       10.64740      27.60219       16.07660      61.03093       14.21082  336.6240 108.2959 533.1238 70.35654 -196.4998      129.1435 
1 1 1 -16 12 2  o 510.7425 44.01089 52.90928       8.644280      50.74274       10.82089      56.73034       14.37051  492.7716 57.63309 509.7440 74.81927 -16.97244      94.44309 
1 1 1 -16 12 3  o 247.9527 69.31126 13.53615       6.933537      11.21838       13.51268      14.36448       8.078025  245.0542 96.54831 254.0288 75.98618 -8.974625      122.8636 
1 1 1 -16 12 4  o 339.8832 56.22974 24.45211       7.162537      30.86325       14.15296      22.24476       8.304523  355.9121 98.86224 317.4284 69.30898 38.48376       120.7372 
1 1 1 -16 12 5  o 178.9125 69.80016 5.129147       7.004167      16.66335       13.13937      0.5505077      8.278444  269.7339 97.59360 162.6210 70.60217 107.1128       120.4540 
1 1 1 -16 12 6  o 359.4908 54.21590 27.33671       7.333797      23.64513       14.32666      28.64755       8.537142  307.2595 102.4425 363.3559 62.76937 -56.09637      120.1435 
1 1 1 -16 12 7  o 465.0922 44.81800 44.52724       7.994848      33.40716       15.52071      48.54345       9.327518  358.4221 104.8493 482.1557 50.56664 -123.7337      116.4061 
1 1 1 -16 12 8  o 367.2216 51.37074 28.52492       7.125545      27.74885       11.69666      28.98289       8.985320  336.7469 88.33945 360.7265 66.59303 -23.97961      110.6277 
1 1 1 -16 12 9  o 132.8853 61.40490 -4.052438      7.436938      -6.539509      11.04494      -1.989606      10.05892  155.8134 72.94657 162.8710 73.79368 -7.057541      103.7628 
1 1 1 -16 12 10 f 354.9135 56.60788 27.52559       7.540250      22.75604       11.20910      31.46773       10.19057  297.7373 89.61080 366.1693 74.20351 -68.43198      116.3454 
1 1 1 -16 12 11 o 256.1074 70.11668 15.61447       7.177913      12.24055       11.06239      18.06786       9.433328  227.7080 88.03067 267.1406 82.56778 -39.43263      120.6932 
1 1 1 -16 12 12 f 502.2869 40.52552 52.65436       7.837828      44.74469       11.73846      59.01768       10.52869  432.0570 72.52888 519.6539 52.90940 -87.59686      89.77663 
1 1 1 -16 12 13 f 191.7106 72.35055 8.452113       7.355070      10.70658       11.27609      6.782639       9.703445  211.1594 86.42658 188.3546 78.90886 22.80482       117.0306 
1 1 1 -16 12 14 o 291.5291 79.12791 23.03109       9.187929      37.60070       20.05095      19.15876       10.33706  296.7986 117.3946 255.1688 87.01197 41.62984       146.1252 
1 1 1 -16 12 15 o 184.7478 72.36422 8.469460       7.551209      3.482676       12.15994      11.59957       9.633880  174.7266 79.92360 203.9221 81.14661 -29.19542      113.8971 
1 1 1 -16 12 16 o 518.7217 63.19999 67.68909       12.46831      67.68909       12.46831      0.000000       0.000000  518.7217 63.19999 ?        ?        0.000000       63.19999 
1 1 1 -16 12 17 o 160.1586 74.22108 3.523901       10.98108      3.523901       10.98108      0.000000       0.000000  160.1586 74.22108 ?        ?        0.000000       74.22108 
1 1 1 -16 12 18 o 153.3851 69.46010 4.858496       8.899011      6.996622       11.17125      1.145628       14.72109  164.2736 75.67879 156.1955 75.99979 8.078125       107.2532 
1 1 1 -16 12 19 o 124.3146 58.59050 -0.2591505     7.335405      6.877370       11.12187      -5.753710      9.758905  155.7475 73.00624 122.0506 59.90982 33.69690       94.44097 
1 1 1 -16 12 20 o 110.8550 54.59184 -5.636738      8.320028      8.913276       16.05880      -10.97535      9.727369  150.7519 74.54127 108.4636 54.32310 42.28835       92.23557 
1 1 1 -16 12 21 o 174.9828 72.63287 15.24921       8.113619      19.68364       13.63540      12.81841       10.09539  159.7486 76.57594 153.7402 71.21781 6.008438       104.5746 
1 1 1 -16 12 22 o 84.07478 42.46859 -11.33422      6.651086      -10.18086      9.146596      -12.62840      9.688928  98.19385 49.62459 97.36185 49.40906 0.8320007      70.02753 
1 1 1 -16 12 23 o 142.2181 66.69054 15.33265       9.296355      0.000000       0.000000      15.33265       9.296355  ?        ?        142.2181 66.69054 0.000000       66.69054 
1 1 1 -16 13 1  o 274.7989 72.62349 16.80099       7.867260      17.92585       9.653859      14.57689       13.57469  280.5686 82.86766 262.3145 98.43600 18.25409       128.6728 
1 1 1 -16 13 2  o 217.7999 76.00689 9.842074       7.904871      5.817561       9.996944      16.55681       12.91294  201.9069 81.85385 270.9976 96.90727 -69.09070      126.8506 
1 1 1 -16 13 3  o 311.8227 68.30850 21.45942       8.043218      0.000000       0.000000      21.45942       8.043218  ?        ?        311.8227 68.30850 0.000000       68.30850 
1 1 1 -16 13 4  o 350.2542 48.45303 25.50588       6.414201      30.75812       9.303310      20.74725       8.855359  375.3319 66.24738 301.9672 75.66587 73.36472       100.5686 
1 1 1 -16 13 5  o 574.0872 31.58913 65.74861       7.015672      62.91355       10.37335      68.13856       9.524258  551.4125 48.95012 578.1786 42.71963 -26.76617      64.96984 
1 1 1 -16 13 6  o 151.8205 64.58821 1.408926       6.666508      10.54918       10.39971      -4.966902      8.685810  226.0934 85.86201 142.7303 66.09698 83.36305       108.3563 
1 1 1 -16 13 7  o 389.7207 45.91958 31.59460       6.816516      33.66673       11.08887      30.33598       8.642203  380.7800 77.61962 372.1280 61.98056 8.652069       99.32973 
1 1 1 -16 13 8  o 452.3139 40.87842 42.04976       7.103023      45.81440       10.77339      39.15494       9.447150  456.4878 62.40535 424.2380 58.93246 32.24973       85.83392 
1 1 1 -16 13 9  o 321.4017 59.47808 22.92548       7.150489      27.46103       10.77279      19.35357       9.560114  333.2603 83.42878 279.4626 82.44263 53.79773       117.2909 
1 1 1 -16 13 10 o 189.3322 73.52068 7.166636       7.742780      16.97516       10.12855      -6.624869      12.01023  257.1484 86.13751 159.0469 74.96333 98.10144       114.1892 
1 1 1 -16 13 11 o 402.2157 57.78387 36.21330       8.766768      26.67513       11.02659      52.60220       14.45386  316.8886 86.96560 453.8551 85.13194 -136.9665      121.6982 
1 1 1 -16 13 12 o 334.0872 59.33297 25.68363       7.416112      14.40370       11.37232      34.02983       9.782288  230.7422 89.24085 374.9720 69.74280 -144.2298      113.2607 
1 1 1 -16 13 13 f 158.1023 67.63596 3.358965       7.384531      7.016658       11.27629      0.6124890      9.771262  190.5534 82.56422 159.7020 72.50464 30.85144       109.8807 
1 1 1 -16 13 14 o 185.7313 76.51005 8.131248       8.908032      9.964122       11.23803      5.032755       14.61164  197.8417 84.00488 187.3832 86.40618 10.45851       120.5108 
1 1 1 -16 13 15 o 156.5611 70.80519 2.412210       9.212000      9.026734       11.72084      -8.276026      14.89918  188.3110 82.82933 154.3366 75.39320 33.97437       112.0037 
1 1 1 -16 13 16 o 241.6144 105.7630 32.43410       18.90742      32.43410       18.90742      0.000000       0.000000  241.6144 105.7630 ?        ?        0.000000       105.7630 
1 1 1 -16 13 17 o 137.4401 64.88585 -0.6343920     9.065621      -4.266485      11.18867      6.307450       15.46812  137.7460 66.84522 169.9539 81.49225 -32.20792      105.4005 
1 1 1 -16 13 18 o 145.3649 63.87131 4.831820       6.953225      12.02516       10.12660      -1.584678      9.564173  177.4031 77.53502 132.2973 63.60505 45.10579       100.2860 
1 1 1 -16 13 19 o 130.5530 59.68673 2.848122       6.769958      -2.436728      9.854190      7.572210       9.316732  126.1051 61.53881 152.2234 69.75061 -26.11837      93.01706 
1 1 1 -16 13 20 o 97.16982 48.68374 -10.46159      7.844414      -13.09127      13.61065      -9.153606      9.599051  116.6736 59.14020 108.0002 54.07236 8.673409       80.13354 
1 1 1 -16 13 21 o 119.0762 56.40014 2.716315       6.953850      12.13613       9.914373      -6.404955      9.755997  146.3882 68.71806 107.8189 54.05853 38.56925       87.43282 
1 1 1 -16 13 22 o 225.4827 68.45155 21.32240       6.519974      26.25603       8.960565      15.77131       9.504753  202.1834 78.92945 148.4364 68.88163 53.74707       104.7594 
1 1 1 -16 13 23 o 152.3675 64.43617 13.35277       6.569694      14.62476       8.881618      11.81592       9.762650  138.7127 65.09119 127.8231 62.12423 10.88956       89.97935 
1 1 1 -16 14 1  o 125.8963 59.30298 -6.781420      7.495829      -3.673510      9.313346      -12.49730      12.63028  154.2341 70.31600 156.3049 74.59147 -2.070877      102.5096 
1 1 1 -16 14 2  o 516.2062 72.18900 58.72185       14.07587      0.000000       0.000000      58.72185       14.07587  ?        ?        516.2062 72.18900 0.000000       72.18900 
1 1 1 -16 14 3  o 137.9679 61.01548 -0.8926849     6.443497      -4.793082      7.375175      11.68555       13.24426  131.0564 60.76686 241.9969 95.50793 -110.9405      113.2006 
1 1 1 -16 14 4  o 391.0585 43.05542 31.42956       6.430461      30.79563       9.278584      32.01545       8.920096  373.7133 66.36242 384.0674 61.90924 -10.35410      90.75641 
1 1 1 -16 14 5  o 365.4858 48.47364 27.98587       6.710502      26.90511       9.995142      28.87279       9.054583  340.1858 77.39945 359.9229 67.25142 -19.73703      102.5350 
1 1 1 -16 14 6  o 187.8352 67.62511 7.197903       6.298309      9.056424       9.250253      5.591638       8.599604  211.2890 80.80146 187.9474 76.01467 23.34157       110.9374 
1 1 1 -16 14 7  o 241.3781 68.43925 13.44464       6.710409      9.704411       9.487983      17.18797       9.491920  214.2342 81.85565 265.1024 82.97019 -50.86815      116.5521 
1 1 1 -16 14 8  o 163.5895 65.26353 4.280540       6.246264      2.167688       9.378129      5.965165       8.374007  172.5375 75.02657 186.0688 75.09644 -13.53127      106.1530 
1 1 1 -16 14 9  o 247.5218 66.79813 14.42257       6.569928      5.510812       9.901795      21.43160       8.781347  188.8691 79.44764 295.7401 76.03563 -106.8710      109.9697 
1 1 1 -16 14 10 o 381.0439 48.70678 31.36906       7.042707      37.08594       10.78573      27.11991       9.298682  391.3390 73.67223 333.0192 73.83602 58.31979       104.3041 
1 1 1 -16 14 11 o 170.7731 69.06364 5.389255       7.098209      13.31117       10.40306      -1.511667      9.709557  224.9383 85.76760 154.6325 70.98372 70.30577       111.3318 
1 1 1 -16 14 12 o 129.7399 61.58530 -5.704747      8.380416      -9.354926      10.41219      1.009271       14.12135  135.5058 65.45119 180.7661 83.91096 -45.26030      106.4185 
1 1 1 -16 14 13 o 154.5173 69.93313 1.071943       9.005891      7.871729       11.23506      -11.15096      15.06312  189.6818 82.29981 155.0446 75.75336 34.63713       111.8563 
1 1 1 -16 14 14 o 227.4855 80.77413 15.68275       8.956215      17.46805       11.45233      12.87161       14.37077  228.0485 89.17473 204.5966 90.76951 23.45186       127.2448 
1 1 1 -16 14 15 o 199.8364 78.18866 12.31584       8.808310      19.66262       11.24533      0.6522964      14.16899  232.2332 89.02365 164.8387 78.75826 67.39459       118.8616 
1 1 1 -16 14 16 o 230.3107 88.46093 21.02462       11.11720      21.02462       11.11720      0.000000       0.000000  230.3107 88.46093 ?        ?        0.000000       88.46093 
1 1 1 -16 14 17 o 103.9896 51.13710 -8.226521      7.212829      -8.910507      10.54790      -7.625772      9.885276  122.9003 60.70226 121.9617 59.95320 0.9385910      85.31793 
1 1 1 -16 14 18 o 170.4969 70.10170 10.36160       7.460765      -3.942232      11.98429      19.41336       9.533505  132.0516 65.12491 209.8042 81.54989 -77.75259      104.3630 
1 1 1 -16 14 19 o 99.48195 48.84019 -5.563760      6.494571      -18.64035      8.833185      9.823400       9.581846  92.87823 47.13814 153.9023 70.59938 -61.02406      84.88979 
1 1 1 -16 14 20 f 165.3512 69.45573 12.91063       7.550295      23.43374       11.79012      5.594896       9.830490  177.5849 80.22714 133.0232 64.08723 44.56169       102.6819 
1 1 1 -16 14 21 o 104.3903 50.96353 -1.279283      6.778501      -6.683865      9.049526      5.629167       10.23140  102.5754 51.51693 125.6690 61.61662 -23.09362      80.31564 
1 1 1 -16 14 22 o 84.96976 42.74643 -8.217928      6.364583      -0.8926984     8.487080      -17.63116      9.620932  106.0462 52.73653 88.98129 45.51383 17.06494       69.66096 
1 1 1 -16 15 1  o 251.7556 70.93102 14.36708       7.231633      19.34159       8.540678      1.767009       13.59264  289.8183 75.22538 201.3225 88.84739 88.49582       116.4161 
1 1 1 -16 15 2  o 112.1860 54.99849 -14.07272      8.142982      -21.26835      9.582750      4.622868       15.44633  112.2312 55.84885 219.1648 95.77377 -106.9336      110.8680 
1 1 1 -16 15 3  o 268.6712 65.34696 16.22265       6.752775      18.58302       7.762214      8.876704       13.69365  285.1129 70.49981 227.0417 94.31038 58.07123       117.7483 
1 1 1 -16 15 4  o 402.7377 52.56299 34.47830       8.025058      32.24739       9.607146      39.62872       14.59735  378.9997 67.75916 395.1012 96.06499 -16.10153      117.5576 
1 1 1 -16 15 5  o 249.7088 65.64127 14.22957       6.449512      9.353352       9.645145      18.17322       8.673936  212.9171 82.23046 275.5646 77.69843 -62.64749      113.1322 
1 1 1 -16 15 6  o 178.4888 68.49015 6.005596       6.660214      16.70890       9.988593      -2.562382      8.936852  259.0347 85.49874 150.7498 68.78663 108.2849       109.7344 
1 1 1 -16 15 7  o 484.5305 36.15665 47.98404       6.754574      47.67989       9.935842      48.24538       9.210198  467.4895 55.83199 474.7263 50.74316 -7.236755      75.44587 
1 1 1 -16 15 8  o 321.9200 55.76857 23.01647       6.719558      40.41665       9.977359      8.572901       9.090251  421.8726 62.81435 201.1680 79.21050 220.7045       101.0938 
1 1 1 -16 15 9  o 144.9412 62.93866 1.269217       6.581360      -0.3632287     10.02759      2.504547       8.723062  162.2717 73.58591 165.8030 72.22667 -3.531250      103.1095 
1 1 1 -16 15 10 o 233.1734 70.83722 13.61606       6.980529      18.15500       10.40362      9.899345       9.414278  254.5184 87.28778 204.1383 80.53669 50.38011       118.7658 
1 1 1 -16 15 11 o 423.7617 52.78728 40.40218       8.498847      47.16914       10.49577      27.51607       14.48366  447.0600 62.13318 284.4198 102.5324 162.6402       119.8892 
1 1 1 -16 15 12 o 257.9283 76.04713 18.23090       8.136413      21.95945       10.16934      11.59809       13.56349  270.8396 86.02634 207.1823 90.16015 63.65727       124.6169 
1 1 1 -16 15 13 o 150.7999 68.64016 1.082624       8.829741      11.11202       11.24209      -15.06626      14.26531  198.3297 84.10519 142.0170 70.22847 56.31271       109.5706 
1 1 1 -16 15 14 o 223.8254 87.67634 17.74432       11.08550      17.74432       11.08550      0.000000       0.000000  223.8254 87.67634 ?        ?        0.000000       87.67634 
1 1 1 -16 15 15 o 96.95808 48.38365 -13.63534      7.404869      4.822853       10.59026      -31.29192      10.35774  161.9800 74.27412 95.89892 48.89613 66.08105       88.92400 
1 1 1 -16 15 16 o 189.0556 75.18964 12.34398       8.267184      0.4578330      10.36844      33.08997       13.69808  143.1283 68.10365 257.9861 98.40589 -114.8578      119.6738 
1 1 1 -16 15 17 o 111.9437 53.83180 -3.311306      6.860106      10.49670       9.514044      -18.26483      9.900824  168.2598 74.29021 103.0425 52.02172 65.21738       90.69341 
1 1 1 -16 15 18 o 111.6340 53.31700 -1.511186      6.480435      -4.546250      8.519017      2.657243       9.983706  114.3511 56.09898 135.6522 65.15735 -21.30109      85.98009 
1 1 1 -16 15 19 o 106.8854 52.09106 -2.855576      6.995121      1.166757       9.936310      -6.807892      9.849450  125.8068 61.48018 111.3349 55.59641 14.47187       82.89012 
1 1 1 -16 15 20 o 121.2836 57.43629 3.507177       7.205928      3.260296       10.15886      3.757180       10.22288  123.9925 60.91601 125.0025 61.35042 -1.010002      86.45597 
1 1 1 -16 15 21 o 104.1848 50.70047 -0.2908245     6.557845      -0.9057813     8.607352      0.5600578      10.12470  108.5453 53.83131 113.7092 56.71606 -5.163963      78.19540 
1 1 1 -16 16 1  o 469.0770 45.31404 45.67037       8.151978      41.85320       9.887654      53.77197       14.40483  438.9889 59.53365 479.2977 80.22345 -40.30881      99.90023 
1 1 1 -16 16 2  o 267.1827 73.59629 16.75084       7.879892      17.95654       9.520478      14.12830       14.04107  271.6497 82.77167 248.0889 98.20336 23.56084       128.4330 
1 1 1 -16 16 3  o 290.3562 65.95133 19.22324       7.267358      22.86124       8.472851      9.097191       14.13574  313.7119 71.17865 224.9767 94.79616 88.73526       118.5441 
1 1 1 -16 16 4  f 256.9381 67.79492 15.34433       6.862979      7.041789       7.924750      40.25031       13.72562  191.0338 74.32433 397.9642 90.81389 -206.9305      117.3510 
1 1 1 -16 16 5  o 256.1212 81.76153 16.35567       9.177178      16.35567       9.177178      0.000000       0.000000  256.1212 81.76153 ?        ?        0.000000       81.76153 
1 1 1 -16 16 6  o 468.6855 37.47990 45.20650       6.764872      46.51240       9.668495      43.95406       9.468583  461.0030 55.09571 447.5108 55.68644 13.49222       78.33592 
1 1 1 -16 16 7  o 189.2774 74.45700 7.336385       8.024746      -3.847533      10.04415      27.07437       13.34343  151.6784 70.52861 305.3260 98.70725 -153.6476      121.3153 
1 1 1 -16 16 8  o 148.9085 65.98240 0.6215147      7.571144      3.799023       9.223382      -5.942494      13.25658  173.7050 74.96777 164.1995 77.80148 9.505539       108.0428 
1 1 1 -16 16 9  o 151.5135 67.18435 1.079882       7.863038      -6.198062      9.832623      13.99053       13.09601  140.3924 66.66113 226.2220 92.92915 -85.82967      114.3658 
1 1 1 -16 16 10 o 184.7570 74.48199 7.608925       8.227364      3.519772       10.28618      14.87077       13.70759  172.5914 76.67142 224.9353 93.97353 -52.34383      121.2828 
1 1 1 -16 16 11 o 174.5161 80.63206 2.159771       12.81754      0.000000       0.000000      2.159771       12.81754  ?        ?        174.5161 80.63206 0.000000       80.63206 
1 1 1 -16 16 12 o 230.9149 77.16977 15.49683       8.129187      29.61464       10.46455      -5.988442      12.90944  315.6775 83.91623 151.3907 73.06367 164.2869       111.2665 
1 1 1 -16 16 13 o 238.9651 78.18235 17.48067       8.359020      19.96471       10.44473      13.05507       13.94131  240.6557 87.02193 198.7066 88.70108 41.94910       124.2606 
1 1 1 -16 16 14 o 91.77231 45.93931 -14.22520      6.914101      -2.338765      10.27386      -24.06509      9.347665  140.5704 67.13577 96.86989 49.09225 43.70055       83.17007 
1 1 1 -16 16 15 o 332.7440 65.46460 30.72962       8.158168      20.54638       10.42822      46.79315       13.09747  225.1524 85.86600 352.3492 93.98450 -127.1969      127.3030 
1 1 1 -16 16 16 o 329.0661 65.13922 31.22294       8.029806      36.46869       9.889068      21.07058       13.75735  330.9608 78.18392 195.0459 87.51434 135.9149       117.3520 
1 1 1 -16 16 17 o 120.0282 56.06469 0.7106626      6.462158      14.20693       8.929239      -14.13184      9.363997  179.5419 75.48049 103.0769 51.85496 76.46497       91.57643 
1 1 1 -16 16 18 o 160.5357 70.62326 11.75756       8.523809      11.75756       8.523809      0.000000       0.000000  160.5357 70.62326 ?        ?        0.000000       70.62326 
1 1 1 -16 16 19 o 122.8825 57.45698 3.584033       6.815378      2.497607       9.195284      4.908407       10.15244  123.4826 60.07875 129.6827 63.10294 -6.200058      87.12885 
1 1 1 -16 16 20 o 105.5920 51.24923 -0.4195327     6.583354      -6.321352      8.648220      7.713336       10.15209  101.3820 50.84023 129.3642 62.98214 -27.98226      80.94121 
1 1 1 -16 17 1  o 155.4595 68.95213 -0.3987247E-01 8.287539      0.6130694      10.84927      -0.9546649     12.84176  175.7731 78.37186 182.1127 82.84864 -6.339691      114.0441 
1 1 1 -16 17 2  o 388.4169 58.94138 33.34957       8.611704      20.09017       11.14766      52.97359       13.56174  277.6595 90.25952 473.1088 76.41648 -195.4494      118.2635 
1 1 1 -16 17 3  o 163.3112 68.73895 3.102418       7.419755      2.511179       9.188956      4.210135       12.57764  171.7735 74.47946 196.2078 86.06463 -24.43430      113.8170 
1 1 1 -16 17 4  o 313.7579 66.29070 22.92887       7.824439      25.50965       9.524496      17.57190       13.72230  321.9424 77.18089 254.6093 98.15260 67.33316       124.8632 
1 1 1 -16 17 5  o 372.2418 53.63402 30.49637       7.529633      31.04743       9.139509      29.33213       13.28446  364.1971 67.09074 319.9835 97.83123 44.21353       118.6260 
1 1 1 -16 17 6  o 429.9940 47.54488 39.82925       7.806676      39.21598       9.579208      41.04206       13.47101  413.7259 61.48964 389.5608 90.73178 24.16510       109.6049 
1 1 1 -16 17 7  f 213.1466 75.14831 11.35770       7.738890      19.75766       9.609405      -4.145317      13.05468  269.7676 83.32737 166.1385 78.25980 103.6291       114.3156 
1 1 1 -16 17 8  o 175.9644 70.56570 6.352616       7.342804      15.20887       9.206011      -9.133620      12.17361  235.4637 82.03235 147.8105 71.23808 87.65323       108.6470 
1 1 1 -16 17 9  o 246.7309 74.92448 16.31081       7.810509      14.85077       9.860902      18.76901       12.79504  227.6260 84.19526 242.2174 94.38427 -14.59146      126.4802 
1 1 1 -16 17 10 o 198.3557 74.85057 10.44527       7.871632      11.84823       10.08345      8.256304       12.59521  205.6469 82.61369 192.2058 85.13895 13.44116       118.6325 
1 1 1 -16 17 11 o 154.9353 69.02330 2.812724       8.396458      0.7907508      10.60583      6.208134       13.74369  157.5911 72.99971 183.1169 84.20430 -25.52580      111.4420 
1 1 1 -16 17 12 o 166.6739 67.64056 6.723716       6.834216      18.28656       9.903568      -3.788570      9.442956  232.8831 84.65676 135.5701 64.64109 97.31294       106.5140 
1 1 1 -16 17 13 o 178.8827 70.30145 9.213450       7.147663      -0.8808175     10.23515      18.82246       9.986099  144.0133 68.27322 227.8273 84.63696 -83.81409      108.7412 
1 1 1 -16 17 14 o 201.9363 70.87656 12.94401       6.878458      21.41555       9.651994      4.201701       9.805031  238.2205 83.93132 153.2039 70.69305 85.01651       109.7359 
1 1 1 -16 17 15 o 105.4193 52.00579 -8.425045      7.661988      -8.130921      9.185281      -9.097867      13.89241  115.3032 56.89290 132.8147 66.27591 -17.51148      87.34586 
1 1 1 -16 17 16 o 96.56618 48.13374 -10.25934      7.241888      -11.00973      8.784001      -8.666942      12.79602  104.9929 52.44048 125.1562 62.62805 -20.16330      81.68401 
1 1 1 -16 17 17 o 198.0150 72.77847 16.26983       7.348297      12.70033       8.591596      25.99552       14.18176  166.4075 72.08533 182.2964 84.43321 -15.88887      111.0192 
1 1 1 -16 17 18 o 155.6933 64.68346 9.948722       6.442972      9.127838       8.162729      11.30536       10.49366  145.0836 66.02217 147.1025 69.55824 -2.018936      95.90243 
1 1 1 -16 17 19 o 162.6155 67.63931 13.05512       7.057193      4.937917       9.633135      22.45817       10.36810  125.9641 61.33210 175.1932 77.44198 -49.22912      98.78708 
1 1 1 -16 18 1  o 149.3622 65.69138 0.6074287      7.370846      3.975305       9.075257      -5.920167      12.63448  176.8826 75.30705 163.9595 77.15930 12.92317       107.8179 
1 1 1 -16 18 2  o 215.9408 75.96757 11.17509       7.904383      16.22025       10.11309      3.254108       12.67173  249.2566 86.02728 190.5492 84.84866 58.70740       120.8304 
1 1 1 -16 18 3  o 353.3150 54.35350 27.66345       7.218906      21.31641       8.668071      42.03008       13.04110  292.1853 75.75732 402.7351 85.99591 -110.5498      114.6057 
1 1 1 -16 18 4  o 391.9590 49.53652 33.45021       7.372039      34.43696       8.952043      31.37101       12.99470  386.9786 61.63460 330.3860 95.73579 56.59262       113.8603 
1 1 1 -16 18 5  o 315.2944 60.43033 23.07632       7.130127      23.89740       8.645353      21.33003       12.60811  309.1487 73.14998 266.7491 95.71749 42.39960       120.4689 
1 1 1 -16 18 6  o 262.5932 70.33051 17.36184       7.315950      10.25937       8.963037      31.53959       12.66351  203.9924 79.13323 325.8677 94.53141 -121.8753      123.2812 
1 1 1 -16 18 7  o 166.2178 65.92075 5.609138       6.338059      2.409432       8.889507      8.917443       9.039104  161.5051 71.53365 193.9116 78.10597 -32.40649      105.9132 
1 1 1 -16 18 8  o 337.1465 54.60621 26.28882       6.905200      42.75061       9.969623      11.10988       9.573288  420.7750 62.94362 203.7377 80.94846 217.0372       102.5405 
1 1 1 -16 18 9  o 243.9778 65.60178 15.32091       6.350414      30.64934       9.245177      1.628285       8.737954  341.4785 71.98321 153.4189 69.21036 188.0596       99.85818 
1 1 1 -16 18 10 o 453.6587 40.36847 44.84316       7.037811      46.72754       9.998242      42.99253       9.908302  435.3470 60.79602 413.2923 63.78554 22.05472       88.11782 
1 1 1 -16 18 11 f 211.6312 70.86017 12.94727       6.854334      10.47640       10.03856      15.10536       9.381721  187.7276 79.53500 214.0252 81.48627 -26.29758      113.8676 
1 1 1 -16 18 12 o 203.2755 69.25919 12.25558       6.549230      24.70667       9.628784      1.536072       8.934190  270.1925 83.40354 145.2583 67.18576 124.9341       107.0984 
1 1 1 -16 18 13 o 162.5545 66.25687 7.423947       6.592641      13.75809       9.430195      1.368826       9.220158  192.7979 78.98840 141.9643 66.52203 50.83362       103.2683 
1 1 1 -16 18 14 o 196.9411 69.44365 12.91835       6.608739      3.772139       9.034764      23.44400       9.692164  144.4747 67.08306 239.4009 84.12721 -94.92618      107.5989 
1 1 1 -16 18 15 o 122.3834 58.17521 -0.2817845     7.529488      -1.079566      8.927735      1.683720       14.01317  125.8527 60.74409 142.9599 70.48880 -17.10721      93.05115 
1 1 1 -16 18 16 o 211.3536 70.40525 16.71453       6.767523      13.75534       8.711439      21.21869       10.74756  172.1465 73.54813 191.9226 81.83707 -19.77611      110.0301 
1 1 1 -16 18 17 o 106.9879 51.68072 -1.670188      6.495036      0.2859479      8.289232      -4.781135      10.45348  119.1307 57.74799 115.7013 57.69691 3.429398       81.63188 
1 1 1 -16 18 18 o 86.40186 43.35069 -9.390567      6.328810      -6.111919      7.856306      -15.45131      10.68154  100.9244 50.27868 100.1229 50.91724 0.8015137      71.55775 
1 1 1 -16 19 1  o 179.9835 70.39182 6.636612       7.136938      10.43579       9.315514      1.237658       11.10496  209.1435 80.80186 173.2914 78.11335 35.85208       112.3861 
1 1 1 -16 19 2  o 285.4315 67.74254 19.76901       7.396495      17.02215       9.411111      24.20705       11.96239  251.4835 82.98966 288.1653 93.49100 -36.68178      125.0114 
1 1 1 -16 19 3  o 109.8553 52.20240 -5.400642      6.052864      -2.283925      7.043455      -14.20253      11.83654  131.1354 60.29348 136.5672 66.81524 -5.431732      89.99767 
1 1 1 -16 19 4  o 201.5202 69.28146 10.00765       6.556029      8.639356       7.527176      14.30770       13.34381  191.4691 72.96763 225.6653 93.36502 -34.19617      118.4960 
1 1 1 -16 19 5  o 299.4659 60.68350 21.33892       6.815672      14.75838       7.780101      43.05502       14.13336  235.2665 75.30001 378.5416 95.99908 -143.2750      122.0079 
1 1 1 -16 19 6  o 126.9336 58.19913 -1.572396      6.500398      -2.848878      7.426222      2.610918       13.44376  129.7989 60.45139 179.0908 82.68691 -49.29192      102.4280 
1 1 1 -16 19 7  o 127.0408 57.59374 -0.5928831     6.137634      5.679086       8.639173      -6.984609      8.721261  171.3835 73.23280 126.2179 60.69613 45.16564       95.11606 
1 1 1 -16 19 8  o 261.2480 64.48411 17.53217       6.502734      12.61686       8.887051      23.19647       9.540153  207.2436 79.21238 277.4756 82.48138 -70.23207      114.3581 
1 1 1 -16 19 9  o 215.0980 67.05781 12.63299       6.207047      15.62234       8.650833      9.461039       8.911134  223.9465 79.39926 185.1391 76.42335 38.80746       110.2033 
1 1 1 -16 19 10 o 132.6461 59.60263 1.178872       6.405762      7.813177       9.152852      -5.190449      8.968201  173.1712 74.70909 127.4686 61.36085 45.70254       96.67783 
1 1 1 -16 19 11 o 169.6325 67.50666 8.068554       6.667802      2.987690       9.422410      13.16516       9.436997  150.6631 69.44333 194.3768 79.25464 -43.71371      105.3740 
1 1 1 -16 19 12 o 104.4666 50.72065 -5.717286      6.463291      -20.90984      8.966746      10.71248       9.324706  95.93561 48.55907 176.4569 75.75928 -80.52133      89.98585 
1 1 1 -16 19 13 o 401.3342 45.32979 38.80371       6.941276      29.74428       9.516955      49.10055       10.14612  286.6996 81.57900 412.5680 65.51508 -125.8684      104.6296 
1 1 1 -16 19 14 o 189.8239 70.21764 13.16541       6.858806      24.32804       9.274875      -0.3062421     10.18909  239.7632 82.40587 131.7362 63.89675 108.0270       104.2762 
1 1 1 -16 19 15 o 156.8830 75.28284 12.88241       13.25731      0.000000       0.000000      12.88241       13.25731  ?        ?        156.8830 75.28284 0.000000       75.28284 
1 1 1 -16 19 16 o 107.7858 51.93560 -1.565248      6.461234      0.3758159      8.191359      -4.761780      10.51176  120.0000 57.98363 116.8126 58.18807 3.187386       82.14593 
1 1 1 -16 20 1  o 244.5867 94.00294 18.34186       12.55866      0.000000       0.000000      18.34186       12.55866  ?        ?        244.5867 94.00294 0.000000       94.00294 
1 1 1 -16 20 2  o 172.1257 69.06224 6.117652       7.037251      0.5818513      8.645396      16.98797       12.11479  152.6059 68.84326 236.4736 91.92579 -83.86777      114.8466 
1 1 1 -16 20 3  o 194.3727 67.01737 9.399394       6.136680      4.209795       6.979424      27.08013       12.88258  159.3096 66.84091 287.1433 97.14016 -127.8337      117.9149 
1 1 1 -16 20 4  o 189.8784 67.77826 9.041254       6.314059      3.813815       7.147165      27.62450       13.47566  156.8145 66.79828 281.8736 99.18735 -125.0591      119.5832 
1 1 1 -16 20 5  o 287.6229 61.25642 20.32343       6.632676      15.68079       7.585310      35.40263       13.67036  238.1365 74.11185 321.2606 99.41245 -83.12407      123.9976 
1 1 1 -16 20 6  o 244.9470 66.44931 15.75294       6.481483      22.80704       7.442695      -6.388249      13.18591  297.7708 66.08617 151.4514 73.27383 146.3195       98.67338 
1 1 1 -16 20 7  f 253.5795 65.72114 17.01847       6.525266      13.14005       7.380448      30.90518       13.96545  213.0445 73.49341 277.8426 100.6013 -64.79805      124.5870 
1 1 1 -16 20 8  o 352.6826 46.77435 28.62713       6.248434      22.75865       8.237749      36.57793       9.588506  279.6872 74.50447 367.0884 69.81059 -87.40121      102.1001 
1 1 1 -16 20 9  o 429.2389 40.72359 41.19010       6.707229      43.08594       9.160594      38.99927       9.847522  411.7262 58.97569 373.7787 70.42315 37.94754       91.85616 
1 1 1 -16 20 10 o 165.5478 65.64328 7.655094       6.283774      14.97853       8.370384      -1.801920      9.511847  207.7360 77.42574 135.3107 64.61661 72.42531       100.8467 
1 1 1 -16 20 11 o 257.5646 64.43439 19.03128       6.429038      12.59574       8.484428      27.70898       9.852176  186.7754 75.51679 273.4483 84.35837 -86.67294      113.2216 
1 1 1 -16 20 12 o 131.0341 59.55897 2.432650       6.618071      5.395062       9.138002      -0.8352718     9.597636  148.8623 68.52966 131.9653 63.51341 16.89699       93.43590 
1 1 1 -16 20 13 o 129.9817 59.32502 2.827879       6.652640      11.81293       9.023496      -7.871644      9.846837  169.3401 73.61518 115.6907 57.40919 53.64935       93.35422 
1 1 1 -16 20 14 o 120.3866 57.01528 0.5567687      7.102989      0.7497666      8.655556      0.1587819      12.42948  126.2962 60.66482 133.5361 65.94398 -7.239891      89.60373 
1 1 1 -16 21 1  o 245.7947 71.85630 16.17359       7.291780      7.362341       8.925692      33.85403       12.64357  181.3177 75.79774 326.3552 94.39471 -145.0374      121.0606 
1 1 1 -16 21 2  o 160.0388 67.72784 4.559050       7.266214      11.37174       8.928353      -8.803764      12.50435  202.3296 78.84269 145.2633 70.53297 57.06635       105.7879 
1 1 1 -16 21 3  o 110.4298 52.17764 -3.903701      5.884450      -7.867607      6.553297      12.59565       13.37001  104.6648 50.87579 204.5899 89.26253 -99.92506      102.7431 
1 1 1 -16 21 4  o 119.8735 55.02794 -1.260207      5.835190      -4.983789      6.484663      14.58525       13.37702  111.8827 53.40764 208.8749 90.21474 -96.99215      104.8383 
1 1 1 -16 21 5  o 227.4501 66.84487 14.04102       6.295406      14.58097       7.068066      11.96849       13.84747  226.1639 71.70679 196.0221 87.88703 30.14172       113.4284 
1 1 1 -16 21 6  o 130.7083 58.47430 1.066914       6.094000      4.582388       6.843353      -12.39966      13.39385  152.9057 65.25375 137.3292 67.93530 15.57651       94.19796 
1 1 1 -16 21 7  o 101.3253 49.24719 -6.663316      6.136058      -7.826036      6.840318      -1.872964      13.88425  104.5863 51.08903 154.8080 74.96826 -50.22171      90.72116 
1 1 1 -16 21 8  o 238.2849 66.10065 16.14790       6.331428      15.72429       7.055563      17.89964       14.34769  226.3194 71.63134 199.8703 89.54703 26.44914       114.6722 
1 1 1 -16 21 9  o 195.6501 67.04842 11.64748       6.138143      14.55222       8.203462      7.952637       9.252130  203.3813 76.48275 165.3868 73.12897 37.99452       105.8180 
1 1 1 -16 21 10 o 193.3089 68.16708 12.00653       6.368093      14.39093       8.518867      8.986606       9.587180  195.4241 76.76607 165.5960 73.76522 29.82814       106.4628 
1 1 1 -16 21 11 o 134.6480 59.88595 3.562393       6.293190      -0.8570397     8.278184      9.613690       9.686705  126.2546 60.28886 163.5837 73.41350 -37.32909      94.99625 
1 1 1 -16 21 12 o 291.1183 60.33681 24.28845       6.597419      34.40489       8.857870      11.68459       9.887062  325.5566 71.97373 166.4039 74.45956 159.1526       103.5589 
1 1 1 -16 22 1  o 132.9970 60.72159 -0.3244580     6.976907      0.2911485E-01  8.564390      -1.022061      12.02987  144.3974 66.42592 157.6976 74.53985 -13.30022      99.84283 
1 1 1 -16 22 2  o 219.9536 72.69657 13.85598       7.220369      20.84792       8.852715      -0.3731528E-01 12.47901  262.4647 79.78121 160.4178 75.85415 102.0469       110.0859 
1 1 1 -16 22 3  o 183.3278 63.94891 8.885691       5.595417      10.87919       6.195148      0.5918823E-01  13.03582  198.6698 67.36253 160.7598 76.45507 37.90999       101.8974 
1 1 1 -16 22 4  o 145.2698 61.18572 3.965511       5.885032      7.941413       6.547667      -12.74902      13.42505  173.0680 67.49631 136.6662 67.67963 36.40181       95.58391 
1 1 1 -16 22 5  o 114.5599 53.60084 -2.128658      5.948084      -4.187176      6.642358      6.203109       13.36329  113.1856 54.03609 171.8126 80.37354 -58.62700      96.84939 
1 1 1 -16 22 6  o 108.0238 51.42521 -3.636311      5.926938      -3.405896      6.664185      -4.508266      12.96399  114.8900 54.64738 144.8201 70.65238 -29.93008      89.32018 
1 1 1 -16 22 7  o 133.1578 58.76812 2.507355       5.947768      0.6214123      6.614896      10.46795       13.59038  128.0842 58.72035 176.2145 81.97163 -48.13028      100.8337 
1 1 1 -16 22 8  o 185.9953 68.69960 10.95363       6.560627      11.77930       7.403923      7.935830       14.15480  187.6415 72.16305 166.2520 79.23494 21.38950       107.1713 
1 1 1 -16 22 9  o 250.6050 69.80039 19.64621       7.045030      19.57379       7.996899      19.89724       14.88895  235.7989 76.43381 189.6472 87.36826 46.15167       116.0833 
1 1 1 -15 0  1  o 147.5716 78.53413 6.240503       6.093802      6.240503       6.093802      6.240503       6.093802  147.5716 78.53413 147.5716 78.53413 0.000000       0.000000 
1 1 1 -15 0  2  o 148.1705 78.93572 6.288024       6.162436      6.288024       6.162436      6.288024       6.162436  148.1705 78.93572 148.1705 78.93572 0.000000       0.000000 
1 1 1 -15 0  3  f 1144.902 24.57695 255.4507       10.91623      255.4507       10.91623      255.4507       10.91623  1144.902 24.57695 1144.902 24.57695 -0.000000      0.000000 
1 1 1 -15 0  4  o 777.1352 28.17060 118.0775       8.476648      118.0775       8.476648      118.0775       8.476648  777.1352 28.17060 777.1352 28.17060 0.000000       0.000000 
1 1 1 -15 0  5  o 104.6492 67.97884 -0.3148695     6.613622      -0.3148695     6.613622      -0.3148695     6.613622  104.6492 67.97884 104.6492 67.97884 -0.000000      0.000000 
1 1 1 -15 0  6  o 540.4668 39.94165 57.97372       8.278207      57.97372       8.278207      57.97372       8.278207  540.4668 39.94165 540.4668 39.94165 0.000000       0.000000 
1 1 1 -15 0  7  o 208.2730 91.20583 12.36808       7.692517      12.36808       7.692517      12.36808       7.692517  208.2730 91.20583 208.2730 91.20583 -0.000000      0.000000 
1 1 1 -15 0  8  o 996.3459 28.24638 193.8073       10.90965      193.8073       10.90965      193.8073       10.90965  996.3459 28.24638 996.3459 28.24638 0.000000       0.000000 
1 1 1 -15 0  9  o 104.4954 70.36788 -3.330460      8.197648      -3.330460      8.197648      -3.330460      8.197648  104.4954 70.36788 104.4954 70.36788 0.000000       0.000000 
1 1 1 -15 0  10 o 256.8532 98.54442 17.87351       9.292335      17.87351       9.292335      17.87351       9.292335  256.8532 98.54442 256.8532 98.54442 0.000000       0.000000 
1 1 1 -15 0  11 o 857.4976 34.34142 144.1717       11.39446      144.1717       11.39446      144.1717       11.39446  857.4976 34.34142 857.4976 34.34142 -0.000000      0.000000 
1 1 1 -15 0  12 o 127.1176 82.92475 -0.5830100     9.988749      -0.5830100     9.988749      -0.5830100     9.988749  127.1176 82.92475 127.1176 82.92475 0.000000       0.000000 
1 1 1 -15 0  13 o 96.90820 68.17886 -10.81201      10.00751      -10.81201      10.00751      -10.81201      10.00751  96.90820 68.17886 96.90820 68.17886 -0.000000      0.000000 
1 1 1 -15 0  14 o 145.9930 91.09943 3.142122       10.53481      3.142122       10.53481      3.142122       10.53481  145.9930 91.09943 145.9930 91.09943 0.000000       0.000000 
1 1 1 -15 0  15 o 226.5687 110.3459 15.59832       11.42056      15.59832       11.42056      15.59832       11.42056  226.5687 110.3459 226.5687 110.3459 0.000000       0.000000 
1 1 1 -15 0  16 o 654.4120 49.98065 85.80194       12.53188      85.80194       12.53188      85.80194       12.53188  654.4120 49.98065 654.4120 49.98065 -0.000000      0.000000 
1 1 1 -15 0  17 f 569.1967 66.40961 67.04971       14.15779      67.04971       14.15779      67.04971       14.15779  569.1967 66.40961 569.1967 66.40961 -0.000000      0.000000 
1 1 1 -15 0  18 o 573.2739 103.7582 73.51181       20.85443      73.51181       20.85443      73.51181       20.85443  573.2739 103.7582 573.2739 103.7582 -0.000000      0.000000 
1 1 1 -15 0  19 o 220.8581 120.6143 15.30072       14.72671      15.30072       14.72671      15.30072       14.72671  220.8581 120.6143 220.8581 120.6143 -0.000000      0.000000 
1 1 1 -15 0  20 o 125.7810 85.43495 -5.254396      12.60590      -5.254396      12.60590      -5.254396      12.60590  125.7810 85.43495 125.7810 85.43495 -0.000000      0.000000 
1 1 1 -15 0  21 o 419.2908 89.21095 40.53637       12.76850      40.53637       12.76850      40.53637       12.76850  419.2908 89.21095 419.2908 89.21095 -0.000000      0.000000 
1 1 1 -15 0  22 o 172.7870 109.7847 5.564476       16.07019      5.564476       16.07019      5.564476       16.07019  172.7870 109.7847 172.7870 109.7847 0.000000       0.000000 
1 1 1 -15 0  23 o 165.2061 106.7457 4.089098       16.01739      4.089098       16.01739      4.089098       16.01739  165.2061 106.7457 165.2061 106.7457 0.000000       0.000000 
1 1 1 -15 0  24 o 212.4828 108.1454 15.51233       11.20076      15.51233       11.20076      15.51233       11.20076  212.4828 108.1454 212.4828 108.1454 0.000000       0.000000 
1 1 1 -15 0  25 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -15 0  26 o 179.9486 98.21832 11.68210       9.759398      11.68210       9.759398      11.68210       9.759398  179.9486 98.21832 179.9486 98.21832 0.000000       0.000000 
1 1 1 -15 0  27 o 179.6110 98.39671 12.22867       9.836376      12.22867       9.836376      12.22867       9.836376  179.6110 98.39671 179.6110 98.39671 -0.000000      0.000000 
1 1 1 -15 0  28 o 124.6291 81.27451 2.792259       9.583314      2.792259       9.583314      2.792259       9.583314  124.6291 81.27451 124.6291 81.27451 -0.000000      0.000000 
1 1 1 -15 1  1  o 582.4066 22.35945 66.22121       5.057261      74.96162       7.387515      58.51268       6.937748  618.1638 30.77279 544.7846 32.94682 73.37921       45.08278 
1 1 1 -15 1  2  o 613.8314 22.25514 73.57422       5.305269      72.29565       7.271918      75.02911       7.757134  606.1218 30.99676 617.1050 32.48224 -10.98322      44.89872 
1 1 1 -15 1  3  o 265.0058 44.87817 14.31834       4.453832      21.46670       6.402435      7.615333       6.199790  323.4303 52.79427 198.3658 67.38714 125.0645       85.60526 
1 1 1 -15 1  4  o 547.5559 24.94090 58.66569       5.303573      63.93951       7.475729      53.32172       7.525286  568.8072 33.99801 518.2065 37.65036 50.60065       50.72883 
1 1 1 -15 1  5  o 404.1696 33.88926 32.40548       5.270187      24.37159       7.349900      40.90731       7.560920  343.0770 57.17720 451.5084 43.66544 -108.4315      71.94375 
1 1 1 -15 1  6  o 743.6327 21.89038 108.0732       6.321786      102.0651       8.930376      114.1082       8.950370  720.0580 31.93554 761.8877 30.24977 -41.82965      43.98780 
1 1 1 -15 1  7  o 308.6181 47.20360 19.46955       5.477665      16.59974       7.967587      22.04165       7.543015  277.0612 73.01989 323.4279 62.31371 -46.36667      95.99429 
1 1 1 -15 1  8  o 410.8037 54.77739 34.74833       8.521271      34.74833       8.521271      0.000000       0.000000  410.8037 54.77739 ?        ?        0.000000       54.77739 
1 1 1 -15 1  9  o 775.8267 34.02858 119.0296       10.25266      119.0296       10.25266      0.000000       0.000000  775.8267 34.02858 ?        ?        0.000000       34.02858 
1 1 1 -15 1  10 o 239.8035 65.13889 12.38389       6.223584      9.828978       9.143044      14.58974       8.495536  224.4230 81.37798 258.1051 78.08812 -33.68207      112.7836 
1 1 1 -15 1  11 o 197.0928 70.41742 7.501262       6.816822      -2.645072      9.929177      16.54760       9.375513  164.9105 74.14290 271.7364 81.99252 -106.8259      110.5439 
1 1 1 -15 1  12 f 671.4539 29.70940 89.16537       7.747079      87.82688       11.11508      90.42989       10.80361  658.1867 43.73349 669.1263 41.78410 -10.93958      60.48577 
1 1 1 -15 1  13 o 580.9221 33.79488 67.48873       7.591300      60.33656       10.70638      74.71984       10.76530  538.7457 51.81075 603.8763 46.25566 -65.13062      69.45458 
1 1 1 -15 1  14 o 914.5672 25.50142 165.1696       9.057494      154.8536       12.74026      175.7120       12.87934  877.1724 37.39946 936.0741 35.42871 -58.90167      51.51614 
1 1 1 -15 1  15 f 494.1331 43.19615 50.27553       8.205981      50.90076       11.70200      49.67061       11.51039  481.4882 64.17986 475.7974 63.90897 5.690765       90.57268 
1 1 1 -15 1  16 o 328.4340 92.68147 27.68223       12.33652      27.68223       12.33652      0.000000       0.000000  328.4340 92.68147 ?        ?        0.000000       92.68147 
1 1 1 -15 1  17 o 407.8114 73.54114 38.88099       11.21861      81.44708       20.71426      21.21334       13.34526  558.4963 99.13486 280.3826 98.70157 278.1137       139.8918 
1 1 1 -15 1  18 o 218.2344 93.69785 8.867810       14.26392      13.87325       19.89920      3.577915       20.45682  245.4653 107.9481 220.2760 101.8063 25.18927       148.3823 
1 1 1 -15 1  19 o 133.2882 65.05636 -13.83771      11.02754      -16.70109      13.45942      -7.990375      19.23386  144.3273 70.74611 187.6641 90.21766 -43.33678      114.6483 
1 1 1 -15 1  20 o 165.5945 72.47017 3.128709       8.872931      1.920312       12.99911      4.182867       12.14121  179.7139 82.36275 183.7045 82.33430 -3.990585      116.4584 
1 1 1 -15 1  21 o 113.9341 55.92591 -11.47508      8.504344      -14.35215      11.96143      -8.534091      12.09357  132.3186 65.21902 143.8603 69.73955 -11.54176      95.48363 
1 1 1 -15 1  22 o 182.6620 80.23227 8.982920       10.96359      5.087963       15.45835      12.92510       15.55179  177.4689 84.06730 196.7051 90.12685 -19.23611      123.2484 
1 1 1 -15 1  23 o 265.6092 92.39005 28.79352       11.67536      17.13105       16.15655      41.54012       16.89081  192.9216 89.62105 268.6920 107.2812 -75.77040      139.7898 
1 1 1 -15 1  24 o 129.3140 60.89284 0.4125409      7.891235      6.241453       10.87950      -6.058547      11.46315  154.2263 72.26549 128.6785 63.50459 25.54778       96.20361 
1 1 1 -15 1  25 o 190.0205 73.35828 15.14661       7.673729      6.146136       10.77573      24.40748       10.93051  143.6116 68.63479 207.8360 85.08207 -64.22441      109.3147 
1 1 1 -15 1  26 o 160.0531 67.78185 12.06390       7.286062      4.839974       10.05164      20.06192       10.57648  129.4856 62.95644 171.3024 76.80593 -41.81677      99.31094 
1 1 1 -15 1  27 o 123.5704 57.95420 6.242519       7.024499      1.307835       10.23398      10.63847       9.659204  113.5732 56.70769 131.5582 63.41806 -17.98508      85.07416 
1 1 1 -15 1  28 o 121.7343 56.99570 8.077156       6.744706      13.01021       9.602064      3.272691       9.476091  125.8295 61.25927 108.1467 54.08331 17.68281       81.71721 
1 1 1 -15 2  1  o 1317.613 16.93399 338.1585       8.665133      334.7888       12.03709      341.7830       12.48381  1309.099 23.67670 1322.488 24.30679 -13.38867      33.93238 
1 1 1 -15 2  2  f 253.1364 46.70078 13.12495       4.421855      12.29369       6.016001      14.10175       6.521428  241.7812 63.31963 258.4850 65.02352 -16.70383      90.76031 
1 1 1 -15 2  3  o 908.8478 18.53242 161.0426       6.541108      167.3331       9.191688      154.5885       9.310505  924.7322 25.59477 888.4388 26.98471 36.29346       37.19230 
1 1 1 -15 2  4  o 449.2263 29.32427 39.76508       5.087814      44.54012       7.168148      34.91711       7.222674  472.8790 39.39105 416.5115 45.38692 56.36749       60.09682 
1 1 1 -15 2  5  o 876.2782 19.65103 149.8452       6.687369      144.8260       9.390268      155.0105       9.525928  859.2398 28.14075 889.1136 27.58812 -29.87378      39.40820 
1 1 1 -15 2  6  o 964.1124 19.20868 181.3899       7.192057      178.9393       10.39342      183.6415       9.962467  954.9078 28.02652 967.9106 26.50353 -13.00281      38.57360 
1 1 1 -15 2  7  o 511.1428 40.45656 52.20930       7.965184      0.000000       0.000000      52.20930       7.965184  ?        ?        511.1428 40.45656 0.000000       40.45656 
1 1 1 -15 2  8  o 403.2036 55.23280 33.52855       8.421325      0.000000       0.000000      33.52855       8.421325  ?        ?        403.2036 55.23280 0.000000       55.23280 
1 1 1 -15 2  9  o 644.6165 39.67619 83.00556       9.884274      83.00556       9.884274      0.000000       0.000000  644.6165 39.67619 ?        ?        0.000000       39.67619 
1 1 1 -15 2  10 o 250.5139 64.54540 13.53588       6.318436      5.017710       9.269271      20.92918       8.635580  195.6629 78.99467 308.8254 73.13213 -113.1625      107.6497 
1 1 1 -15 2  11 o 313.5955 58.17099 20.85133       6.823569      28.01483       10.33665      15.31861       9.084186  354.7934 77.21305 262.3177 81.01685 92.47577       111.9178 
1 1 1 -15 2  12 o 393.0916 49.32668 31.95713       7.364331      28.27838       10.59789      35.39213       10.24076  353.3705 79.18722 403.8269 67.69522 -50.45648      104.1790 
1 1 1 -15 2  13 o 728.4207 29.17398 105.1028       8.252889      111.1242       11.98941      99.68055       11.37733  740.2674 41.87601 700.9228 41.99010 39.34460       59.30235 
1 1 1 -15 2  14 o 491.0131 41.16993 49.19211       7.778107      48.87402       11.23554      49.48486       10.77850  475.1917 62.39104 480.7480 58.96783 -5.556244      85.84782 
1 1 1 -15 2  15 o 1047.780 24.32730 216.8385       9.899014      235.1929       14.41792      200.4711       13.61518  1082.226 34.30494 998.3638 35.11612 83.86230       49.09146 
1 1 1 -15 2  16 o 318.8312 72.51162 23.68014       8.775585      35.53680       13.01276      13.78976       11.88489  376.3494 90.20755 242.4534 91.85697 133.8960       128.7443 
1 1 1 -15 2  17 o 458.6649 61.66314 46.70681       10.70545      46.80687       19.15924      46.66139       12.90858  393.4202 116.8738 442.8890 77.89466 -49.46881      140.4530 
1 1 1 -15 2  18 o 158.7327 76.92949 -14.10115      14.69227      -37.38273      21.51002      6.260505       20.11598  162.1842 81.16301 225.2433 102.9419 -63.05907      131.0895 
1 1 1 -15 2  19 f 185.7452 81.25255 4.427301       11.14274      -16.27225      13.53466      47.96841       19.62983  145.3347 71.17731 370.9073 119.7024 -225.5726      139.2655 
1 1 1 -15 2  20 o 232.7707 81.65553 14.91855       9.129134      1.972472       12.81709      28.24921       13.00607  178.7222 81.86258 299.1466 97.50536 -120.4244      127.3137 
1 1 1 -15 2  21 o 220.1786 79.39852 14.08474       8.686212      16.79356       11.87341      10.96573       12.74072  226.7215 90.12798 200.5223 87.32180 26.19917       125.4916 
1 1 1 -15 2  22 o 211.0142 87.17281 15.89234       11.60743      12.99307       16.83568      18.51914       16.02508  195.8855 91.15990 211.3042 94.65559 -15.41872      131.4146 
1 1 1 -15 2  23 o 210.8750 87.87990 19.20167       11.94514      26.48518       16.35948      10.88402       17.48233  216.8582 96.49728 178.0167 85.68818 38.84158       129.0511 
1 1 1 -15 2  24 o 181.6737 73.63816 12.31765       8.089320      3.325236       11.05259      22.69159       11.87129  146.2877 69.80174 210.2889 87.61938 -64.00124      112.0243 
1 1 1 -15 2  25 o 112.6373 54.61895 -2.533957      7.432037      -14.51962      10.22683      10.88027       10.81914  105.1307 53.05165 155.4969 72.60217 -50.36620      89.91970 
1 1 1 -15 2  26 o 134.5921 61.53072 6.753119       7.193763      4.808152       10.07373      8.777104       10.27633  128.8043 62.71590 137.7589 66.15223 -8.954559      91.15592 
1 1 1 -15 2  27 o 125.0061 58.25890 6.738547       6.916028      7.045202       9.728351      6.425198       9.833986  122.9540 60.24363 121.6764 59.80981 1.277588       84.89116 
1 1 1 -15 2  28 o 101.9947 50.29430 1.219799       7.138825      -13.58119      10.16597      15.61917       10.02710  90.28616 46.22730 129.4786 62.93602 -39.19241      78.08909 
1 1 1 -15 3  1  o 753.1328 19.00557 110.5691       5.558791      116.0396       7.762867      104.8120       7.963612  770.2448 25.95168 731.5936 28.02930 38.65112       38.19857 
1 1 1 -15 3  2  o 566.9854 23.88049 62.82478       5.258271      61.12220       7.247239      64.71740       7.641014  556.5099 33.69172 572.4695 34.53093 -15.95959      48.24434 
1 1 1 -15 3  3  o 105.4910 48.55770 -3.276576      4.586026      -6.309792      6.405004      -0.8569229E-01 6.569361  117.2898 55.11440 147.0969 63.37708 -29.80708      83.98959 
1 1 1 -15 3  4  o 163.1358 58.12914 4.736506       4.642288      11.63060       6.867731      -1.063771      6.299399  235.3786 69.98496 138.7610 60.88608 96.61760       92.76319 
1 1 1 -15 3  5  o 470.9768 28.73366 43.68763       5.230413      45.74369       7.794656      42.00352       7.054453  478.0927 42.42205 458.7507 39.99678 19.34198       58.30414 
1 1 1 -15 3  6  o 192.5852 60.94114 7.525093       5.106987      8.160055       7.375934      6.940387       7.078014  207.3811 73.33807 196.6043 71.55322 10.77675       102.4614 
1 1 1 -15 3  7  o 766.4295 22.38083 114.8770       6.661568      118.7344       10.03843      111.8416       8.904868  775.8533 33.31640 753.9765 30.41177 21.87683       45.10940 
1 1 1 -15 3  8  o 265.4551 80.52594 15.31834       9.025468      15.31834       9.025468      0.000000       0.000000  265.4551 80.52594 ?        ?        0.000000       80.52594 
1 1 1 -15 3  9  o 939.2526 22.06823 172.6520       8.049667      172.8727       11.92977      172.4676       10.90678  935.4224 32.83950 935.6468 30.01627 -0.2244263     44.49055 
1 1 1 -15 3  10 o 595.7552 30.62439 70.22827       7.061422      77.77901       10.74566      64.48932       9.368172  620.5582 44.89153 565.7244 42.96136 54.83374       62.13637 
1 1 1 -15 3  11 o 429.0343 42.18335 37.29109       6.937610      25.15393       9.901772      48.99440       9.723191  335.2343 77.59142 487.2584 52.19547 -152.0241      93.51361 
1 1 1 -15 3  12 o 217.0089 69.81304 10.11675       6.681057      15.64491       10.01345      5.681258       8.969413  262.5176 85.55484 194.9479 78.05727 67.56964       115.8126 
1 1 1 -15 3  13 o 190.7919 71.04668 6.857030       7.044832      9.557232       10.33237      4.511253       9.630421  221.8744 85.26693 191.1366 79.21761 30.73773       116.3868 
1 1 1 -15 3  14 o 140.4944 63.66712 -2.523126      7.491619      -6.646171      10.67159      1.483266       10.51954  154.2606 72.05193 181.4226 79.16546 -27.16208      107.0451 
1 1 1 -15 3  15 o 323.1291 64.63078 23.31413       7.827118      10.20393       11.23882      35.66177       10.90707  224.0279 88.11886 394.2313 73.95751 -170.2034      115.0419 
1 1 1 -15 3  16 o 371.4230 61.09578 30.47366       8.506183      15.76714       12.61928      42.71994       11.51547  253.6172 94.96037 432.3956 71.04413 -178.7784      118.5949 
1 1 1 -15 3  17 o 164.0032 74.43610 -1.516466      10.28937      25.68700       19.34647      -12.24637      12.15031  291.7265 115.3375 147.8589 71.23826 143.8676       135.5641 
1 1 1 -15 3  18 o 222.7814 95.23177 10.08088       14.61923      6.606559       20.27636      13.84230       21.09750  225.7419 103.2395 245.5514 109.4007 -19.80951      150.4224 
1 1 1 -15 3  19 f 220.9491 86.61347 12.28214       10.82445      14.56953       12.63687      5.979204       20.97684  233.2730 92.90221 218.4192 101.6829 14.85381       137.7325 
1 1 1 -15 3  20 o 130.1866 61.99443 -6.124350      8.627104      -13.30179      12.50139      0.4015398      11.92047  140.5513 68.74361 169.4463 78.10341 -28.89507      104.0472 
1 1 1 -15 3  21 o 129.3235 61.27751 -4.294991      8.224239      7.512293       11.70435      -15.81020      11.55868  185.3405 82.08660 126.7994 62.79448 58.54104       103.3506 
1 1 1 -15 3  22 o 174.8652 80.21522 6.672544       12.36953      27.63490       17.35180      -14.98706      17.63802  233.9012 101.8801 149.6193 74.66415 84.28191       126.3103 
1 1 1 -15 3  23 o 142.5234 68.71268 -1.624295      11.34795      2.976602       16.41895      -5.832105      15.70190  162.5368 79.34328 147.9263 73.24482 14.61055       107.9822 
1 1 1 -15 3  24 o 127.6479 60.68648 -0.2588443     8.199327      5.967421       11.59024      -6.496630      11.60096  152.5932 72.43104 127.4291 63.07111 25.16403       96.04281 
1 1 1 -15 3  25 o 147.8061 65.78476 7.789001       7.607533      14.13864       10.56072      0.9399168      10.96820  165.0893 75.11458 130.9986 64.13888 34.09065       98.77244 
1 1 1 -15 3  26 f 117.7194 56.35268 2.073203       7.328741      17.38896       10.22148      -14.13015      10.51349  161.3745 73.60744 100.8209 51.19571 60.55362       89.66078 
1 1 1 -15 3  27 o 188.6608 71.73225 19.74909       7.263976      29.26227       10.26341      10.20095       10.28225  186.1674 79.69227 127.7421 62.45025 58.42525       101.2467 
1 1 1 -15 3  28 o 111.8638 53.78092 5.361297       6.837664      5.234574       9.275962      5.512093       10.11875  110.4873 54.97556 110.7294 55.45020 -0.2421188     78.08353 
1 1 1 -15 4  1  o 279.1278 42.62746 15.75685       4.474288      19.30458       6.097507      11.61806       6.585871  306.6470 53.12648 235.7760 68.10720 70.87103       86.37716 
1 1 1 -15 4  2  o 769.2961 19.57542 115.4148       5.848340      119.5899       8.110218      110.8918       8.441318  781.6348 26.71780 752.1620 28.89820 29.47278       39.35666 
1 1 1 -15 4  3  o 145.1046 57.39227 2.518261       4.792171      6.922335       6.952151      -1.468696      6.614738  196.5822 71.01044 140.4090 61.97164 56.17323       94.24949 
1 1 1 -15 4  4  o 454.9861 29.83576 40.80708       5.242662      43.67398       7.541349      38.12563       7.293355  467.4323 41.99144 435.9818 43.66248 31.45053       60.57799 
1 1 1 -15 4  5  o 160.0112 58.65452 4.318463       4.768399      -4.754048      6.976914      12.27104       6.532109  129.7373 59.78284 240.6690 67.27480 -110.9317      89.99937 
1 1 1 -15 4  6  o 684.6656 23.22725 91.69272       6.175957      91.06928       9.103026      92.22443       8.406715  678.4632 34.66439 684.5199 31.62367 -6.056702      46.92203 
1 1 1 -15 4  7  o 499.9734 29.82870 49.32849       5.765364      47.43169       8.841517      50.73166       7.604503  484.2928 47.62598 504.1916 39.14399 -19.89877      61.64809 
1 1 1 -15 4  8  o 257.7964 58.11387 14.05754       5.679054      13.50163       9.183457      14.40177       7.226517  251.7409 81.92705 258.2660 70.20718 -6.525131      107.8939 
1 1 1 -15 4  9  o 134.9991 59.67596 -1.272696      6.156975      -16.62144      9.555511      9.623393       8.051057  122.8319 60.08209 219.4259 76.69902 -96.59400      97.42996 
1 1 1 -15 4  10 o 409.2302 42.47517 33.89531       6.652089      38.05885       10.13050      30.73929       8.820011  423.9805 63.47835 381.1748 61.69004 42.80566       88.51646 
1 1 1 -15 4  11 o 132.1279 59.27579 -2.031643      6.309192      15.90697       9.978699      -13.97877      8.143504  265.8714 85.29774 113.6972 55.58253 152.1743       101.8092 
1 1 1 -15 4  12 o 157.1613 65.62994 2.070763       6.681629      9.981787       9.887443      -4.578306      9.064588  224.3492 84.04510 148.9705 68.45876 75.37866       108.3982 
1 1 1 -15 4  13 o 221.3046 72.79338 10.71849       7.242804      18.97381       10.73714      3.825700       9.811129  282.4836 88.21786 188.5545 79.18697 93.92911       118.5452 
1 1 1 -15 4  14 o 159.4341 68.16792 1.561427       7.493660      -2.598681      11.00666      5.155903       10.23107  169.3134 76.90035 195.8507 81.45036 -26.53726      112.0171 
1 1 1 -15 4  15 o 415.9292 50.49504 36.52929       7.989101      37.49773       11.99450      35.75706       10.71076  398.7857 80.22781 395.7344 72.35943 3.051300       108.0388 
1 1 1 -15 4  16 o 233.5453 81.65433 12.80109       9.125240      40.53189       16.20322      -0.7941855E-01 11.04299  384.5735 105.3717 175.5152 78.60314 209.0582       131.4597 
1 1 1 -15 4  17 o 171.6325 76.29186 0.7847881      10.19960      24.44873       18.30081      -9.877554      12.28437  286.9431 112.5798 153.8497 73.45945 133.0933       134.4266 
1 1 1 -15 4  18 o 478.3300 82.47238 56.98701       14.76691      42.15614       19.37133      77.56153       22.81607  354.4244 119.1217 500.5301 119.1026 -146.1057      168.4500 
1 1 1 -15 4  19 o 133.4044 64.95815 -12.58011      10.80980      -10.68857      12.79618      -17.29383      20.20018  150.4066 72.62677 174.9273 85.93139 -24.52071      112.5116 
1 1 1 -15 4  20 o 391.3907 59.22282 35.93203       8.720389      36.67835       12.42224      35.20689       12.24467  355.4729 89.91937 347.5742 90.00217 7.898712       127.2238 
1 1 1 -15 4  21 o 240.6281 79.48582 17.22312       8.632424      19.39724       11.97736      14.87300       12.45270  236.4323 91.54410 213.4465 89.40448 22.98573       127.9589 
1 1 1 -15 4  22 o 128.4247 63.54219 -12.52863      11.73784      -28.47615      16.58478      3.476864       16.61489  130.9729 66.26464 172.7186 83.23807 -41.74565      106.3935 
1 1 1 -15 4  23 o 142.3927 68.87669 -1.693842      11.63550      -7.655672      16.54098      4.145749       16.37052  146.4364 72.95244 162.9453 79.47282 -16.50888      107.8795 
1 1 1 -15 4  24 o 162.5858 70.07269 9.203294       8.035906      17.27225       10.98235      -0.9532154E-01 11.78951  188.4827 81.57404 138.3311 67.46229 50.15163       105.8560 
1 1 1 -15 4  25 o 133.1625 61.37523 4.549454       7.359359      15.74778       10.19691      -7.625226      10.63214  170.3855 75.97372 114.7247 57.36000 55.66083       95.19546 
1 1 1 -15 4  26 o 131.6048 60.55008 6.555436       7.119864      9.267370       10.29930      4.073192       9.853500  136.0824 65.57027 124.8173 61.04446 11.26502       89.58731 
1 1 1 -15 4  27 o 315.6048 62.74490 35.98239       7.419586      33.41554       10.55377      38.49085       10.43303  196.9179 82.37897 226.6339 86.01568 -29.71596      119.1008 
1 1 1 -15 4  28 o 127.3449 58.53421 9.865594       6.632075      9.836831       9.261358      9.895868       9.501596  118.2044 58.09078 117.8484 58.09465 0.3560257      82.15551 
1 1 1 -15 5  1  o 701.9316 24.79766 96.31449       6.759795      87.73433       11.50025      100.8439       8.355643  663.5044 44.89508 717.1395 30.00187 -53.63507      53.99704 
1 1 1 -15 5  2  o 1074.009 17.68878 224.7794       7.377918      223.6285       10.30951      225.9877       10.56301  1069.419 24.82344 1074.899 25.30417 -5.480103      35.44720 
1 1 1 -15 5  3  o 540.0482 25.15008 57.05790       5.274724      53.39403       7.350459      60.94772       7.573725  519.0069 36.70484 555.0741 35.31787 -36.06720      50.93719 
1 1 1 -15 5  4  o 106.8731 49.48544 -3.823687      4.866246      -3.543675      7.022150      -4.082396      6.749751  135.3214 61.44696 129.9359 59.47596 5.385590       85.51678 
1 1 1 -15 5  5  o 769.6711 21.60294 115.7314       6.457227      116.4804       9.474435      115.0817       8.824015  769.4687 31.70548 765.4481 29.68401 4.020630       43.43245 
1 1 1 -15 5  6  o 721.3313 22.71972 101.7537       6.364522      102.3504       9.596025      101.2851       8.504152  720.1893 34.30968 717.6311 30.51419 2.558228       45.91590 
1 1 1 -15 5  7  o 240.4743 57.87671 12.21981       5.339797      17.61093       8.642158      8.890634       6.791266  284.1385 76.58311 210.2809 70.53280 73.85762       104.1146 
1 1 1 -15 5  8  o 192.0007 65.05878 7.280462       5.778617      16.06014       9.405478      1.956849       7.323941  270.7102 82.22239 164.5376 68.71133 106.1727       107.1530 
1 1 1 -15 5  9  o 218.0550 64.84138 10.09764       5.895089      23.11419       10.13380      3.439695       7.247599  321.6171 81.13920 172.1610 69.72995 149.4561       106.9852 
1 1 1 -15 5  10 o 242.2383 65.64615 12.73196       6.329630      10.52094       9.778858      14.32627       8.303823  230.0511 84.04649 254.8841 77.22181 -24.83304      114.1360 
1 1 1 -15 5  11 f 375.6158 46.41544 28.97961       6.626661      30.47949       9.893237      27.75909       8.924483  372.7370 70.93673 357.6417 66.70890 15.09537       97.37606 
1 1 1 -15 5  12 o 380.7572 47.62921 29.98618       6.888785      22.85353       10.69027      35.05127       9.008590  312.0623 85.62412 405.9406 58.86019 -93.87833      103.9039 
1 1 1 -15 5  13 o 469.1809 41.48742 44.89256       7.481442      50.68950       11.45666      40.58261       9.878583  485.0479 62.25687 434.8771 60.09862 50.17072       86.53186 
1 1 1 -15 5  14 o 411.2374 49.93266 35.49484       7.810954      39.18486       11.87667      32.68225       10.36892  412.8084 76.91279 379.0815 73.08190 33.72690       106.0968 
1 1 1 -15 5  15 o 235.1364 76.65227 12.81920       8.037732      13.68469       11.91461      12.09634       10.88868  243.5241 92.04151 232.9375 88.00178 10.58664       127.3419 
1 1 1 -15 5  16 o 247.4359 81.65951 14.79722       9.111790      11.63223       16.01970      16.31084       11.07836  239.1340 100.8468 256.0052 89.94339 -16.87114      135.1292 
1 1 1 -15 5  17 o 125.3365 61.04219 -13.12245      9.559774      -20.98892      15.54974      -8.342614      12.12103  153.3410 75.34079 156.0282 74.06429 -2.687195      105.6492 
1 1 1 -15 5  18 o 475.6014 62.86815 51.52711       11.32724      32.61834       13.00914      110.8002       23.03273  343.4254 94.54840 645.0652 94.76704 -301.6398      133.8663 
1 1 1 -15 5  19 o 530.5213 55.60963 63.21294       11.28693      68.57656       13.15774      48.27134       21.96094  541.6488 63.77297 343.3563 125.8734 198.2925       141.1067 
1 1 1 -15 5  20 o 288.4333 76.52544 22.45065       8.713311      24.55938       12.13679      20.20775       12.51697  275.6147 94.28134 248.5592 94.24454 27.05548       133.3079 
1 1 1 -15 5  21 o 137.9688 64.35198 -1.626137      8.465383      -6.851356      11.47764      4.607105       12.53596  141.3870 68.39450 174.5033 80.30859 -33.11630      105.4859 
1 1 1 -15 5  22 o 162.9459 75.94755 4.071841       11.75753      27.02321       17.95423      -13.16081      15.55745  222.7831 99.96661 142.5568 70.97553 80.22632       122.6004 
1 1 1 -15 5  23 o 157.0304 73.54335 5.348074       11.24408      2.136815       17.42991      7.637029       14.71553  159.0278 78.44958 165.7831 79.49045 -6.755371      111.6829 
1 1 1 -15 5  24 o 186.5791 74.03690 13.87478       7.998909      9.985036       11.20003      17.92430       11.42774  159.9798 74.41786 186.0193 81.80503 -26.03952      110.5897 
1 1 1 -15 5  25 o 144.8903 64.69746 7.760588       7.422868      -1.972095      10.57240      17.22234       10.42421  122.2752 60.46465 171.9957 76.74465 -49.72046      97.70218 
1 1 1 -15 5  26 o 117.4990 55.79899 2.996575       6.894199      0.3085524      9.705212      5.734650       9.795151  116.0856 57.49786 126.7209 61.73233 -10.63522      84.36163 
1 1 1 -15 5  27 o 111.6776 55.56364 2.576752       9.468130      2.576752       9.468130      0.000000       0.000000  111.6776 55.56364 ?        ?        0.000000       55.56364 
1 1 1 -15 5  28 o 97.01844 48.02227 -0.7462966E-01 6.729208      -5.104241      9.439210      5.123237       9.595796  95.36428 48.43367 108.8164 54.41903 -13.45207      72.85088 
1 1 1 -15 6  1  o 253.8010 54.55823 13.38115       5.217540      22.42058       8.495391      7.906537       6.611339  325.7021 69.29319 203.0343 69.58482 122.6677       98.20180 
1 1 1 -15 6  2  o 485.8026 28.22371 46.40004       5.301834      36.64178       7.422641      56.56449       7.575547  427.0953 45.44962 534.3713 36.72719 -107.2760      58.43419 
1 1 1 -15 6  3  o 854.7728 22.27622 142.7232       7.394693      147.9057       12.47357      139.9148       9.182210  865.5895 37.10656 844.8670 27.98536 20.72253       46.47663 
1 1 1 -15 6  4  o 518.1264 27.65136 52.77780       5.543801      51.49915       8.057653      53.92713       7.639302  507.9982 41.19793 520.9321 38.02374 -12.93387      56.06313 
1 1 1 -15 6  5  o 279.3538 49.28827 16.06068       5.151736      22.81440       7.859003      10.97186       6.821888  329.0965 63.79472 228.9506 70.12439 100.1459       94.80083 
1 1 1 -15 6  6  o 260.4716 55.13504 14.20804       5.403368      8.252518       8.296117      18.59571       7.120851  212.0797 77.42317 296.0014 63.82349 -83.92174      100.3384 
1 1 1 -15 6  7  o 305.3056 48.18132 19.13574       5.523221      19.25526       8.855972      19.05966       7.065778  296.6305 76.40834 299.6214 62.73534 -2.990906      98.86333 
1 1 1 -15 6  8  o 287.6317 54.49315 17.31866       5.864219      15.56193       9.680866      18.33690       7.370328  266.6017 83.84943 291.8218 66.51408 -25.22012      107.0273 
1 1 1 -15 6  9  o 171.9205 65.02364 4.870682       5.949025      8.770185       9.637074      2.469824       7.561778  219.2256 82.79737 168.6640 70.07375 50.56154       108.4700 
1 1 1 -15 6  10 o 566.2606 31.15306 63.61971       6.824510      60.85807       10.49961      65.63988       8.980167  544.6619 50.20353 570.9345 40.76951 -26.27258      64.67262 
1 1 1 -15 6  11 o 674.0537 28.03009 89.70832       7.337480      80.49342       11.23385      96.56449       9.690001  628.0615 46.38553 694.7449 36.03832 -66.68347      58.73992 
1 1 1 -15 6  12 o 367.4239 50.98885 28.23828       7.079514      42.30448       10.69797      17.27880       9.442957  442.5975 64.10578 273.0730 82.26244 169.5245       104.2912 
1 1 1 -15 6  13 o 198.0365 70.98619 7.993792       6.932760      -13.20182      10.69480      23.35561       9.104813  137.8720 66.52985 319.2742 74.74940 -181.4022      100.0684 
1 1 1 -15 6  14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -15 6  15 o 253.5950 73.91413 15.06163       7.725742      13.34687       11.78819      16.35270       10.22871  241.0357 91.44352 259.0814 86.56347 -18.04573      125.9172 
1 1 1 -15 6  16 o 473.4938 52.27142 47.92054       9.451597      54.72565       16.49345      44.59314       11.53310  462.0323 95.09064 441.9683 69.48673 20.06406       117.7737 
1 1 1 -15 6  17 o 148.2953 68.84779 -4.184911      9.511351      16.54654       16.70540      -14.12892      11.56972  252.5665 104.4778 138.8121 67.50316 113.7543       124.3876 
1 1 1 -15 6  18 o 267.6317 88.30848 19.49963       10.65620      18.66537       12.66613      21.52057       19.71378  257.0160 95.35175 261.9872 111.2526 -4.971130      146.5233 
1 1 1 -15 6  19 o 107.5790 54.12863 -24.94961      10.22612      -31.93742      11.98622      -6.258695      19.60320  111.7698 56.52345 186.0842 89.86337 -74.31435      106.1618 
1 1 1 -15 6  20 o 164.3483 72.10989 3.827045       8.834999      -0.2446030     12.35896      8.082438       12.63475  165.5749 77.40430 192.2079 85.19971 -26.63303      115.1105 
1 1 1 -15 6  21 o 219.9395 78.83279 14.89336       8.550004      26.68455       11.81757      1.941660       12.38548  273.2341 93.03528 164.8045 77.18478 108.4296       120.8845 
1 1 1 -15 6  22 o 488.7744 67.52222 65.29045       12.47464      77.58613       19.20949      56.32363       16.40434  417.3722 114.8853 359.0442 108.4837 58.32797       158.0105 
1 1 1 -15 6  23 o 395.9098 68.99633 45.92578       10.22279      43.22262       18.15037      47.18171       12.37174  242.0692 104.8174 357.5088 89.35468 -115.4396      137.7350 
1 1 1 -15 6  24 o 190.9819 73.50015 14.62361       7.684711      17.85023       11.15131      11.70544       10.60491  183.5698 80.76681 163.4233 74.71005 20.14651       110.0221 
1 1 1 -15 6  25 o 92.56742 46.34515 -9.620412      7.050684      -6.705009      10.68945      -11.86559      9.380613  113.6433 56.92157 101.6363 51.22720 12.00703       76.57866 
1 1 1 -15 6  26 o 83.47272 42.13493 -10.76027      6.479409      -14.54100      9.788956      -7.812229      8.644014  95.11323 48.40590 98.83350 49.73301 -3.720276      69.40103 
1 1 1 -15 6  27 o 84.23892 42.58424 -9.171450      6.764162      -5.554687      9.325738      -13.18647      9.825776  98.64394 49.88219 91.90303 46.92531 6.740913       68.48516 
1 1 1 -15 7  1  o 757.4730 23.86860 112.1397       7.021373      116.8374       11.51015      109.3556       8.861013  768.2028 38.70562 746.4626 30.56661 21.74017       49.31981 
1 1 1 -15 7  2  o 759.9590 20.71940 112.7180       6.114986      103.2235       8.318573      123.8805       9.019708  725.3479 29.53075 794.7025 29.22536 -69.35455      41.54741 
1 1 1 -15 7  3  o 218.1939 70.55159 9.683650       6.816602      0.000000       0.000000      9.683650       6.816602  ?        ?        218.1939 70.55159 0.000000       70.55159 
1 1 1 -15 7  4  o 1367.885 20.87106 365.3952       11.08721      366.5272       19.13104      364.8227       13.60487  1362.306 36.16063 1364.835 25.66766 -2.529297      44.34434 
1 1 1 -15 7  5  o 557.8473 28.06436 61.23260       6.060509      53.91976       9.063319      67.14705       8.150825  517.7709 45.53658 581.7262 36.25945 -63.95526      58.20934 
1 1 1 -15 7  6  o 500.3501 30.97231 49.47716       5.988735      51.00158       9.226913      48.36752       7.872196  502.0597 47.90431 491.2415 41.65663 10.81827       63.48306 
1 1 1 -15 7  7  o 181.0677 63.16387 6.240272       5.458916      4.248848       8.761165      7.504031       6.979307  188.8196 76.59998 199.3059 71.24708 -10.48633      104.6122 
1 1 1 -15 7  8  o 266.1588 56.09221 14.97356       5.615067      21.97903       9.347441      11.01846       7.023490  315.1013 77.03225 227.6244 71.39223 87.47696       105.0277 
1 1 1 -15 7  9  o 191.4554 66.05524 7.263769       5.962220      -6.396028      9.295895      16.81009       7.771183  146.2631 67.95733 276.1694 71.79259 -129.9062      98.85532 
1 1 1 -15 7  10 o 310.6222 53.51778 20.28643       6.222889      8.454449       9.917281      27.97048       7.992069  216.6415 83.46276 363.3942 58.62611 -146.7527      101.9954 
1 1 1 -15 7  11 o 440.4301 38.74455 39.19310       6.559545      35.84411       10.65882      41.23466       8.322106  403.7563 70.54474 446.9218 48.73853 -43.16550      85.74383 
1 1 1 -15 7  12 f 264.0329 67.77303 15.58405       6.984517      19.22478       10.87431      13.02733       9.112729  284.1761 88.78501 241.1229 81.69930 43.05312       120.6547 
1 1 1 -15 7  13 o 206.4440 72.43331 9.020815       7.183638      -1.278812      11.17378      16.27703       9.378739  175.3153 78.75121 263.0664 82.49705 -87.75111      114.0505 
1 1 1 -15 7  14 o 258.3476 83.49493 15.91863       9.548035      0.000000       0.000000      15.91863       9.548035  ?        ?        258.3476 83.49493 0.000000       83.49493 
1 1 1 -15 7  15 o 198.9951 77.32967 7.649230       8.570708      40.54849       14.93421      -8.507914      10.46578  395.3949 97.79959 145.5771 69.02141 249.8178       119.7026 
1 1 1 -15 7  16 o 406.7873 61.13843 36.74966       9.359749      34.99501       15.07901      37.84943       11.93789  354.6916 103.2291 395.6384 80.43689 -40.94681      130.8676 
1 1 1 -15 7  17 o 420.2500 57.31894 39.10853       9.110798      46.71973       13.75331      33.15657       12.16214  430.1385 85.34501 356.8522 88.25203 73.28622       122.7689 
1 1 1 -15 7  18 o 171.2201 76.24525 1.951893       10.23354      5.323913       12.16763      -6.198821      18.91728  192.6125 84.56492 188.5704 90.33999 4.042114       123.7438 
1 1 1 -15 7  19 o 480.8168 67.34708 56.22561       12.23049      56.22561       12.23049      0.000000       0.000000  480.8168 67.34708 ?        ?        0.000000       67.34708 
1 1 1 -15 7  20 o 189.2818 75.88537 9.263515       8.489069      23.11778       11.97930      -4.711963      12.03159  260.2421 93.30881 151.1843 72.32805 109.0578       118.0588 
1 1 1 -15 7  21 o 147.1672 67.92683 0.8800899      9.062256      3.993929       11.31339      -4.695044      15.13814  165.3985 76.18279 157.1423 76.59420 8.256180       108.0300 
1 1 1 -15 7  22 o 133.3505 65.14959 -6.146381      11.13584      -17.44538      17.70308      1.251783       14.32488  141.0581 71.00467 157.7650 76.33919 -16.70686      104.2561 
1 1 1 -15 7  23 o 128.7536 62.12874 -2.060424      9.325732      7.509006       17.44257      -5.890828      11.03544  161.0848 79.27312 127.6643 62.87030 33.42045       101.1776 
1 1 1 -15 7  24 o 168.3045 69.52045 11.18103       7.381141      22.57309       11.03253      1.949969       9.931149  199.4847 83.88447 133.0657 64.18520 66.41904       105.6236 
1 1 1 -15 7  25 o 136.6850 61.57364 6.797962       6.887434      -0.8063160     10.54355      12.45815       9.096479  120.3294 59.65879 153.5258 69.79911 -33.19648      91.82095 
1 1 1 -15 7  26 o 109.9055 52.53851 1.902667       6.321953      -5.206586      9.809043      6.953956       8.268291  104.8268 52.77785 126.1536 60.24404 -21.32681      80.09274 
1 1 1 -15 7  27 o 82.34712 41.49855 -7.849639      6.142757      -12.51294      9.001736      -3.785636      8.403433  89.04577 45.41811 97.70330 49.14790 -8.657532      66.92026 
1 1 1 -15 8  1  o 575.1563 28.13178 64.84903       6.283637      46.20229       9.460680      79.56802       8.405431  477.5701 51.84285 634.7715 34.22334 -157.2014      62.12019 
1 1 1 -15 8  2  o 821.0740 22.96651 131.7711       7.323276      130.8271       12.11324      132.3150       9.193701  813.3723 38.34802 821.2181 28.82729 -7.845886      47.97482 
1 1 1 -15 8  3  o 599.7401 24.83196 70.40622       5.783650      74.74563       8.220625      66.15295       8.138624  614.7181 34.57547 577.5911 36.47022 37.12708       50.25475 
1 1 1 -15 8  4  o 375.1158 37.77308 28.12258       5.427837      25.03186       7.934070      30.84166       7.441798  345.7970 61.32643 388.8859 50.46484 -43.08884      79.42059 
1 1 1 -15 8  5  o 364.6365 41.00366 26.75693       5.705740      14.20587       8.598460      36.63187       7.626893  256.9909 78.73011 425.2132 46.97044 -168.2223      91.67689 
1 1 1 -15 8  6  o 512.5438 34.51345 52.17841       6.829856      58.22115       13.01743      49.88313       8.022802  527.3517 64.93361 498.4832 41.82938 28.86853       77.24034 
1 1 1 -15 8  7  o 283.2898 52.87218 16.76727       5.602882      8.514006       8.495215      23.12116       7.453864  213.1668 78.26661 330.8700 60.22795 -117.7032      98.75762 
1 1 1 -15 8  8  o 650.7147 25.98876 83.22512       6.567561      71.93533       9.977443      91.85665       8.724092  597.1942 43.31509 681.1206 32.98133 -83.92639      54.44231 
1 1 1 -15 8  9  o 493.5554 33.32941 48.53582       6.350960      45.32065       10.06832      50.66050       8.184686  465.8075 56.83601 500.3727 42.52214 -34.56522      70.98215 
1 1 1 -15 8  10 o 308.8035 55.30051 20.20264       6.388372      23.09157       10.00653      18.21507       8.299954  317.5934 80.90446 284.7258 74.28144 32.86758       109.8329 
1 1 1 -15 8  11 o 220.6089 68.01021 10.64024       6.404861      7.002453       10.42911      12.84309       8.115611  208.8942 83.98264 239.9153 76.91899 -31.02113      113.8842 
1 1 1 -15 8  12 o 172.2911 67.59552 4.697752       6.597448      9.629064       10.77305      1.738490       8.345436  222.9116 86.67699 167.8551 71.85753 55.05649       112.5895 
1 1 1 -15 8  13 o 311.0501 62.56877 21.33473       7.296295      30.72367       11.37823      14.77774       9.508657  359.9764 83.07738 251.4630 83.43962 108.5133       117.7456 
1 1 1 -15 8  14 o 514.5781 41.72167 54.34724       8.265818      58.71009       14.81747      52.37621       9.959455  503.4023 78.34099 497.6075 52.32082 5.794800       94.20605 
1 1 1 -15 8  15 o 145.0450 66.49007 -3.218659      8.478620      19.12852       14.75275      -14.24026      10.36058  270.7862 102.4013 130.8104 63.67296 139.9758       120.5830 
1 1 1 -15 8  16 o 203.8872 79.30611 8.674805       9.021042      3.446406       15.22914      11.50104       11.19683  205.4017 92.12460 224.9871 88.11990 -19.58545      127.4836 
1 1 1 -15 8  17 o 476.7834 48.49249 48.76133       8.853936      51.27311       13.06903      46.63050       12.03723  460.1502 75.77137 441.9986 72.65065 18.15161       104.9734 
1 1 1 -15 8  18 o 362.6310 76.26165 33.27467       10.39931      36.76531       12.53519      25.56834       18.62526  365.1298 89.17068 268.2717 110.5857 96.85803       142.0585 
1 1 1 -15 8  19 o 103.6779 51.66490 -16.52942      8.320038      -8.350591      11.71271      -24.85969      11.82065  144.2647 69.61700 117.4747 58.98313 26.79002       91.24438 
1 1 1 -15 8  20 o 123.5419 59.24157 -5.882619      8.177275      -4.211108      11.62145      -7.521716      11.50821  148.5544 71.07375 140.6485 68.14561 7.905884       98.46472 
1 1 1 -15 8  21 o 384.9849 64.24032 38.81852       9.266149      54.34388       11.79165      13.75288       14.98281  444.6747 70.64429 194.2117 88.79167 250.4629       113.4662 
1 1 1 -15 8  22 o 245.4327 93.34669 27.63570       12.30346      28.52276       18.21146      26.89087       16.68766  210.0244 96.70760 211.9198 95.61926 -1.895447      135.9978 
1 1 1 -15 8  23 o 140.6699 64.40184 4.104848       7.919408      4.247696       11.42421      3.972701       10.98799  147.2316 70.44804 145.9476 69.62780 1.284042       99.05028 
1 1 1 -15 8  24 o 150.6100 65.39536 8.329919       7.104112      6.001161       10.72666      10.14945       9.481611  140.8548 67.62489 153.4126 70.32109 -12.55774      97.56117 
1 1 1 -15 8  25 o 164.1826 66.72731 12.29864       6.662226      3.439617       10.02203      19.31324       8.917938  124.8537 61.16842 180.2407 75.58561 -55.38699      97.23559 
1 1 1 -15 8  26 o 183.0883 67.88536 16.48993       6.418207      22.72532       9.548333      11.35047       8.668718  170.0187 74.77220 135.6102 63.84686 34.40849       98.32244 
1 1 1 -15 8  27 o 104.2953 50.47196 2.336408       6.266136      -3.809640      9.235602      7.578890       8.529738  98.63724 49.85064 117.2920 57.24160 -18.65478      75.90578 
1 1 1 -15 9  1  o 774.6687 24.53498 117.4333       7.381246      143.5802       13.14670      105.3967       8.919838  851.2573 39.76746 732.1050 31.37297 119.1522       50.65287 
1 1 1 -15 9  2  o 719.0766 29.48287 101.5718       8.233279      100.4260       11.84748      102.6420       11.44993  709.1229 43.22699 717.8137 41.24697 -8.690857      59.74852 
1 1 1 -15 9  3  o 830.2043 31.17870 135.6537       10.05243      0.000000       0.000000      135.6537       10.05243  ?        ?        830.2043 31.17870 0.000000       31.17870 
1 1 1 -15 9  4  o 1270.041 18.56815 314.7968       9.158289      307.5013       13.11675      321.7366       12.79287  1251.732 26.98280 1281.000 25.71526 -29.26843      37.27393 
1 1 1 -15 9  5  f 199.6407 62.32065 8.235066       5.359077      -0.7280049     7.854760      16.04089       7.330165  155.6417 68.14817 272.3783 69.16809 -116.7366      97.09994 
1 1 1 -15 9  6  o 610.5448 26.86784 73.24935       6.370569      68.93591       9.668865      76.55840       8.468653  585.5719 42.81427 620.5910 35.28405 -35.01910      55.47996 
1 1 1 -15 9  7  o 615.2765 27.68204 74.50951       6.614490      70.86564       10.38712      76.99505       8.578756  591.7471 45.54927 621.7510 35.67808 -30.00385      57.85898 
1 1 1 -15 9  8  o 390.0958 45.46308 31.07544       6.758249      44.00081       13.83617      27.02543       7.745019  442.5326 83.57182 358.2191 57.62722 84.31351       101.5143 
1 1 1 -15 9  9  o 209.5501 65.43420 9.364246       5.907421      19.11138       9.550570      3.324167       7.518171  289.3839 81.50756 172.0369 70.51034 117.3470       107.7738 
1 1 1 -15 9  10 o 177.8580 66.64011 5.628815       6.216803      -18.31671      10.09720      20.24793       7.889501  123.0620 60.51367 302.3243 68.75047 -179.2623      91.58893 
1 1 1 -15 9  11 o 182.3587 68.85185 5.984052       6.662806      -1.439525      10.84947      10.47892       8.442291  173.8509 77.88078 221.9552 78.46389 -48.10428      110.5531 
1 1 1 -15 9  12 o 180.5779 69.23351 5.739967       6.802016      2.022357       11.01742      8.029811       8.646711  187.2126 81.36378 204.8746 78.17505 -17.66191      112.8335 
1 1 1 -15 9  13 o 405.7448 51.62276 34.75969       7.950139      43.55258       14.49769      30.97851       9.507075  422.3792 91.06336 372.0022 68.32505 50.37704       113.8457 
1 1 1 -15 9  14 o 398.2463 55.99335 34.18430       8.420761      39.65263       14.75798      31.54451       10.25378  392.5517 97.29594 369.2065 74.08922 23.34512       122.2935 
1 1 1 -15 9  15 o 403.1908 58.72990 35.69749       8.925850      45.16273       15.77704      31.24178       10.82476  412.2633 99.64654 359.8851 79.56535 52.37814       127.5150 
1 1 1 -15 9  16 o 524.1240 55.13730 59.93670       11.05467      0.000000       0.000000      59.93670       11.05467  ?        ?        524.1240 55.13730 0.000000       55.13730 
1 1 1 -15 9  17 o 158.9459 69.21037 2.052765       8.002115      7.541508       11.63789      -2.869267      11.02072  200.4720 85.31298 159.9620 74.20941 40.51001       113.0723 
1 1 1 -15 9  18 o 388.1863 66.69749 36.45568       9.692559      50.39028       12.23207      12.94369       15.88903  449.6328 72.51804 220.7705 96.78842 228.8624       120.9416 
1 1 1 -15 9  19 o 119.0302 57.40611 -7.428038      7.936819      1.345387       11.55981      -15.25214      10.91650  166.2476 76.72822 124.5521 61.56234 41.69541       98.37246 
1 1 1 -15 9  20 o 375.7620 68.65920 37.26501       9.650139      41.16144       12.27502      30.96006       15.61456  363.0618 87.98067 263.5766 103.8051 99.48520       136.0739 
1 1 1 -15 9  21 o 430.3895 59.21849 47.33634       9.635823      51.24381       12.26741      41.04204       15.56964  410.9250 79.74734 290.5099 106.0637 120.4151       132.6994 
1 1 1 -15 9  22 o 146.5223 70.28430 1.493652       11.53089      36.49055       16.52790      -31.69400      16.09501  235.7147 101.0219 119.5110 60.93672 116.2037       117.9776 
1 1 1 -15 9  23 o 119.8364 57.27876 -1.004984      7.509422      -14.08246      10.93199      10.67900       10.33315  111.2281 55.96477 161.5397 73.80908 -50.31158      92.62740 
1 1 1 -15 9  24 o 125.2733 58.20730 3.245652       6.820935      0.6633874      10.01384      5.480741       9.316393  125.1647 61.28305 135.4708 64.48671 -10.30611      88.96149 
1 1 1 -15 9  25 f 109.8796 52.84499 0.7696294      6.615211      8.343328       9.899371      -5.341246      8.892121  132.4346 63.93188 104.5267 52.29066 27.90786       82.59297 
1 1 1 -15 9  26 o 88.74183 44.25414 -5.220055      6.151543      -8.795060      9.172875      -2.298175      8.292746  95.73678 48.53011 102.2759 51.06371 -6.539131      70.44625 
1 1 1 -15 10 1  o 230.7631 69.38985 11.21643       6.723388      8.696914       8.139907      16.62592       11.92721  214.6956 76.92259 278.7683 93.47294 -64.07274      121.0548 
1 1 1 -15 10 2  o 285.2100 54.89341 16.96481       5.859450      12.96847       9.580632      19.35288       7.406035  249.5016 83.77425 301.5466 65.14490 -52.04504      106.1225 
1 1 1 -15 10 3  o 372.2439 41.34805 27.90308       5.876377      43.78717       9.897722      19.25607       7.302758  461.0940 56.45277 300.6598 64.47800 160.4342       85.69906 
1 1 1 -15 10 4  o 780.8052 25.34495 119.5760       7.685322      121.7634       9.802543      116.0865       12.38082  785.5351 32.13255 761.6447 42.01965 23.89044       52.89756 
1 1 1 -15 10 5  o 383.4005 38.92623 29.53639       5.715556      32.75405       8.645315      27.03808       7.617860  396.3984 57.86435 360.1868 56.30311 36.21167       80.73613 
1 1 1 -15 10 6  o 410.9449 36.40379 33.79989       5.749630      30.31017       8.806476      36.39258       7.590716  378.5073 62.06165 422.4542 47.06759 -43.94687      77.89099 
1 1 1 -15 10 7  o 407.2835 39.43204 33.43098       6.158887      22.25746       9.413110      41.79477       8.144033  315.5741 77.39668 452.4957 47.03154 -136.9216      90.56607 
1 1 1 -15 10 8  o 637.8536 27.92397 80.24303       6.917134      81.21712       10.52975      79.50359       9.174334  633.7188 43.04032 629.9017 37.67650 3.817078       57.20129 
1 1 1 -15 10 9  o 146.5804 63.25180 0.3732093      6.563801      -10.28787      13.70785      3.544807       7.476665  169.9321 80.09151 172.6079 70.48029 -2.675812      106.6870 
1 1 1 -15 10 10 o 470.6119 36.49515 44.57315       6.617838      36.28443       11.39713      48.78937       8.128552  401.9116 75.79878 489.1033 43.23961 -87.19171      87.26465 
1 1 1 -15 10 11 o 340.6944 54.86428 24.68596       7.012623      36.43707       11.27241      17.26679       8.956852  401.7882 75.00079 272.7600 79.61028 129.0283       109.3751 
1 1 1 -15 10 12 o 538.4205 38.26223 58.74861       7.948463      63.98914       14.73159      56.59649       9.440517  534.6049 72.85301 522.9442 46.98645 11.66071       86.69076 
1 1 1 -15 10 13 o 507.2968 42.00318 52.82619       8.200641      54.80905       14.62847      51.91747       9.903074  484.5611 80.56490 495.7620 52.22164 -11.20090      96.00938 
1 1 1 -15 10 14 o 300.9880 72.38673 21.17937       8.357649      21.10002       14.85410      21.21613       10.10970  281.0500 103.4476 292.8456 84.32250 -11.79565      133.4604 
1 1 1 -15 10 15 o 126.7927 60.34530 -7.558439      8.150780      -2.298490      14.46547      -10.00529      9.866096  185.6918 85.74754 135.3105 64.93449 50.38129       107.5599 
1 1 1 -15 10 16 o 306.9804 67.65372 22.29151       7.848086      22.76683       11.85494      21.92068       10.47116  286.1710 93.08141 287.1161 86.65514 -0.9451294     127.1741 
1 1 1 -15 10 17 f 207.0393 80.05737 10.47354       9.150735      14.13862       11.63352      4.526224       14.81939  228.2491 89.69316 196.4657 89.23203 31.78340       126.5196 
1 1 1 -15 10 18 o 416.7331 62.50209 41.58395       9.803398      55.62046       12.60209      20.07087       15.60143  470.0042 71.27811 240.9362 100.4224 229.0680       123.1472 
1 1 1 -15 10 19 o 137.3154 63.52639 -1.208899      7.994173      8.806273       12.09575      -8.976310      10.65226  189.4411 83.69761 133.2792 64.80302 56.16191       105.8524 
1 1 1 -15 10 20 o 309.4209 77.96146 28.46563       9.364153      24.39803       11.93215      34.98756       15.10907  251.3041 92.68352 278.2187 103.9588 -26.91460      139.2755 
1 1 1 -15 10 21 o 152.1902 69.13508 4.300921       8.900907      7.626182       11.34082      -1.033323      14.36375  167.6119 76.85824 152.7454 74.48583 14.86655       107.0296 
1 1 1 -15 10 22 o 203.4765 92.56074 27.93516       16.02524      27.93516       16.02524      0.000000       0.000000  203.4765 92.56074 ?        ?        0.000000       92.56074 
1 1 1 -15 10 23 o 127.9688 59.74704 2.455616       7.325973      -0.9631788     10.32944      5.915832       10.39182  127.5243 62.39648 143.2592 68.17017 -15.73493      92.41478 
1 1 1 -15 10 24 o 132.7342 63.98871 5.737827       9.837225      5.737827       9.837225      0.000000       0.000000  132.7342 63.98871 ?        ?        0.000000       63.98871 
1 1 1 -15 10 25 o 98.28822 48.37912 -2.814864      6.507062      -3.234302      9.280423      -2.409244      9.126266  107.0007 53.51196 107.9288 53.83514 -0.9281464     75.90620 
1 1 1 -15 10 26 o 92.96243 46.01328 -2.819347      6.176300      -0.8824950E-01 9.053409      -5.196986      8.447273  105.9585 52.97003 96.93373 48.82588 9.024727       72.04020 
1 1 1 -15 11 1  o 143.4900 60.63788 0.8378459      5.811235      -0.1734629E-01 6.714131      3.391560       11.60230  148.1408 63.94847 204.7459 86.05621 -56.60513      107.2151 
1 1 1 -15 11 2  o 798.8252 24.52691 125.0406       7.608913      152.4922       13.58336      112.4878       9.185276  875.6412 39.94413 755.5199 31.30533 120.1213       50.74995 
1 1 1 -15 11 3  o 255.3771 61.67867 13.92161       6.048206      12.95173       9.663264      14.54627       7.755046  248.2639 84.13094 258.7932 73.64236 -10.52922      111.8088 
1 1 1 -15 11 4  o 419.2404 35.41969 35.07310       5.712838      39.20060       8.327263      31.40328       7.852012  437.8710 49.85884 389.9818 53.23589 47.88922       72.93807 
1 1 1 -15 11 5  o 418.0625 40.70949 35.22371       6.525592      34.33624       8.481080      36.51152       10.21648  406.7092 55.11541 414.2732 65.69408 -7.563965      85.75209 
1 1 1 -15 11 6  o 439.5429 36.02854 38.65753       6.095959      38.32580       8.891158      38.95179       8.374039  429.7097 54.50431 435.1882 50.48636 -5.478516      74.29396 
1 1 1 -15 11 7  o 251.8478 63.27430 13.77217       6.180791      12.06940       9.598764      14.97827       8.078443  238.8431 83.73264 259.5356 75.56437 -20.69252      112.7880 
1 1 1 -15 11 8  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -15 11 9  o 993.1946 22.07825 193.6404       8.515828      185.6228       12.20405      201.2488       11.88855  966.3148 32.52050 1007.655 30.38008 -41.34045      44.50317 
1 1 1 -15 11 10 o 230.9280 68.08751 11.81500       6.522275      -6.655083      10.57185      23.16538       8.287470  154.5817 72.03812 323.1395 68.18290 -168.5578      99.18870 
1 1 1 -15 11 11 o 421.1584 54.47725 37.52445       8.701399      0.000000       0.000000      37.52445       8.701399  ?        ?        421.1584 54.47725 0.000000       54.47725 
1 1 1 -15 11 12 o 149.0761 65.56857 -0.1943802     7.344056      -18.91266      13.49407      7.683395       8.754102  147.3124 71.91545 201.9888 78.24750 -54.67644      106.2756 
1 1 1 -15 11 13 o 249.0854 74.96294 14.55831       7.844295      29.03637       14.46488      8.526633       9.336385  328.6240 102.3546 207.5561 80.69506 121.0678       130.3386 
1 1 1 -15 11 14 o 411.1841 51.28881 36.16461       8.011974      34.41107       13.95194      37.02739       9.786498  359.0718 97.52711 406.1268 64.18203 -47.05499      116.7513 
1 1 1 -15 11 15 o 178.9600 70.51319 6.024169       7.208128      19.91183       11.39314      -3.244874      9.307785  271.9723 91.35542 149.2854 68.88219 122.6869       114.4140 
1 1 1 -15 11 16 o 209.7817 74.46729 10.71777       7.611706      -6.728128      11.62128      23.82505       10.07311  152.6681 72.48444 299.2727 83.50220 -146.6046      110.5740 
1 1 1 -15 11 17 o 361.1603 72.26007 32.81593       9.781190      11.49355       12.29341      69.60067       16.14688  211.5564 88.73286 509.0348 84.65247 -297.4784      122.6359 
1 1 1 -15 11 18 o 171.9460 74.84592 5.239450       9.352015      -2.213965      12.26614      15.58703       14.45272  159.4230 75.32867 219.2491 94.22977 -59.82610      120.6385 
1 1 1 -15 11 19 f 120.7470 58.78788 -8.518614      8.846174      -13.13587      11.48622      -1.787364      13.86861  128.4503 63.42493 160.7353 77.09631 -32.28508      99.83267 
1 1 1 -15 11 20 o 334.3544 72.40721 31.98631       9.129727      42.05126       11.85720      17.33022       14.30821  359.7101 86.03719 202.4478 90.15302 157.2623       124.6193 
1 1 1 -15 11 21 o 127.9309 62.91796 -6.988667      10.93019      -26.60821      17.45147      5.675426       14.02086  128.6566 65.39363 160.9715 77.29140 -32.31488      101.2437 
1 1 1 -15 11 22 o 185.5311 75.46839 14.24686       8.531255      25.00508       15.25821      9.353996       10.28999  190.6317 88.04169 159.0077 73.02257 31.62401       114.3837 
1 1 1 -15 11 23 o 173.0657 68.93237 12.36047       6.957935      8.851734       9.912827      15.76795       9.768766  146.9252 68.88775 171.5791 75.54042 -24.65395      102.2344 
1 1 1 -15 11 24 o 235.2956 69.79131 21.87860       6.835917      28.25378       9.471489      14.94710       9.876092  221.1730 82.37540 153.9495 71.00614 67.22343       108.7547 
1 1 1 -15 11 25 o 109.4667 52.59096 2.005978       6.511744      4.835777       9.172761      -0.8689837     9.245667  119.0558 58.36761 108.6938 54.21186 10.36196       79.65993 
1 1 1 -15 12 1  o 135.4723 58.39847 -0.3777857E-01 5.583562      -1.880471      6.349829      6.244710       11.72469  134.4490 59.95117 218.0770 88.56287 -83.62807      106.9464 
1 1 1 -15 12 2  o 500.6680 66.65917 52.82569       12.63889      0.000000       0.000000      52.82569       12.63889  ?        ?        500.6680 66.65917 0.000000       66.65917 
1 1 1 -15 12 3  o 385.0346 44.79539 30.10709       6.573048      35.60516       11.49736      27.43759       8.011395  404.1423 76.04559 361.6270 59.08615 42.51532       96.30215 
1 1 1 -15 12 4  o 184.0332 62.75480 6.673983       5.376910      -3.424137      7.570937      16.95099       7.637701  140.3301 63.75270 278.4035 70.55295 -138.0734      95.09009 
1 1 1 -15 12 5  f 646.3833 37.36282 83.47175       9.339030      0.000000       0.000000      83.47175       9.339030  ?        ?        646.3833 37.36282 0.000000       37.36282 
1 1 1 -15 12 6  o 823.9164 23.20331 133.1960       7.424396      147.1701       11.21472      122.2931       9.906006  861.2126 33.53129 785.5819 32.46976 75.63074       46.67583 
1 1 1 -15 12 7  o 317.7843 58.27750 21.50257       6.927146      20.62605       9.168187      22.66865       10.57457  302.1333 77.69936 313.4277 84.81297 -11.29440      115.0236 
1 1 1 -15 12 8  f 168.0187 65.71766 4.283256       6.220974      1.114462       9.632296      6.550871       8.148309  176.3275 76.35448 195.4688 75.55591 -19.14131      107.4184 
1 1 1 -15 12 9  o 413.7032 47.58261 35.36016       7.505557      25.35835       14.19646      39.24042       8.842410  319.1132 101.6725 432.5894 53.79589 -113.4762      115.0274 
1 1 1 -15 12 10 o 165.5684 69.46554 2.483264       7.538063      10.21988       13.91307      -0.7314337     8.968448  236.7472 96.34734 161.7085 71.72605 75.03867       120.1143 
1 1 1 -15 12 11 o 138.8815 62.74695 -2.231416      7.213672      -14.20600      13.61026      2.446607       8.506821  157.5409 75.77510 171.7159 73.00418 -14.17500      105.2211 
1 1 1 -15 12 12 o 531.8649 40.27126 57.85149       8.256427      91.95350       17.42493      47.97852       9.375728  639.2488 71.40986 476.5647 51.47647 162.6842       88.02951 
1 1 1 -15 12 13 f 227.2514 82.20724 11.93228       9.322273      0.000000       0.000000      11.93228       9.322273  ?        ?        227.2514 82.20724 0.000000       82.20724 
1 1 1 -15 12 14 o 143.1163 63.89272 -0.6155785     7.235548      20.15837       11.36263      -14.78489      9.384122  275.3101 91.20531 120.0613 58.89592 155.2488       108.5686 
1 1 1 -15 12 15 o 244.1654 73.09286 14.80087       7.472409      5.317679       11.79546      21.15786       9.657474  192.6063 83.94321 283.9536 82.60453 -91.34738      117.7708 
1 1 1 -15 12 16 o 275.6971 70.58956 19.07183       7.590460      26.30101       11.99958      14.24971       9.800324  297.3047 93.32763 228.7871 84.05450 68.51765       125.5994 
1 1 1 -15 12 17 o 242.0339 82.33989 16.96740       9.256560      19.10107       12.10569      13.96364       14.36348  243.5274 92.60023 217.0856 93.62196 26.44177       131.6810 
1 1 1 -15 12 18 o 210.6658 80.17944 13.29295       9.081240      24.00535       11.16030      -7.699627      15.62303  267.5539 90.41444 158.4104 77.34381 109.1435       118.9825 
1 1 1 -15 12 19 f 163.7269 71.71481 5.733163       8.705589      -5.232811      11.31104      21.66879       13.63527  140.3960 67.91055 226.8854 94.16595 -86.48944      116.0994 
1 1 1 -15 12 20 o 129.5738 61.98026 -2.728075      8.827899      6.269708       11.26389      -17.05510      14.21342  163.4896 75.55502 129.3273 64.89859 34.16232       99.60115 
1 1 1 -15 12 21 o 177.6173 74.87402 11.95133       8.824909      4.831488       16.69529      14.71198       10.39595  156.5709 77.14922 184.8141 79.67679 -28.24323      110.9071 
1 1 1 -15 12 22 o 114.4711 55.89764 -3.639236      8.167608      -7.058643      14.87486      -2.163303      9.772618  129.7749 65.29481 124.0035 60.67753 5.771416       89.13571 
1 1 1 -15 12 23 o 102.4033 50.17877 -3.735385      6.753585      -8.071157      9.264748      1.180970       9.865564  105.9424 53.05385 123.9445 60.71576 -18.00208      80.62949 
1 1 1 -15 12 24 o 98.27137 48.24261 -2.878644      6.333251      5.929508       8.837420      -12.17836      9.080671  126.0664 60.74279 95.30748 48.30961 30.75892       77.61124 
1 1 1 -15 12 25 o 121.4971 56.04785 5.984981       6.157306      11.14284       8.791825      1.019819       8.626034  132.2490 62.86428 109.0673 54.05476 23.18171       82.90858 
1 1 1 -15 13 1  o 601.2592 34.99119 71.79582       8.135166      69.95537       10.33780      74.78931       13.18424  588.9621 45.55150 602.9243 56.98278 -13.96222      72.95188 
1 1 1 -15 13 2  o 487.8545 51.67295 48.72371       9.640949      34.42137       14.81072      59.24010       12.70007  384.0420 98.75194 532.3361 62.62929 -148.2941      116.9375 
1 1 1 -15 13 3  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -15 13 4  o 598.4879 32.26077 71.06267       7.470523      73.45248       14.63636      70.22075       8.687340  590.0760 64.94518 592.5200 37.95289 -2.444031      75.22166 
1 1 1 -15 13 5  o 175.9904 68.76691 4.673832       6.806452      0.2575659      13.45461      6.192745       7.890602  200.7161 88.49689 193.1315 74.43582 7.584671       115.6391 
1 1 1 -15 13 6  o 771.0526 28.07155 117.2812       8.405787      118.0295       15.59168      116.9745       9.980405  756.5773 53.40849 767.5046 33.48414 -10.92731      63.03693 
1 1 1 -15 13 7  o 226.8618 70.87212 11.21150       6.929212      -9.825800      13.19992      19.21382       8.141123  167.5077 78.84061 293.3995 71.98954 -125.8918      106.7630 
1 1 1 -15 13 8  o 769.6450 29.32538 117.2822       8.765203      144.3471       16.33341      106.3354       10.38765  836.8962 50.49120 727.9467 36.86451 108.9496       62.51682 
1 1 1 -15 13 9  o 581.6263 43.57357 69.07709       9.770743      59.77789       14.48996      76.83112       13.23147  517.8563 74.16728 603.2301 57.16251 -85.37378      93.63940 
1 1 1 -15 13 10 o 337.1490 59.12833 24.63290       7.459568      13.31913       14.01349      29.10632       8.811755  249.2453 98.28247 363.5630 64.78535 -114.3177      117.7140 
1 1 1 -15 13 11 o 442.2410 48.04416 40.90355       8.118663      52.45741       14.28982      35.39651       9.865561  473.6384 80.57301 399.0044 65.97282 74.63403       104.1366 
1 1 1 -15 13 12 o 114.2502 54.65055 -7.652572      6.863527      -15.14795      10.69878      -2.410381      8.947339  131.6680 64.22446 151.8883 69.12019 -20.22029      94.35243 
1 1 1 -15 13 13 o 448.6825 43.07853 42.04729       7.414060      37.29738       11.34076      45.59261       9.797781  394.2323 76.83471 456.3618 56.48970 -62.12946      95.36592 
1 1 1 -15 13 14 o 265.7444 75.60116 17.66397       8.174158      16.07198       19.25907      18.01377       9.027630  246.0889 107.2570 264.4214 80.60778 -18.33247      134.1703 
1 1 1 -15 13 15 o 898.3701 35.92002 166.5553       12.53199      0.000000       0.000000      166.5553       12.53199  ?        ?        898.3701 35.92002 0.000000       35.92002 
1 1 1 -15 13 16 o 328.0006 60.93360 25.62442       7.476020      18.80070       11.69667      30.33744       9.720790  246.0222 91.55930 341.0238 75.40186 -95.00153      118.6109 
1 1 1 -15 13 17 o 172.0185 73.43254 6.008371       8.671082      -0.4165140     10.95240      16.79907       14.19389  157.0403 73.23047 221.3423 94.20625 -64.30202      119.3211 
1 1 1 -15 13 18 o 189.1897 77.23584 10.34156       8.976406      8.706882       11.20577      13.26900       14.99581  182.5418 80.60902 198.7862 90.08035 -16.24442      120.8813 
1 1 1 -15 13 19 o 117.0487 57.28888 -8.314816      8.727975      1.557718       11.20835      -23.52354      13.91150  152.9662 72.19492 122.6498 61.89003 30.31644       95.09196 
1 1 1 -15 13 20 o 144.7263 66.41019 3.517114       8.487254      2.291334       10.88695      5.416294       13.55137  147.2986 69.99963 159.1151 76.29007 -11.81642      103.5380 
1 1 1 -15 13 21 o 143.5420 66.24245 5.052848       8.613017      -17.44964      16.44786      13.55472       10.11001  126.6683 64.29115 174.1659 76.75580 -47.49767      100.1239 
1 1 1 -15 13 22 o 98.84987 48.86621 -6.476291      6.887522      -19.95461      9.641390      7.570406       9.842579  94.78963 48.22150 143.3668 67.66100 -48.57716      83.08624 
1 1 1 -15 13 23 o 236.5695 70.05806 22.00428       6.892336      25.97578       9.479763      17.55063       10.03871  209.1886 81.31718 163.2910 73.87550 45.89766       109.8639 
1 1 1 -15 13 24 o 222.9768 68.05316 20.74141       6.431787      8.435406       8.731022      35.34358       9.510761  129.5830 61.88867 248.0768 83.46737 -118.4938      103.9087 
1 1 1 -15 14 1  o 508.9716 39.96007 51.94226       7.835067      57.06170       9.944996      43.56492       12.72175  529.5638 48.90947 448.0276 75.82113 81.53622       90.22738 
1 1 1 -15 14 2  o 245.7256 81.84009 12.92171       9.144483      32.45480       14.72815      0.6679524      11.66534  370.6643 100.0063 191.6826 83.51151 178.9818       130.2898 
1 1 1 -15 14 3  o 296.8214 81.58630 19.84572       9.695783      7.080829       14.40193      30.42709       13.11242  232.7052 96.69541 361.7695 92.86023 -129.0643      134.0635 
1 1 1 -15 14 4  o 149.0324 64.16425 0.3985219      6.723640      -19.38477      13.25163      7.257125       7.802571  148.3108 72.15028 199.8226 74.69883 -51.51175      103.8536 
1 1 1 -15 14 5  o 203.8656 72.39631 8.259143       7.194915      1.872730       13.48608      10.80015       8.506680  205.7627 89.71512 227.0109 78.86816 -21.24818      119.4529 
1 1 1 -15 14 6  o 421.6799 85.01674 40.76947       13.44174      40.76947       13.44174      0.000000       0.000000  421.6799 85.01674 ?        ?        0.000000       85.01674 
1 1 1 -15 14 7  o 169.2808 68.86517 3.546489       7.104557      0.6620820      12.70774      4.857966       8.568810  194.6120 85.89525 187.1023 75.80642 7.509735       114.5627 
1 1 1 -15 14 8  o 405.6245 46.73312 34.02788       7.227053      39.27001       13.73060      32.01908       8.499715  406.1563 89.46655 386.9587 58.37574 19.19757       106.8269 
1 1 1 -15 14 9  o 241.1617 72.51321 13.22450       7.342405      6.612755       13.64571      15.91883       8.710913  218.8548 92.72679 261.2650 79.07795 -42.41022      121.8671 
1 1 1 -15 14 10 f 152.6125 66.89491 0.1925384      7.586843      -12.45908      9.763387      19.47647       12.05384  130.5374 63.13027 278.7607 93.96535 -148.2233      113.2030 
1 1 1 -15 14 11 o 162.6623 67.03265 3.380337       6.841056      6.251555       9.926959      0.7834771      9.440771  196.2882 80.80233 168.1769 74.14127 28.11130       109.6629 
1 1 1 -15 14 12 o 241.7633 72.15685 13.97056       7.290339      16.32872       11.22570      12.25054       9.587266  252.1995 90.33667 226.8514 83.16719 25.34804       122.7905 
1 1 1 -15 14 13 o 647.3290 31.51777 84.72957       7.923346      93.46696       12.62491      79.05174       10.17720  659.4789 49.65905 613.7524 42.96901 45.72650       65.66854 
1 1 1 -15 14 14 o 343.2824 56.99316 26.79342       7.331579      24.54135       11.28232      28.43954       9.645796  293.8165 90.21275 335.4998 75.81663 -41.68332      117.8410 
1 1 1 -15 14 15 f 557.5469 35.75770 64.78885       7.701639      51.83874       11.85808      74.23721       10.12874  459.6672 68.52042 585.7303 44.86885 -126.0632      81.90398 
1 1 1 -15 14 16 o 158.5816 70.72623 2.625261       8.842262      -12.21569      18.95541      6.752826       9.996528  166.4044 82.03552 180.3073 77.93140 -13.90291      113.1509 
1 1 1 -15 14 17 o 117.9070 58.89261 -18.56775      11.08272      -18.56775      11.08272      0.000000       0.000000  117.9070 58.89261 ?        ?        0.000000       58.89261 
1 1 1 -15 14 18 f 296.2413 75.96410 26.12929       8.781019      23.97530       10.97049      29.96984       14.64877  253.3974 89.45879 253.0347 100.2601 0.3626709      134.3687 
1 1 1 -15 14 19 o 96.01604 48.27885 -16.42735      8.066012      -16.67412      10.02892      -15.97532      13.57329  108.7443 54.56208 127.0039 63.68937 -18.25954      83.86510 
1 1 1 -15 14 20 o 97.91030 48.59654 -9.655522      7.070710      -16.78111      9.916435      -2.286103      10.08467  104.7824 52.79483 130.0356 63.18588 -25.25319      82.33924 
1 1 1 -15 14 21 o 137.2118 63.83245 4.680520       8.243270      9.250820       14.38376      2.445337       10.05904  150.0261 73.45387 133.8562 64.57428 16.16983       97.80240 
1 1 1 -15 14 22 o 141.1874 63.02201 7.573554       7.036814      10.50409       9.546797      4.087379       10.41259  147.1557 68.53706 130.3821 63.54494 16.77361       93.46276 
1 1 1 -15 14 23 o 122.6414 57.16353 4.652808       6.661506      1.980267       9.089185      7.754354       9.791561  117.8978 57.86050 130.7293 63.22263 -12.83148      85.70261 
1 1 1 -15 15 1  o 229.0541 74.07867 11.17944       7.514906      6.782992       9.299288      19.45478       12.75826  205.2417 80.32863 291.6187 96.64606 -86.37704      125.6708 
1 1 1 -15 15 2  o 312.1692 65.87538 21.10579       7.735240      5.737263       9.544941      50.51104       13.20290  200.2561 80.40232 482.6516 72.69321 -282.3955      108.3920 
1 1 1 -15 15 3  o 768.3918 50.99819 121.0011       15.13182      0.000000       0.000000      121.0011       15.13182  ?        ?        768.3918 50.99819 0.000000       50.99819 
1 1 1 -15 15 4  o 157.1145 68.64962 -0.1471568     7.933935      -5.415186      10.34962      7.360860       12.35557  157.9023 72.77998 221.7791 90.58603 -63.87677      116.2014 
1 1 1 -15 15 5  o 587.6525 29.36989 68.33150       6.702716      71.26685       9.669778      65.61683       9.299222  592.9286 42.27071 568.7543 42.40595 24.17438       59.87552 
1 1 1 -15 15 6  o 137.7220 60.06678 -0.1965844     6.049480      -11.78761      8.677814      10.76199       8.437749  123.5503 59.69466 224.4076 78.51489 -100.8572      98.63083 
1 1 1 -15 15 7  o 469.8042 35.41088 44.43517       6.413234      43.34010       9.360299      45.40407       8.804557  453.4606 54.22803 467.3924 49.24746 -13.93179      73.25293 
1 1 1 -15 15 8  o 194.1231 77.82096 6.170173       8.926982      6.170173       8.926982      0.000000       0.000000  194.1231 77.82096 ?        ?        0.000000       77.82096 
1 1 1 -15 15 9  o 443.8923 39.23314 40.28817       6.693668      39.19226       9.932893      41.19988       9.059792  422.3401 62.44253 439.2426 54.26499 -16.90253      82.72701 
1 1 1 -15 15 10 o 219.6014 69.28641 11.07934       6.605195      9.083119       10.08619      12.57827       8.740067  211.4028 83.37439 231.1594 79.96350 -19.75653      115.5225 
1 1 1 -15 15 11 o 196.9518 70.31159 8.584412       6.795074      15.23341       10.40963      3.647639       8.969714  245.5925 87.09484 175.7725 74.85193 69.82008       114.8404 
1 1 1 -15 15 12 o 299.7902 73.33860 22.01499       8.468195      18.17365       10.96154      27.70109       13.33637  259.0485 89.55437 309.0805 98.55177 -50.03198      133.1632 
1 1 1 -15 15 13 o 222.5678 72.26363 12.39551       7.146376      28.73669       11.18840      1.134417       9.287879  324.0297 87.05476 161.7136 72.27820 162.3161       113.1489 
1 1 1 -15 15 14 o 261.0409 69.52597 17.26801       7.174373      5.225111       10.72910      27.00793       9.648848  181.5657 79.56926 318.9527 78.44167 -137.3869      111.7334 
1 1 1 -15 15 15 o 473.8236 42.04750 48.60279       7.656832      59.86736       11.39568      39.33187       10.33818  501.5367 59.67889 392.4969 70.41051 109.0399       92.29956 
1 1 1 -15 15 16 o 176.0698 78.62670 6.164289       10.96572      6.164289       10.96572      0.000000       0.000000  176.0698 78.62670 ?        ?        0.000000       78.62670 
1 1 1 -15 15 17 f 158.3630 74.09949 2.074330       11.37003      2.074330       11.37003      0.000000       0.000000  158.3630 74.09949 ?        ?        0.000000       74.09949 
1 1 1 -15 15 18 o 137.2701 65.92322 -2.361231      10.21019      -3.318048      14.86258      -1.506131      14.05040  150.6321 73.93829 151.6576 73.89235 -1.025421      104.5321 
1 1 1 -15 15 19 o 138.4061 61.97170 3.602901       6.860609      4.060417       9.303985      3.057674       10.15673  146.4958 68.03932 145.3731 68.64592 1.122650       96.65201 
1 1 1 -15 15 20 o 158.3582 68.66642 9.134251       7.811400      5.334758       12.43711      11.60946       10.03836  145.9520 70.74611 163.8722 74.03030 -17.92021      102.3987 
1 1 1 -15 15 21 o 135.7130 63.21050 5.556121       8.122004      -1.406149      12.97564      10.04126       10.41457  127.6322 63.74626 148.2356 69.84891 -20.60342      94.56456 
1 1 1 -15 15 22 o 104.6768 52.47355 -7.027251      9.171322      -7.027251      9.171322      0.000000       0.000000  104.6768 52.47355 ?        ?        0.000000       52.47355 
1 1 1 -15 15 23 o 93.41907 46.42419 -5.043708      6.529999      -10.60499      8.661717      2.278878       9.939139  94.44878 47.79758 117.0095 57.99677 -22.56069      75.15474 
1 1 1 -15 16 1  o 217.9613 67.67965 10.21901       6.329823      7.769794       7.289612      17.72617       12.76229  200.3438 72.66055 278.2226 96.60526 -77.87883      120.8807 
1 1 1 -15 16 2  f 200.2030 72.51791 7.820832       7.257706      9.596340       9.138738      4.788509       11.94298  219.8552 81.10675 207.6428 87.29406 12.21242       119.1577 
1 1 1 -15 16 3  o 450.7673 45.49190 41.63060       7.854761      43.33883       9.743262      38.45936       13.27537  453.8141 56.50782 406.9727 86.65191 46.84143       103.4490 
1 1 1 -15 16 4  f 156.3378 64.51837 2.485060       6.348785      -3.463379      7.340114      20.15349       12.65028  136.0586 62.18260 289.2941 96.25353 -153.2355      114.5924 
1 1 1 -15 16 5  o 453.6630 35.89886 41.47825       6.273070      43.65998       9.050742      39.46121       8.702428  456.7165 51.95263 433.4781 52.78440 23.23837       74.06261 
1 1 1 -15 16 6  o 220.1153 66.36372 10.76294       6.143771      12.59315       8.816763      9.035403       8.565876  236.0065 80.35967 210.6783 78.36366 25.32826       112.2432 
1 1 1 -15 16 7  o 504.8322 34.40311 51.39234       6.704653      55.70253       9.780145      47.57068       9.209212  515.8111 49.42853 475.5441 50.64522 40.26703       70.76805 
1 1 1 -15 16 8  f 353.5900 65.76112 28.13022       8.697835      0.000000       0.000000      28.13022       8.697835  ?        ?        353.5900 65.76112 0.000000       65.76112 
1 1 1 -15 16 9  o 231.4603 67.35888 12.42988       6.420565      3.411065       9.881712      19.01901       8.446391  181.1816 77.89408 280.9336 75.70715 -99.75197      108.6235 
1 1 1 -15 16 10 o 91.02894 45.18476 -13.10465      6.117624      -6.943167      9.708036      -17.16295      7.878819  141.2726 66.83293 101.5065 50.53295 39.76611       83.78675 
1 1 1 -15 16 11 o 480.8438 38.32423 47.95796       7.097147      44.06473       10.80267      50.91447       9.413823  435.3175 65.96633 484.2184 50.81844 -48.90088      83.27107 
1 1 1 -15 16 12 o 126.8224 58.29616 -2.378176      6.579041      -7.395660      10.07352      1.353875       8.687845  139.6279 66.62797 158.8034 70.50868 -19.17557      97.00907 
1 1 1 -15 16 13 o 396.9462 49.91793 35.02452       7.524950      38.19081       10.67610      31.89851       10.60800  388.2996 73.48879 345.0887 80.61068 43.21097       109.0811 
1 1 1 -15 16 14 o 319.2331 86.35008 29.92260       10.96388      29.92260       10.96388      0.000000       0.000000  319.2331 86.35008 ?        ?        0.000000       86.35008 
1 1 1 -15 16 15 o 143.0406 65.85682 -0.2386566     8.442231      2.043506       10.55846      -4.283755      14.05697  161.0536 73.96465 158.6968 76.50140 2.356796       106.4107 
1 1 1 -15 16 16 o 160.6203 73.97405 3.264802       10.66304      3.264802       10.66304      0.000000       0.000000  160.6203 73.97405 ?        ?        0.000000       73.97405 
1 1 1 -15 16 17 o 173.8170 76.66737 8.971087       10.10789      8.971087       10.10789      0.000000       0.000000  173.8170 76.66737 ?        ?        0.000000       76.66737 
1 1 1 -15 16 18 o 176.4660 76.04996 11.36712       9.464071      11.36712       9.464071      0.000000       0.000000  176.4660 76.04996 ?        ?        0.000000       76.04996 
1 1 1 -15 16 19 o 94.29578 47.26410 -12.47985      7.430545      -7.738309      10.90870      -16.58406      10.14912  120.7035 59.98652 104.8110 52.88512 15.89250       79.97011 
1 1 1 -15 16 20 o 153.2737 67.14188 9.163482       7.632193      13.11457       10.96656      5.452250       10.62848  159.4054 73.97797 139.3450 67.00780 20.06039       99.81375 
1 1 1 -15 16 21 o 109.5235 52.77960 -0.6225401     6.677943      -4.303642      8.822739      4.315183       10.21828  109.5918 54.37581 129.5178 63.08540 -19.92598      83.28563 
1 1 1 -15 16 22 o 136.1962 61.23287 7.944849       6.772342      5.840118       9.142306      10.50423       10.08150  126.6340 61.20551 137.0557 65.73685 -10.42170      89.81897 
1 1 1 -15 17 1  o 201.7679 67.37653 8.611001       6.196789      9.261624       7.268602      6.879891       11.85628  209.9080 72.90459 214.4124 88.28959 -4.504364      114.4995 
1 1 1 -15 17 2  o 265.8066 70.00521 15.93449       7.326564      23.29579       9.053328      1.964020       12.47202  319.8570 74.30244 196.4887 85.95710 123.3683       113.6199 
1 1 1 -15 17 3  o 250.4369 73.00801 14.29594       7.536822      21.81539       9.418067      0.9046659      12.56840  305.8097 78.80828 192.3756 85.13937 113.4341       116.0149 
1 1 1 -15 17 4  f 177.7658 67.96021 5.633016       6.542440      4.636933       7.686992      8.250910       12.46191  178.0486 71.91825 220.3568 90.60094 -42.30814      115.6753 
1 1 1 -15 17 5  o 190.8980 68.38493 7.499944       6.433029      16.10304       7.671961      -12.87355      11.80624  263.5497 72.62834 146.3461 70.43685 117.2036       101.1742 
1 1 1 -15 17 6  o 268.1912 60.23426 16.02701       6.120217      13.34497       8.879423      18.45438       8.447323  238.2219 80.64700 278.9131 75.94201 -40.69113      110.7751 
1 1 1 -15 17 7  o 584.8457 30.13484 68.60996       6.821180      71.23141       9.815876      66.16186       9.485801  586.0432 43.43846 564.5757 43.60157 21.46753       61.54670 
1 1 1 -15 17 8  o 233.4793 67.27913 12.75963       6.433762      27.35030       9.778481      1.621762       8.543483  336.2736 76.59007 163.7446 71.40047 172.5289       104.7094 
1 1 1 -15 17 9  o 155.8587 64.86440 3.101131       6.495108      -4.065856      9.782671      8.751023       8.685787  149.7630 69.62684 200.9697 77.91673 -51.20668      104.4936 
1 1 1 -15 17 10 o 278.9277 63.53596 18.29092       6.728605      13.18177       10.12730      22.32862       9.002990  226.9032 85.04729 296.6241 77.35273 -69.72093      114.9630 
1 1 1 -15 17 11 o 379.2038 47.72972 31.35650       6.873207      50.92573       10.34699      15.90212       9.195025  473.3237 57.46826 242.4446 82.06776 230.8791       100.1884 
1 1 1 -15 17 12 o 304.1429 70.30434 23.36850       8.137771      39.26254       10.20512      -4.387929      13.48599  399.7299 68.18537 163.8648 77.88277 235.8651       103.5131 
1 1 1 -15 17 13 o 364.7388 61.49260 32.13773       8.400498      35.93501       10.47971      25.31155       14.05083  367.7210 75.90050 264.5753 99.96360 103.1457       125.5134 
1 1 1 -15 17 14 o 171.8503 72.29983 6.572436       8.202285      5.604385       10.25634      8.290167       13.66222  172.8562 76.68543 188.7925 85.72015 -15.93634      115.0156 
1 1 1 -15 17 15 o 186.7989 79.82382 10.25214       10.26514      10.25214       10.26514      0.000000       0.000000  186.7989 79.82382 ?        ?        0.000000       79.82382 
1 1 1 -15 17 16 o 164.9872 74.17033 6.565312       9.933769      6.565312       9.933769      0.000000       0.000000  164.9872 74.17033 ?        ?        0.000000       74.17033 
1 1 1 -15 17 17 o 118.0247 55.94165 -2.029927      6.865057      8.664026       9.305663      -14.80019      10.16899  166.0932 73.39584 111.1391 55.64545 54.95411       92.10519 
1 1 1 -15 17 18 o 130.4943 59.73309 2.480868       6.808822      -8.204191      9.079103      16.21415       10.29299  112.5842 55.73655 186.8154 79.88403 -74.23113      97.40648 
1 1 1 -15 17 19 o 92.64735 46.11396 -8.903732      6.548491      -12.53823      8.106622      -2.078243      11.10925  96.76351 48.61989 126.7616 62.55070 -29.99804      79.22427 
1 1 1 -15 17 20 o 167.8871 68.65588 12.41048       7.108006      7.746747       9.559243      18.17788       10.63033  140.2375 66.33572 170.2192 76.60526 -29.98174      101.3351 
1 1 1 -15 17 21 o 107.6911 52.56747 -1.350790      7.204624      -2.478865      9.898930      -0.8013703E-01 10.50589  113.5784 56.55891 118.6782 58.96092 -5.099808      81.70251 
1 1 1 -15 18 1  o 190.3556 68.82220 7.331482       6.532382      4.304461       8.011871      13.33430       11.28246  177.8315 72.82579 242.6687 90.00011 -64.83720      115.7740 
1 1 1 -15 18 2  o 123.2126 58.00021 -6.027004      7.148300      -5.605231      9.230083      -6.659093      11.29939  144.5071 67.33260 157.9625 73.89840 -13.45540      99.97327 
1 1 1 -15 18 3  o 134.9580 62.02614 -3.524332      7.443915      -8.068821      9.506286      3.679214       11.96855  139.0997 65.90138 196.2560 85.04794 -57.15639      107.5925 
1 1 1 -15 18 4  o 408.2603 49.35553 35.25943       7.666428      41.48632       9.589475      24.23061       12.76216  436.7867 57.96407 303.5042 96.36796 133.2824       112.4572 
1 1 1 -15 18 5  o 477.9003 42.53758 47.36766       7.812204      48.46661       9.656355      45.28570       13.29107  475.1557 53.24538 432.6711 82.10304 42.48468       97.85693 
1 1 1 -15 18 6  o 176.7193 69.00928 5.769479       6.851285      13.76293       8.041561      -15.39723      13.08578  238.5519 76.57626 147.4351 71.71803 91.11681       104.9162 
1 1 1 -15 18 7  o 195.8763 67.78213 8.664148       6.280293      12.34321       9.330803      5.617020       8.491726  225.4919 82.14137 182.4434 74.87476 43.04846       111.1460 
1 1 1 -15 18 8  o 252.5150 66.06381 15.18545       6.553067      11.75427       9.364130      18.47848       9.173677  219.2283 81.85667 266.9728 81.22867 -47.74443      115.3196 
1 1 1 -15 18 9  o 137.3423 62.52372 -1.536525      7.329614      6.566368       9.279386      -14.97887      11.95189  186.8086 77.61977 136.8184 66.98090 49.99014       102.5245 
1 1 1 -15 18 10 o 411.3786 50.87194 37.51405       7.954110      43.19427       10.00008      27.73082       13.12388  429.9709 61.65188 297.9740 97.98606 131.9968       115.7680 
1 1 1 -15 18 11 o 172.1334 71.21438 5.796106       7.762872      9.640655       9.747372      -0.8711494     12.83626  197.8202 80.59039 168.7595 78.89046 29.06071       112.7764 
1 1 1 -15 18 12 o 326.5905 66.86224 26.90345       8.194844      26.05877       10.14818      28.48661       13.89330  298.3022 84.01877 280.7301 100.5047 17.57202       130.9975 
1 1 1 -15 18 13 o 137.3628 63.77848 -1.304353      8.165361      -7.436836      9.913646      11.63167       14.39844  131.3795 63.55601 198.9077 89.36888 -67.52820      109.6639 
1 1 1 -15 18 14 o 198.8736 77.09933 12.20066       8.504096      12.95421       10.14161      10.41578       15.60822  199.3636 81.82318 188.4688 87.73022 10.89482       119.9651 
1 1 1 -15 18 15 o 126.1052 59.06371 -1.305892      7.254355      4.454228       9.758698      -8.420537      10.84558  157.0544 71.74744 128.6498 63.15079 28.40460       95.58095 
1 1 1 -15 18 16 o 139.4925 63.90742 2.590875       7.817056      18.09362       9.274970      -35.42540      14.52423  215.5324 81.26919 111.1398 56.77225 104.3926       99.13510 
1 1 1 -15 18 17 o 187.0245 73.11597 13.19154       7.697635      22.49424       9.470635      -4.917189      13.21353  230.1775 82.91915 134.1009 66.53780 96.07655       106.3149 
1 1 1 -15 18 18 o 114.0396 54.34439 -0.9555117     6.654465      6.330798       8.485683      -12.59311      10.72420  144.0902 66.22364 110.5616 55.60304 33.52856       86.47120 
1 1 1 -15 18 19 o 255.5703 72.99808 24.64046       7.605266      19.05609       10.64174      30.47011       10.87292  176.7541 78.27833 227.9058 87.49632 -51.15166      117.4015 
1 1 1 -15 18 20 o 126.8710 59.31805 4.564965       7.262014      2.613575       9.784517      6.958229       10.83584  124.5077 60.87980 134.0477 65.21887 -9.539955      89.21799 
1 1 1 -15 19 1  o 162.1128 66.17450 3.596497       6.588490      -0.4464986     7.940688      12.52943       11.80330  151.4044 67.30724 234.5480 90.85917 -83.14363      113.0737 
1 1 1 -15 19 2  f 159.2477 69.28148 1.254569       8.004656      1.370513       11.18880      1.133009       11.45653  180.7501 80.14593 181.3980 80.73288 -0.6478729     113.7593 
1 1 1 -15 19 3  o 219.0413 78.66927 11.10191       8.518633      23.18275       12.19874      -0.3966052     11.90111  294.3974 94.29541 177.7433 80.42333 116.6541       123.9336 
1 1 1 -15 19 4  o 137.3686 61.35970 -0.7923676     6.682817      -2.962381      8.056845      3.992816       11.96418  140.7039 64.61601 192.4946 84.19992 -51.79074      106.1360 
1 1 1 -15 19 5  o 150.4647 65.42850 1.242990       7.132177      -6.337257      8.738220      16.37103       12.34448  134.6588 63.61275 248.5814 93.75105 -113.9226      113.2954 
1 1 1 -15 19 6  o 378.1194 52.34788 31.33354       7.480787      44.48426       9.245336      6.398190       12.73079  449.7273 54.01590 201.0333 87.41624 248.6940       102.7585 
1 1 1 -15 19 7  o 199.7306 72.67461 9.374666       7.301013      15.95979       9.155748      -2.125491      12.09940  246.0125 81.88833 167.9003 77.84410 78.11221       112.9841 
1 1 1 -15 19 8  o 235.4721 73.32674 14.15920       7.424191      19.47277       9.260539      4.600254       12.42076  268.5307 81.59219 188.2842 83.91002 80.24649       117.0392 
1 1 1 -15 19 9  o 405.3407 50.90131 36.64581       7.835960      48.69730       9.779755      15.03481       13.09619  462.2721 55.59024 227.1483 93.07544 235.1238       108.4127 
1 1 1 -15 19 10 o 176.6121 72.24333 6.702699       7.872893      10.08208       9.558238      -0.4273346     13.88369  198.4580 80.18376 172.6746 81.14114 25.78345       114.0759 
1 1 1 -15 19 11 o 125.2632 59.45442 -4.679717      7.806729      -6.868359      9.387058      0.2292930      14.05850  130.8195 62.92439 171.0727 80.77547 -40.25320      102.3922 
1 1 1 -15 19 12 o 144.1356 65.91361 0.6043565      8.263126      8.939182       10.08668      -16.40296      14.40847  184.7202 79.03613 138.8188 68.98102 45.90141       104.9051 
1 1 1 -15 19 13 o 139.5062 62.48975 1.862628       6.983360      9.450393       9.971104      -5.442293      9.783495  181.6980 78.18336 131.9688 63.66879 49.72928       100.8283 
1 1 1 -15 19 14 o 114.2710 54.56264 -3.791576      6.777866      2.835714       9.515550      -10.61695      9.656709  150.3175 69.45942 117.6893 58.11961 32.62817       90.56766 
1 1 1 -15 19 15 o 114.8102 55.60788 -4.893757      7.646927      -10.10141      9.195567      6.781310       13.76851  113.1823 56.04340 162.5276 77.64938 -49.34528      95.76163 
1 1 1 -15 19 16 o 165.6286 69.99031 9.524506       7.741489      3.939230       9.025991      25.06593       15.05629  142.7895 66.54960 196.3315 89.46820 -53.54193      111.5052 
1 1 1 -15 19 17 o 125.0802 57.84723 2.043470       6.620806      -3.408123      8.706937      9.516993       10.19451  117.8241 57.57326 155.2337 71.78862 -37.40966      92.02329 
1 1 1 -15 19 18 o 112.2243 53.64412 -0.6611509     6.589033      -2.354828      8.455182      1.957985       10.51445  115.7523 56.59756 130.3983 63.61916 -14.64600      85.15093 
1 1 1 -15 20 1  o 299.1303 53.85658 19.69062       6.026351      19.12384       7.098035      21.15406       11.40564  287.1485 65.14611 281.0293 91.29518 6.119171       112.1554 
1 1 1 -15 20 2  o 135.7837 61.26510 -1.353969      6.850266      -7.906357      8.431363      11.37186       11.75009  127.4630 60.85984 222.3347 89.22859 -94.87170      108.0077 
1 1 1 -15 20 3  o 130.8124 61.67596 -5.744653      8.142157      8.373290       11.35091      -20.70817      11.68589  205.6398 85.67947 126.7457 62.83416 78.89412       106.2502 
1 1 1 -15 20 4  o 416.7712 45.89479 37.11971       7.305171      41.91597       8.850962      26.87085       12.93829  436.4345 53.33022 304.0581 97.08239 132.3764       110.7660 
1 1 1 -15 20 5  o 172.7433 69.48030 5.572703       7.141778      4.973739       8.816779      6.715595       12.17901  177.0443 74.74709 197.5327 85.69680 -20.48845      113.7149 
1 1 1 -15 20 6  o 205.6612 72.09238 10.41032       7.115397      12.88785       8.812385      5.769612       12.06079  222.2547 79.99401 191.3188 84.09015 30.93599       116.0612 
1 1 1 -15 20 7  o 170.5650 69.70712 5.550867       7.321566      4.561730       8.628056      8.095398       13.83849  170.8772 73.10541 201.5376 89.25885 -30.66035      115.3757 
1 1 1 -15 20 8  o 162.7428 68.30940 4.532329       7.294333      11.68270       8.768957      -11.52910      13.14243  208.9203 78.96214 146.3524 71.34204 62.56784       106.4176 
1 1 1 -15 20 9  o 106.7031 51.45684 -6.781454      6.373994      -9.570416      8.909557      -3.857523      9.122594  121.5951 59.15520 137.9671 65.12080 -16.37202      87.97759 
1 1 1 -15 20 10 o 130.1324 59.19271 -0.3792642     6.552285      -3.192092      9.183497      2.537388       9.351447  138.3243 65.30421 158.2825 71.48365 -19.95819      96.82227 
1 1 1 -15 20 11 o 122.1860 56.83849 -1.881931      6.534095      -4.797935      9.276464      0.9894189      9.205162  132.2177 63.32133 149.0957 68.69046 -16.87793      93.42361 
1 1 1 -15 20 12 o 218.4864 70.46965 14.04739       6.803998      12.90306       9.483667      15.26117       9.767207  197.2620 79.81081 209.3848 82.21492 -12.12279      114.5821 
1 1 1 -15 20 13 o 155.6367 65.64330 5.995263       6.788966      8.488432       9.565171      3.464333       9.637333  170.2148 74.84873 151.6259 70.00728 18.58890       102.4859 
1 1 1 -15 20 14 o 178.0589 69.20728 10.25475       6.865830      15.32393       9.582833      4.907847       9.841846  195.9592 79.87826 152.1309 70.41782 43.82828       106.4857 
1 1 1 -15 20 15 o 115.2046 55.54790 -3.154794      7.420922      -6.650609      9.029014      4.122828       13.02749  115.8474 57.01551 149.3365 72.39131 -33.48909      92.14809 
1 1 1 -15 20 16 f 111.4790 53.51088 -2.133307      6.709055      -3.877067      8.691284      0.4378300      10.55366  117.1074 57.28595 132.6306 64.49106 -15.52323      86.25993 
1 1 1 -15 20 17 o 118.5179 55.65230 1.095467       6.511187      4.568427       8.308000      -4.434125      10.48318  134.9332 63.20140 119.5923 59.32658 15.34091       86.68368 
1 1 1 -15 21 1  o 294.7626 52.94818 19.35668       5.838321      22.63891       6.793822      10.08761       11.41690  315.8090 57.51279 211.0106 86.73405 104.7984       104.0698 
1 1 1 -15 21 2  o 271.0911 69.58893 18.06000       7.363506      10.72429       9.465136      29.30622       11.71949  210.1846 81.37976 324.7308 89.87757 -114.5462      121.2462 
1 1 1 -15 21 3  o 150.8132 63.41539 2.933026       6.304844      2.723497       7.249484      3.583528       12.77349  155.8640 66.85534 186.5624 83.96550 -30.69835      107.3305 
1 1 1 -15 21 4  o 151.5640 63.52074 3.202870       6.291912      0.7107228E-01  7.093891      14.75206       13.62271  140.9840 63.07901 228.2683 94.38018 -87.28429      113.5191 
1 1 1 -15 21 5  o 475.0629 38.11443 47.49653       6.972626      41.33275       7.939795      68.27384       14.57741  433.4863 47.96741 519.3881 74.39536 -85.90182      88.51859 
1 1 1 -15 21 6  o 152.1285 64.06640 3.485303       6.450905      3.926001       7.461744      2.181263       12.83557  160.0121 68.20867 176.4132 81.21537 -16.40109      106.0583 
1 1 1 -15 21 7  o 151.3073 63.85763 3.595331       6.431179      4.322532       7.410178      1.375732       12.94609  160.2317 68.12934 171.9527 79.99440 -11.72101      105.0748 
1 1 1 -15 21 8  o 360.8253 50.34705 29.85915       6.862827      33.47955       7.823878      17.77843       14.29189  376.8965 55.07867 223.2637 94.76274 153.6328       109.6067 
1 1 1 -15 21 9  o 245.5026 67.30576 16.20812       6.608620      8.613218       8.966144      25.24183       9.778622  181.6466 75.95518 285.9793 83.10011 -104.3328      112.5825 
1 1 1 -15 21 10 o 212.4485 69.23022 12.90603       6.556774      17.91064       9.109213      7.525353       9.445271  232.8608 81.57316 173.1814 75.30058 59.67949       111.0151 
1 1 1 -15 21 11 o 220.3008 69.65008 14.37688       6.672067      17.97653       9.052859      10.09662       9.871680  227.6949 81.17027 180.3371 77.69447 47.35774       112.3612 
1 1 1 -15 21 12 o 133.1275 60.05102 1.924065       6.576479      10.46841       9.050187      -7.635777      9.572902  177.7973 75.43359 121.5326 59.59097 56.26466       96.13174 
1 1 1 -15 21 13 f 222.1866 70.37461 15.93303       6.809206      20.95238       9.262152      10.02965       10.04473  231.1589 82.13533 169.3331 75.46188 61.82579       111.5379 
1 1 1 -15 21 14 o 106.1464 51.31683 -4.091472      6.437482      0.8283554      8.508983      -10.67651      9.844234  131.5325 62.32570 112.7414 56.18415 18.79112       83.91156 
1 1 1 -15 21 15 o 108.6228 52.85371 -4.139185      7.120889      -4.335172      8.691235      -3.738956      12.42004  116.4242 57.02246 130.1821 64.57906 -13.75790      86.15112 
1 1 1 -15 22 1  o 118.6841 54.16730 -1.648982      5.545721      -0.3615741     6.317491      -5.973546      11.57864  132.0220 59.26549 150.9445 71.86311 -18.92255      93.14883 
1 1 1 -15 22 2  o 174.5268 79.51483 2.239503       11.88456      0.000000       0.000000      2.239503       11.88456  ?        ?        174.5268 79.51483 0.000000       79.51483 
1 1 1 -15 22 3  o 134.3473 59.24086 0.8116187      6.030775      -4.370540      6.834589      19.03711       12.81730  119.6341 56.43652 242.4100 94.46436 -122.7758      110.0391 
1 1 1 -15 22 4  o 148.8168 62.30088 3.474920       6.042309      2.535286       6.829342      6.861312       12.96487  148.1973 64.23277 189.4049 84.97172 -41.20767      106.5178 
1 1 1 -15 22 5  o 178.3231 66.81756 7.778736       6.250099      8.701049       7.135604      4.739112       12.95393  185.5421 70.96439 180.2148 82.45514 5.327347       108.7878 
1 1 1 -15 22 6  o 165.2874 65.73296 6.192831       6.318078      13.99748       7.332535      -16.30482      12.44933  223.3145 73.23270 130.5236 64.73265 92.79085       97.74121 
1 1 1 -15 22 7  o 121.0595 55.93795 -1.549116      6.170678      1.072612       7.143551      -9.256042      12.24788  139.2655 62.72470 139.6612 68.25217 -0.3956909     92.69707 
1 1 1 -15 22 8  o 137.3293 60.64351 2.035178       6.342233      -1.123886      7.334957      11.39392       12.62488  130.1343 60.43093 191.0367 84.89990 -60.90247      104.2108 
1 1 1 -15 22 9  o 166.0371 67.81337 7.142934       6.923611      2.066102       8.151422      20.29120       13.11811  144.7702 65.91701 218.7498 91.70082 -73.97954      112.9340 
1 1 1 -15 22 10 o 277.8535 61.35051 20.58993       6.443114      19.89159       8.738077      21.42202       9.538300  241.2167 79.98473 243.4897 83.57471 -2.273026      115.6818 
1 1 1 -15 22 11 o 147.5786 63.11359 5.073115       6.426302      1.907959       8.674950      8.922426       9.566674  141.0494 65.57265 168.7959 74.51274 -27.74643      99.25685 
1 1 1 -15 22 12 o 93.18088 46.17767 -9.305489      6.290628      1.387623       8.555267      -21.89146      9.281644  136.1182 63.87703 95.75600 48.56960 40.36216       80.24512 
1 1 1 -15 22 13 o 151.2245 63.77519 6.696984       6.406896      -0.3379745     8.643258      15.27671       9.545167  128.6769 61.48949 187.7335 78.42366 -59.05667      99.65555 
1 1 1 -15 23 1  o 139.0000 58.44021 2.675964       5.353206      3.778830       6.182018      -0.6297739     10.70294  151.0768 63.11219 156.8364 72.88635 -5.759598      96.41353 
1 1 1 -15 23 2  o 119.9016 56.26072 -3.377599      6.633607      -0.2335873     8.462345      -8.389142      10.68401  144.9548 66.44042 135.8612 65.78578 9.093582       93.49919 
1 1 1 -15 23 3  o 282.9670 52.75163 18.75809       5.583685      13.39416       6.361923      36.74698       11.65062  224.7333 67.48124 351.6236 86.02469 -126.8904      109.3342 
1 1 1 -15 23 4  o 146.7143 61.23495 3.793857       5.812351      9.684583       6.662918      -14.96100      11.88877  190.1853 69.39191 128.8076 63.77035 61.37773       94.24380 
1 1 1 -15 23 5  o 309.1888 52.20184 22.59580       6.044927      19.71485       6.887411      32.25806       12.61327  273.8137 65.62559 299.3122 95.88570 -25.49857      116.1929 
1 1 1 -15 23 6  o 102.7874 49.68103 -6.106325      6.024537      -10.93413      6.871241      9.941579       12.52764  98.62736 48.76604 186.0746 83.49871 -87.44721      96.69623 
1 1 1 -15 23 7  o 170.3324 65.88866 7.730064       6.200160      1.144870       7.150042      27.69266       12.44895  136.4958 61.98936 261.5020 94.93668 -125.0062      113.3828 
1 1 1 -15 23 8  o 236.2887 65.50908 15.66808       6.220493      13.82200       7.128310      21.56274       12.73770  211.2323 72.25488 221.9733 91.47064 -10.74098      116.5661 
1 1 1 -15 23 9  o 121.4924 56.27240 -0.5100051     6.299914      -2.550277      7.194801      6.195406       13.04330  120.2704 57.08235 165.0367 77.88836 -44.76620      96.56599 
1 1 1 -15 23 10 o 162.3597 67.79300 7.671776       7.128163      9.956505       8.429940      1.939903       13.35228  173.4985 73.16077 152.5923 73.80380 20.90619       103.9206 
1 1 1 -15 24 1  o 139.2451 61.00398 1.937097       6.302230      5.001403       7.923193      -3.341060      10.39861  163.0090 69.90570 144.6923 68.65920 18.31670       97.98415 
1 1 1 -15 24 2  o 320.2354 56.77544 24.81179       6.802343      22.21839       8.332129      29.99489       11.77920  280.1769 75.06303 297.7315 92.30475 -17.55466      118.9732 
1 1 1 -15 24 3  f 119.6093 53.97258 -0.1627633     5.318030      -0.5806144     6.035772      1.287387       11.24420  123.6876 56.47382 158.7038 74.07095 -35.01613      93.14397 
1 1 1 -15 24 4  f 142.3777 59.71604 3.655148       5.567631      2.406801       6.362462      7.736064       11.50367  139.4313 61.18491 177.8025 79.88431 -38.37115      100.6235 
1 1 1 -15 24 5  o 176.3355 64.52335 8.371295       5.766693      6.540707       6.591660      14.34230       11.90483  162.9046 66.30899 200.0789 85.74277 -37.17436      108.3914 
1 1 1 -15 24 6  o 165.9900 63.75919 7.279382       5.775540      9.795914       6.622995      -0.7097668     11.80059  183.7463 68.79521 150.0156 71.73129 33.73065       99.38893 
1 1 1 -14 0  1  o 298.7671 53.64057 19.09229       5.627000      19.09229       5.627000      19.09229       5.627000  298.7671 53.64057 298.7671 53.64057 0.000000       0.000000 
1 1 1 -14 0  2  o 85.94740 57.41734 -1.718695      5.263727      -1.718695      5.263727      -1.718695      5.263727  85.94740 57.41734 85.94740 57.41734 0.000000       0.000000 
1 1 1 -14 0  3  o 80.08065 54.84494 -3.474459      5.429640      -3.474459      5.429640      -3.474459      5.429640  80.08065 54.84494 80.08065 54.84494 0.000000       0.000000 
1 1 1 -14 0  4  o 92.56036 61.54421 -1.602796      5.923675      -1.602796      5.923675      -1.602796      5.923675  92.56036 61.54421 92.56036 61.54421 -0.000000      0.000000 
1 1 1 -14 0  5  o 387.7008 46.54467 30.67006       6.740657      30.67006       6.740657      30.67006       6.740657  387.7008 46.54467 387.7008 46.54467 0.000000       0.000000 
1 1 1 -14 0  6  o 381.0054 49.53056 29.84237       6.986712      29.84237       6.986712      29.84237       6.986712  381.0054 49.53056 381.0054 49.53056 0.000000       0.000000 
1 1 1 -14 0  7  o 194.3753 83.20203 10.64756       6.416097      10.64756       6.416097      10.64756       6.416097  194.3753 83.20203 194.3753 83.20203 -0.000000      0.000000 
1 1 1 -14 0  8  o 154.9200 83.27277 6.858543       6.916361      6.858543       6.916361      6.858543       6.916361  154.9200 83.27277 154.9200 83.27277 -0.000000      0.000000 
1 1 1 -14 0  9  o 774.5731 31.83758 117.5340       9.540242      117.5340       9.540242      117.5340       9.540242  774.5731 31.83758 774.5731 31.83758 0.000000       0.000000 
1 1 1 -14 0  10 o 576.8760 39.86516 65.91658       8.833141      65.91658       8.833141      65.91658       8.833141  576.8760 39.86516 576.8760 39.86516 -0.000000      0.000000 
1 1 1 -14 0  11 o 595.9941 40.25381 70.32130       9.219461      70.32130       9.219461      70.32130       9.219461  595.9941 40.25381 595.9941 40.25381 0.000000       0.000000 
1 1 1 -14 0  12 o 1617.897 28.42500 510.3000       17.84748      510.3000       17.84748      510.3000       17.84748  1617.897 28.42500 1617.897 28.42500 0.000000       0.000000 
1 1 1 -14 0  13 o 843.4315 37.18164 139.6817       12.12499      139.6817       12.12499      139.6817       12.12499  843.4315 37.18164 843.4315 37.18164 -0.000000      0.000000 
1 1 1 -14 0  14 o 1395.219 29.72595 379.9093       16.09018      379.9093       16.09018      379.9093       16.09018  1395.219 29.72595 1395.219 29.72595 0.000000       0.000000 
1 1 1 -14 0  15 o 461.2080 60.83377 44.05082       10.36885      44.05082       10.36885      44.05082       10.36885  461.2080 60.83377 461.2080 60.83377 0.000000       0.000000 
1 1 1 -14 0  16 o 368.4661 87.64768 31.20261       10.88517      31.20261       10.88517      31.20261       10.88517  368.4661 87.64768 368.4661 87.64768 0.000000       0.000000 
1 1 1 -14 0  17 o 105.2982 73.18967 -8.782380      10.57401      -8.782380      10.57401      -8.782380      10.57401  105.2982 73.18967 105.2982 73.18967 0.000000       0.000000 
1 1 1 -14 0  18 o 100.1859 70.97472 -13.92448      11.46913      -13.92448      11.46913      -13.92448      11.46913  100.1859 70.97472 100.1859 70.97472 -0.000000      0.000000 
1 1 1 -14 0  19 o 687.2867 74.20119 97.87312       19.22067      97.87312       19.22067      97.87312       19.22067  687.2867 74.20119 687.2867 74.20119 0.000000       0.000000 
1 1 1 -14 0  20 o 314.3697 141.8564 30.85310       18.59410      30.85310       18.59410      30.85310       18.59410  314.3697 141.8564 314.3697 141.8564 -0.000000      0.000000 
1 1 1 -14 0  21 o 153.8143 97.05475 3.356238       12.32085      3.356238       12.32085      3.356238       12.32085  153.8143 97.05475 153.8143 97.05475 0.000000       0.000000 
1 1 1 -14 0  22 o 419.3586 83.31745 39.64183       12.05247      39.64183       12.05247      39.64183       12.05247  419.3586 83.31745 419.3586 83.31745 -0.000000      0.000000 
1 1 1 -14 0  23 o 394.7118 90.65899 36.70223       12.10067      36.70223       12.10067      36.70223       12.10067  394.7118 90.65899 394.7118 90.65899 0.000000       0.000000 
1 1 1 -14 0  24 o 130.3326 90.60249 -10.27217      16.21892      -10.27217      16.21892      -10.27217      16.21892  130.3326 90.60249 130.3326 90.60249 -0.000000      0.000000 
1 1 1 -14 0  25 o 193.3164 106.3205 12.71523       11.53593      12.71523       11.53593      12.71523       11.53593  193.3164 106.3205 193.3164 106.3205 -0.000000      0.000000 
1 1 1 -14 0  26 o 87.89132 63.13488 -15.00132      10.36776      -15.00132      10.36776      -15.00132      10.36776  87.89132 63.13488 87.89132 63.13488 0.000000       0.000000 
1 1 1 -14 0  27 o 131.2462 84.72211 2.711897       10.05716      2.711897       10.05716      2.711897       10.05716  131.2462 84.72211 131.2462 84.72211 0.000000       0.000000 
1 1 1 -14 0  28 o 81.73093 58.98083 -14.55267      9.541713      -14.55267      9.541713      -14.55267      9.541713  81.73093 58.98083 81.73093 58.98083 0.000000       0.000000 
1 1 1 -14 0  29 o 124.2690 81.19989 2.609427       9.636291      2.609427       9.636291      2.609427       9.636291  124.2690 81.19989 124.2690 81.19989 -0.000000      0.000000 
1 1 1 -14 1  1  o 385.5939 27.79495 29.27769       4.134301      30.43919       5.869303      28.13384       5.824522  390.5850 39.22388 374.9755 40.64802 15.60944       56.48693 
1 1 1 -14 1  2  o 381.1668 28.91550 28.65903       4.248405      33.79136       5.947762      23.31284       6.070419  411.9885 37.58794 338.8532 47.42920 73.13522       60.51762 
1 1 1 -14 1  3  o 405.4487 27.67742 32.37773       4.331983      27.42848       6.074543      37.49949       6.179503  369.1419 43.18976 434.1842 37.00115 -65.04230      56.87214 
1 1 1 -14 1  4  o 97.38607 45.38766 -3.717492      4.198050      -3.422370      5.807604      -4.040451      6.075319  121.1838 55.35604 121.8373 56.01033 -0.6535110     78.74928 
1 1 1 -14 1  5  o 1131.576 24.35638 250.6337       10.70346      0.000000       0.000000      250.6337       10.70346  ?        ?        1131.576 24.35638 0.000000       24.35638 
1 1 1 -14 1  6  o 687.4408 21.49027 92.34929       5.737270      91.61769       8.191336      93.05380       8.038279  682.4023 30.90909 687.9655 30.08627 -5.563232      43.13416 
1 1 1 -14 1  7  o 1018.935 18.35504 202.5566       7.263232      199.5018       10.35312      205.5172       10.19229  1008.670 26.42980 1024.062 25.62818 -15.39191      36.81491 
1 1 1 -14 1  8  o 541.7036 26.64710 57.55775       5.605826      53.18139       7.962019      61.85977       7.894089  516.0135 40.04508 557.9688 36.63391 -41.95526      54.27386 
1 1 1 -14 1  9  o 411.9395 34.47204 33.73698       5.464089      37.74517       7.726451      29.72684       7.728326  431.8253 46.82286 380.1168 53.85973 51.70850       71.36701 
1 1 1 -14 1  10 o 880.8091 21.46524 151.6723       7.342526      151.0848       10.60017      152.2141       10.18035  875.8292 31.16488 879.6289 29.80129 -3.799683      43.12038 
1 1 1 -14 1  11 o 807.7731 23.53184 127.7737       7.381988      137.3611       10.87214      119.5731       10.05508  833.9112 33.57122 778.1619 33.27268 55.74933       47.26625 
1 1 1 -14 1  12 o 687.6064 28.69540 93.02513       7.662671      98.29292       11.09499      88.22090       10.59556  700.9814 40.93402 663.8039 41.30611 37.17749       58.15315 
1 1 1 -14 1  13 o 1344.933 21.04667 353.9355       10.99289      365.3723       15.97674      343.6531       15.14887  1360.985 30.22782 1320.376 29.54301 40.60925       42.26713 
1 1 1 -14 1  14 o 781.0865 27.50132 120.1882       8.342201      121.3910       12.02654      119.0729       11.58136  777.9034 39.94424 771.1198 38.79713 6.783569       55.68446 
1 1 1 -14 1  15 o 326.3639 60.27825 22.86830       7.358517      26.06258       10.39706      19.66237       10.41599  337.5550 80.45178 290.6360 86.13673 46.91901       117.8644 
1 1 1 -14 1  16 o 247.8750 73.02638 13.90058       7.505434      12.24363       10.59852      15.56743       10.63013  237.9759 87.41346 259.1576 88.23746 -21.18169      124.2053 
1 1 1 -14 1  17 o 771.3517 28.95098 118.2177       8.672488      123.5107       12.29162      112.9707       12.23806  778.8621 40.77871 743.2617 42.57495 35.60040       58.95362 
1 1 1 -14 1  18 o 646.3386 35.99117 84.56410       8.998249      85.62656       13.29992      83.66724       12.21951  634.0834 54.54086 630.8846 50.29201 3.198853       74.18890 
1 1 1 -14 1  19 o 359.3196 90.84815 33.00441       12.68455      22.40433       17.46926      44.82561       18.44806  282.5661 110.2354 390.5593 114.3274 -107.9932      158.8162 
1 1 1 -14 1  20 o 161.5374 77.35435 -10.38329      13.83504      -19.46345      18.43105      1.336680       20.93952  170.2656 83.31763 217.5019 101.3682 -47.23633      131.2149 
1 1 1 -14 1  21 o 137.6300 64.23409 -4.201070      8.455337      -8.925006      11.86913      0.6664635      12.04818  149.5778 71.63277 176.7898 80.35789 -27.21205      107.6506 
1 1 1 -14 1  22 o 298.0276 74.11967 22.99096       8.542802      20.87708       11.90649      25.23375       12.26414  259.9262 93.04288 284.5663 94.77754 -24.64008      132.8148 
1 1 1 -14 1  23 o 227.4445 78.22775 15.05926       8.358936      11.38305       11.69003      18.90538       11.95714  200.5093 85.42050 235.8159 91.42166 -35.30664      125.1183 
1 1 1 -14 1  24 o 362.8965 87.36938 42.14308       12.16543      58.64927       17.64526      27.18891       16.79523  366.2896 112.8781 233.4159 100.9496 132.8737       151.4341 
1 1 1 -14 1  25 o 168.3241 74.14774 8.565845       9.424127      7.651365       11.73782      10.22465       15.80876  166.1654 76.90984 173.8558 83.10110 -7.690384      113.2295 
1 1 1 -14 1  26 o 176.3186 71.42247 11.55326       7.604683      10.57326       10.59268      12.59557       10.92428  163.9942 74.85268 170.3181 77.05896 -6.323898      107.4291 
1 1 1 -14 1  27 f 161.6453 67.74093 10.77060       7.154883      3.997519       9.786928      18.54628       10.48630  133.5524 64.24186 177.8142 78.27599 -44.26180      101.2628 
1 1 1 -14 1  28 o 95.73113 47.76485 -6.504521      7.206298      -8.113604      9.851809      -4.652856      10.56837  103.9774 52.41867 110.5187 55.52888 -6.541283      76.36212 
1 1 1 -14 1  29 o 132.9022 60.36873 9.325791       6.785150      15.29579       9.793132      3.814181       9.409655  138.5995 66.01455 114.2508 56.59382 24.34865       86.95276 
1 1 1 -14 2  1  o 394.5330 27.55403 30.63357       4.195280      30.52667       5.686020      30.76130       6.215288  391.5432 37.86674 392.1064 41.44397 -0.5632019     56.13816 
1 1 1 -14 2  2  o 154.0877 53.73593 4.325173       3.950780      0.7407861      5.501317      8.142598       5.677334  140.1098 59.09260 200.9823 64.32394 -60.87245      87.34704 
1 1 1 -14 2  3  o 349.1175 31.61580 24.15258       4.240007      26.14580       5.778147      21.82714       6.241132  360.6854 42.03951 326.5121 50.87707 34.17328       65.99845 
1 1 1 -14 2  4  o 315.8210 36.83644 19.96092       4.433116      23.49361       6.283118      16.45898       6.255718  339.3906 49.09691 279.9798 59.37487 59.41080       77.04468 
1 1 1 -14 2  5  o 394.2631 31.21081 30.76038       4.739743      24.39639       6.810209      36.73886       6.600717  344.6570 52.54169 428.6243 40.12069 -83.96729      66.10824 
1 1 1 -14 2  6  o 427.7499 29.10006 36.09974       4.805320      39.97507       7.050494      32.73793       6.566760  446.8471 41.08899 403.5806 42.53870 43.26651       59.14259 
1 1 1 -14 2  7  o 487.1968 28.41803 46.76153       5.353495      44.89681       7.629922      48.56973       7.513392  473.3638 41.93887 493.3018 39.55149 -19.93805      57.64711 
1 1 1 -14 2  8  o 420.4710 33.45847 35.08174       5.418290      31.37235       8.012280      38.20757       7.355072  390.6550 54.27892 435.6022 44.08493 -44.94717      69.92626 
1 1 1 -14 2  9  o 502.3332 30.19519 49.81006       5.863216      54.00632       8.644929      46.23559       7.978758  518.7945 43.30380 479.7719 43.28879 39.02258       61.23021 
1 1 1 -14 2  10 o 143.7366 60.13393 1.201903       5.623983      12.69628       8.692619      -7.073482      7.375679  245.3813 79.70024 125.4576 59.01369 119.9237       99.17028 
1 1 1 -14 2  11 o 772.6575 24.39798 116.9793       7.320974      117.7824       10.69083      116.2701       10.04606  771.3491 35.68886 767.1682 33.71920 4.180908       49.09867 
1 1 1 -14 2  12 o 603.4026 31.06220 71.98147       7.254234      70.79832       10.43802      73.08680       10.08895  592.3144 45.73135 602.9943 43.37261 -10.67993      63.02809 
1 1 1 -14 2  13 o 124.2148 58.19281 -6.180457      7.049519      -10.09916      10.33613      -2.772276      9.639351  145.3562 68.82274 162.5642 73.07373 -17.20799      100.3810 
1 1 1 -14 2  14 o 553.4385 36.14842 61.22317       7.726709      62.25309       11.10026      60.25505       10.76202  549.4952 52.66153 541.0107 51.85779 8.484558       73.90850 
1 1 1 -14 2  15 o 518.5525 37.92065 54.13001       7.583578      44.87967       10.81414      63.08083       10.63763  458.3700 62.36969 552.9603 50.07962 -94.59036      79.98717 
1 1 1 -14 2  16 o 691.3107 30.60125 94.96935       8.215621      107.3476       12.36515      85.18613       10.99283  724.9603 44.12951 645.5597 44.11167 79.40063       62.39594 
1 1 1 -14 2  17 o 230.4486 74.50642 12.05090       7.602391      24.08512       11.19094      1.737642       10.35990  313.4387 88.21152 180.6649 78.70606 132.7738       118.2198 
1 1 1 -14 2  18 o 363.2582 61.74830 29.13553       8.399227      13.91251       11.93168      44.08914       11.82563  244.1544 92.14884 439.8724 71.69598 -195.7180      116.7550 
1 1 1 -14 2  19 o 625.6492 55.03130 84.21555       13.23513      103.1464       18.23888      63.15940       19.23546  672.0404 70.95638 482.9460 105.5103 189.0944       127.1504 
1 1 1 -14 2  20 o 167.5703 79.60286 -8.130290      14.05294      -30.19133      18.63596      20.95067       21.39652  156.7995 78.00366 268.0888 114.9205 -111.2892      138.8931 
1 1 1 -14 2  21 o 216.3565 78.01280 11.57875       8.385372      7.039933       11.52575      16.68273       12.22229  197.7337 84.54215 244.9981 93.07246 -47.26437      125.7373 
1 1 1 -14 2  22 o 291.9695 74.40656 22.22075       8.461341      15.62253       11.26188      30.77311       12.82154  231.0727 88.96391 314.5427 96.10221 -83.46992      130.9588 
1 1 1 -14 2  23 o 156.8052 69.45312 3.095523       8.380263      13.67661       11.67743      -8.140786      12.03356  209.9152 87.13489 143.0465 69.39577 66.86865       111.3924 
1 1 1 -14 2  24 o 213.2264 88.63998 17.42547       12.10983      5.696037       16.90188      29.79800       17.35904  177.3385 85.07343 238.0592 102.7943 -60.72072      133.4322 
1 1 1 -14 2  25 o 132.9173 66.97122 -17.91138      15.95874      0.000000       0.000000      -17.91138      15.95874  ?        ?        132.9173 66.97122 0.000000       66.97122 
1 1 1 -14 2  26 o 148.3767 66.03996 6.328141       7.667049      15.91362       10.82522      -3.320021      10.86056  182.1262 79.86714 128.8187 63.22574 53.30751       101.8639 
1 1 1 -14 2  27 o 100.8980 50.02263 -6.797692      7.409661      -7.858779      10.86992      -5.876663      10.12715  114.1140 57.19291 114.5615 57.07439 -0.4474487     80.79923 
1 1 1 -14 2  28 o 100.8823 49.58221 -2.827142      6.751564      -1.162584      9.699697      -4.391590      9.403498  113.4144 56.39703 107.5276 53.78909 5.886734       77.93517 
1 1 1 -14 2  29 o 123.8959 57.85528 7.223581       6.874019      8.884097       9.867674      5.658043       9.581312  123.2318 60.43972 117.2799 57.91273 5.951904       83.70689 
1 1 1 -14 3  1  o 260.6750 47.98646 13.93337       4.678873      7.617937       7.857524      17.40290       5.823971  207.0374 75.38432 290.4939 53.59895 -83.45654      92.49672 
1 1 1 -14 3  2  o 504.6904 23.12126 49.77260       4.531734      48.81510       6.172081      50.89253       6.675118  497.3621 32.12615 507.3752 34.07447 -10.01312      46.83118 
1 1 1 -14 3  3  o 383.9247 30.71993 29.13291       4.541941      29.15822       6.308400      29.10567       6.544662  380.8113 43.43314 379.9162 45.24800 0.8951111      62.72017 
1 1 1 -14 3  4  o 614.4208 21.52869 73.73754       5.137022      72.08344       7.233953      75.42020       7.296140  604.8503 30.89950 619.6041 30.32152 -14.75372      43.29173 
1 1 1 -14 3  5  o 681.8322 20.79518 90.78391       5.506406      87.45394       7.916943      93.90425       7.663698  667.0327 30.56204 691.7330 28.52804 -24.70026      41.80774 
1 1 1 -14 3  6  o 158.3546 58.26920 4.200279       4.712354      7.511358       6.916750      1.332078       6.437572  200.1952 70.99479 153.3227 64.25450 46.87251       95.75438 
1 1 1 -14 3  7  o 450.0490 30.45480 40.00373       5.291512      35.15479       7.763908      44.21000       7.231122  416.1384 48.97886 470.4580 39.95628 -54.31964      63.20944 
1 1 1 -14 3  8  o 309.0043 45.74290 19.45235       5.323442      23.25503       8.148027      16.62028       7.031697  331.2827 65.65294 279.0597 65.93124 52.22308       93.04427 
1 1 1 -14 3  9  o 323.6788 45.49625 21.31047       5.561078      13.44596       8.434984      27.35707       7.396122  251.1560 78.15071 364.4809 53.87545 -113.3249      94.92153 
1 1 1 -14 3  10 o 666.5517 25.78470 87.11192       6.674578      100.0703       10.04511      76.86787       8.931308  710.0777 36.55078 621.8748 37.15132 88.20288       52.11699 
1 1 1 -14 3  11 o 218.4552 65.67841 10.04873       6.023752      -2.695777      8.748099      21.53979       8.306769  155.7110 69.83124 316.2042 69.53702 -160.4931      98.54846 
1 1 1 -14 3  12 o 505.1098 35.17805 50.76777       6.857506      53.55284       10.06803      48.35758       9.365944  512.0742 51.31778 486.8672 50.25808 25.20700       71.82889 
1 1 1 -14 3  13 o 712.1982 28.24996 99.88312       7.813518      95.70164       11.25250      103.7766       10.85802  690.0804 42.19029 720.4760 38.95107 -30.39557      57.42131 
1 1 1 -14 3  14 o 466.3323 39.98493 43.85291       7.171318      41.06626       10.62782      46.18231       9.716846  438.7680 64.27676 471.6849 54.01907 -32.91687      83.96166 
1 1 1 -14 3  15 o 349.4186 56.00060 25.86681       7.342526      31.51946       10.81688      21.03658       9.999074  373.7426 77.08453 301.0895 82.89088 72.65317       113.1942 
1 1 1 -14 3  16 o 609.4286 33.15967 74.32684       7.818504      83.80772       11.45057      66.04588       10.70147  638.2800 46.51437 564.3132 49.32658 73.96686       67.79896 
1 1 1 -14 3  17 o 263.5605 72.60415 16.03631       7.668523      2.339228       11.06594      28.69130       10.63666  187.3482 81.48286 348.8161 80.19674 -161.4680      114.3284 
1 1 1 -14 3  18 o 511.4080 42.75496 53.96491       8.413558      23.64326       12.12857      82.09083       11.68117  303.2268 93.60686 626.3993 48.39365 -323.1725      105.3764 
1 1 1 -14 3  19 o 199.4359 87.34515 4.065881       12.91040      3.917772       18.39631      4.209622       18.12290  220.0721 99.74509 219.9706 99.41268 0.1015015      140.8260 
1 1 1 -14 3  20 o 307.2078 99.48689 26.86381       13.55064      30.44040       17.82259      21.96374       20.86111  308.7050 113.3610 270.2897 114.5922 38.41531       161.1896 
1 1 1 -14 3  21 o 192.2289 76.64283 7.873735       8.609572      2.573290       12.42245      12.77312       11.94323  183.7920 82.75320 224.0002 89.93707 -40.20816      122.2161 
1 1 1 -14 3  22 o 489.8542 65.29837 57.95122       12.11278      57.95122       12.11278      0.000000       0.000000  489.8542 65.29837 ?        ?        0.000000       65.29837 
1 1 1 -14 3  23 o 148.2037 67.14916 1.220242       8.329369      5.680966       11.28957      -4.108603      12.33932  176.2056 79.15417 152.5049 73.03544 23.70070       107.7012 
1 1 1 -14 3  24 o 313.5667 91.92288 34.82352       11.91839      35.19638       16.96390      34.46007       16.74845  257.7766 105.8139 256.5407 105.2038 1.235901       149.2127 
1 1 1 -14 3  25 o 132.2011 62.25533 -0.1828126     8.250130      -4.877902      11.16393      5.466419       12.24588  133.2626 65.13295 159.1357 75.21542 -25.87309      99.49704 
1 1 1 -14 3  26 o 260.3286 73.80708 23.44006       7.804602      23.66836       10.92165      23.20183       11.15685  215.0362 86.12231 210.3393 86.01556 4.696915       121.7199 
1 1 1 -14 3  27 o 318.1214 64.19496 32.29304       7.657430      23.02871       10.64199      42.23935       11.02674  192.4187 81.72623 298.4657 88.66470 -106.0470      120.5844 
1 1 1 -14 3  28 o 158.6876 66.71600 12.73503       6.976447      18.19098       10.47318      8.383004       9.353811  155.7546 72.28757 132.1079 63.35211 23.64671       96.11963 
1 1 1 -14 3  29 o 118.8550 56.19165 5.915591       6.842888      2.117012       9.694501      9.687338       9.660201  110.7928 55.29914 124.5728 60.82171 -13.78000      82.20265 
1 1 1 -14 4  1  o 858.5968 20.68197 143.8178       6.896188      141.2279       11.69753      145.1974       8.537660  846.9639 35.56323 861.6543 25.51396 -14.69043      43.76877 
1 1 1 -14 4  2  o 109.0407 49.86427 -2.982511      4.728920      -3.958152      7.922813      -2.442573      5.893946  143.7441 65.27045 127.1903 57.15960 16.55374       86.76089 
1 1 1 -14 4  3  o 807.8710 18.90782 127.2739       5.932141      128.8597       8.396780      125.6938       8.381868  811.1812 26.65428 801.0809 26.94241 10.10028       37.89913 
1 1 1 -14 4  4  o 114.3007 50.14437 -0.8506601     4.271074      -7.359604      5.978689      5.933263       6.103672  108.1344 51.52503 183.4315 66.49378 -75.29715      84.12046 
1 1 1 -14 4  5  o 617.8743 22.26365 74.60155       5.342252      78.32014       7.977912      71.57863       7.193068  629.9714 32.72189 602.7244 30.83356 27.24707       44.96032 
1 1 1 -14 4  6  o 754.6898 20.23920 111.1892       5.931846      115.3916       8.726632      107.5798       8.087564  766.5733 29.31332 740.4994 28.12322 26.07391       40.62249 
1 1 1 -14 4  7  o 437.6250 29.97707 37.80591       5.064011      40.91523       7.738056      35.47671       6.697336  450.9690 44.77513 420.6943 41.53505 30.27475       61.07350 
1 1 1 -14 4  8  o 488.4152 29.97979 47.05972       5.659013      38.66515       8.545187      53.61725       7.552534  435.7116 51.49607 519.1592 37.71730 -83.44754      63.83134 
1 1 1 -14 4  9  o 452.2831 34.51276 40.60811       6.016269      37.14200       8.760113      43.70247       8.277003  425.6570 54.22487 465.3152 46.42311 -39.65817      71.38236 
1 1 1 -14 4  10 o 142.6748 59.98775 1.003079       5.640863      -0.9563954     8.900087      2.318677       7.292665  164.6963 72.31605 166.7631 69.01080 -2.066788      99.96050 
1 1 1 -14 4  11 o 557.0657 30.78885 61.31359       6.634969      65.31399       10.32580      58.50032       8.659202  568.5577 47.19157 540.2715 41.58999 28.28619       62.90288 
1 1 1 -14 4  12 o 411.8170 41.80141 34.19374       6.592678      32.79633       9.747588      35.37190       8.950266  392.7467 66.26661 412.4514 57.43608 -19.70468      87.69360 
1 1 1 -14 4  13 o 397.6315 46.70161 32.29052       7.074435      28.21458       10.54907      35.62178       9.536852  356.2997 78.36841 410.8190 61.68105 -54.51929      99.73043 
1 1 1 -14 4  14 f 461.0330 39.72823 42.88282       7.043649      37.83628       10.31102      47.29826       9.644773  419.8353 65.36773 477.6964 52.87585 -57.86105      84.07613 
1 1 1 -14 4  15 o 359.9900 54.01361 27.31311       7.318290      35.14470       10.74915      20.54654       9.991572  398.0074 72.20227 296.9415 83.27404 101.0659       110.2168 
1 1 1 -14 4  16 o 137.7907 62.44100 -2.549850      7.205549      -1.341065      10.44532      -3.647343      9.952873  170.3365 76.35367 158.3085 72.37376 12.02795       105.2038 
1 1 1 -14 4  17 o 200.3305 74.83236 8.058214       7.827606      19.86620       11.61370      -1.770960      10.59598  282.5959 92.13976 168.4303 76.07687 114.1656       119.4882 
1 1 1 -14 4  18 o 383.5958 59.51297 32.21556       8.578456      27.52163       12.77298      36.07253       11.57835  325.6452 95.07521 390.3901 79.07985 -64.74490      123.6645 
1 1 1 -14 4  19 o 220.7927 91.12544 9.680044       12.66644      16.72786       17.17941      1.285100       18.74950  257.6745 106.2108 214.0296 98.39384 43.64487       144.7829 
1 1 1 -14 4  20 o 603.9702 63.05426 82.44153       14.57160      74.76613       19.41605      92.33958       22.04881  526.1915 98.63838 581.2819 101.3575 -55.09045      141.4315 
1 1 1 -14 4  21 o 648.9624 54.90715 93.74107       13.70829      0.000000       0.000000      93.74107       13.70829  ?        ?        648.9624 54.90715 0.000000       54.90715 
1 1 1 -14 4  22 o 122.5615 59.10874 -8.023063      8.414226      3.786199       11.29918      -22.72416      12.60697  176.0267 79.12123 125.4077 62.66500 50.61900       100.9310 
1 1 1 -14 4  23 o 109.5162 53.91724 -11.39001      8.096527      -19.92467      11.30944      -2.416765      11.59639  117.9208 58.98822 152.3569 72.35706 -34.43609      93.35500 
1 1 1 -14 4  24 o 164.4320 75.71819 5.099949       11.16608      10.02056       15.95564      0.3770513      15.63180  182.6178 86.17360 163.0019 79.08052 19.61583       116.9599 
1 1 1 -14 4  25 o 262.5480 74.86407 22.42853       8.006031      7.349974       10.95759      39.69572       11.72589  161.7966 74.68409 323.9877 89.98433 -162.1911      116.9397 
1 1 1 -14 4  26 o 167.4809 70.17771 10.65189       7.677332      -5.289116      11.11957      25.17332       10.61292  124.5081 61.64730 223.8117 86.30797 -99.30361      106.0634 
1 1 1 -14 4  27 o 295.5751 68.07919 29.90708       7.653509      22.99390       10.82365      36.82039       10.82374  187.5517 81.07692 262.2974 89.03872 -74.74576      120.4216 
1 1 1 -14 4  28 o 262.2782 68.72594 26.75104       7.084589      33.03018       9.980184      20.37294       10.05852  226.3602 84.50900 163.9907 74.09232 62.36951       112.3897 
1 1 1 -14 4  29 o 118.8526 56.30806 6.156023       6.939543      15.12592       9.875274      -2.594641      9.753846  135.4189 64.98071 103.5655 52.20424 31.85339       83.35332 
1 1 1 -14 5  1  o 473.3914 29.28245 44.07562       5.356958      58.84675       9.206415      36.51445       6.586854  543.2552 44.01574 428.2194 40.07407 115.0358       59.52576 
1 1 1 -14 5  2  o 439.8502 30.90840 38.14840       5.246171      16.68427       8.376109      52.00360       6.729642  279.4989 75.42137 513.1326 33.96230 -233.6338      82.71530 
1 1 1 -14 5  3  o 657.4393 24.43884 84.51182       6.239708      78.61612       10.11369      88.13507       7.928504  628.6786 41.66016 670.1044 30.46637 -41.42572      51.61171 
1 1 1 -14 5  4  o 198.2543 55.74384 8.145478       4.471125      11.05825       6.441534      5.437449       6.211016  229.8746 67.63296 180.3009 66.79476 49.57365       95.05659 
1 1 1 -14 5  5  o 253.9961 48.63895 13.29187       4.623050      12.68998       6.847689      13.79598       6.266819  244.8083 69.03949 255.3966 63.46303 -10.58823      93.77637 
1 1 1 -14 5  6  o 773.9047 20.66338 116.9319       6.210360      115.7129       8.912092      118.0827       8.658929  767.5889 29.89668 775.7408 28.74217 -8.151855      41.47197 
1 1 1 -14 5  7  o 592.4045 25.14670 68.70927       5.785318      71.53365       8.737945      66.50479       7.719696  600.2867 37.67297 579.7706 34.44062 20.51605       51.04320 
1 1 1 -14 5  8  o 541.4029 27.65183 57.64840       5.794575      51.63012       8.845362      62.17285       7.669404  506.7848 45.42533 560.0624 35.44400 -53.27756      57.61716 
1 1 1 -14 5  9  o 103.0749 49.04428 -6.460590      5.376550      2.887744       8.557133      -12.55833      6.911075  180.7604 74.77499 104.4723 51.10055 76.28815       90.56801 
1 1 1 -14 5  10 o 475.1143 34.16026 44.79836       6.260929      46.68278       9.675723      43.44100       8.211858  478.0229 53.01303 463.7138 46.21553 14.30911       70.32963 
1 1 1 -14 5  11 o 641.2477 28.20146 80.83346       7.023045      81.02156       10.67230      80.68978       9.327212  635.3013 43.51862 636.4992 37.90508 -1.197937      57.71191 
1 1 1 -14 5  12 o 493.4808 35.60953 48.52907       6.778558      37.16172       10.21543      57.47190       9.060758  419.0206 64.87239 533.7228 44.10931 -114.7021      78.44781 
1 1 1 -14 5  13 o 308.2126 58.32968 20.14841       6.726115      16.77711       10.36971      22.59694       8.837327  273.2431 86.87820 320.2666 72.71372 -47.02353      113.2921 
1 1 1 -14 5  14 o 324.4805 56.20819 22.30079       6.826407      13.20312       10.45373      29.06445       9.013569  246.9713 87.31175 366.3364 65.77335 -119.3651      109.3137 
1 1 1 -14 5  15 o 301.9202 62.55238 19.89675       7.093258      15.09512       10.66676      23.70338       9.497504  257.0741 88.37216 322.0229 76.98750 -64.94882      117.2037 
1 1 1 -14 5  16 o 312.8461 62.64397 21.52109       7.345495      13.08935       10.76754      28.86087       10.04614  241.9834 88.22528 355.1642 75.17850 -113.1809      115.9116 
1 1 1 -14 5  17 o 230.5641 75.05498 12.15243       7.707259      17.44637       11.62936      8.005951       10.29215  266.6228 92.23810 209.2804 83.67908 57.34239       124.5394 
1 1 1 -14 5  18 o 304.9836 80.63940 22.55111       9.696807      37.27584       16.96432      15.40548       11.81770  362.2181 110.5164 251.5010 92.31602 110.7171       144.0004 
1 1 1 -14 5  19 o 328.5841 97.28740 29.30787       13.29219      35.82325       17.73052      20.94734       20.08485  342.4736 113.9537 272.8986 113.8597 69.57507       161.0884 
1 1 1 -14 5  20 o 126.2935 62.02947 -15.91644      10.51092      -18.19195      12.21299      -9.416649      20.64108  134.7672 66.32394 193.2128 93.02937 -58.44566      114.2512 
1 1 1 -14 5  21 o 156.8277 69.32479 1.545755       8.308818      21.01677       11.78881      -17.67383      11.71245  266.6662 92.83332 129.6776 64.03387 136.9886       112.7757 
1 1 1 -14 5  22 f 354.2426 63.51714 30.59389       8.417140      45.17389       11.89734      15.98301       11.90994  413.1507 76.98280 226.8074 90.23360 186.3433       118.6105 
1 1 1 -14 5  23 o 332.6479 79.04528 31.93277       10.06074      25.19221       16.85739      35.66198       12.53863  236.3344 101.6752 324.1245 94.07523 -87.79018      138.5207 
1 1 1 -14 5  24 o 147.4225 70.58801 -1.067255      11.51397      2.207021       16.58444      -4.114002      15.99784  166.1310 80.79522 154.8765 76.16023 11.25447       111.0326 
1 1 1 -14 5  25 o 220.0061 88.56036 23.11196       11.61278      23.11196       11.61278      0.000000       0.000000  220.0061 88.56036 ?        ?        0.000000       88.56036 
1 1 1 -14 5  26 o 109.1665 53.37109 -4.643396      7.512022      -16.22902      10.85749      5.995051       10.40421  107.1943 54.16051 145.0643 68.78983 -37.86996      87.55227 
1 1 1 -14 5  27 o 117.5690 56.10608 1.383909       7.145925      19.07163       10.17967      -15.79998      10.03364  173.7068 76.76249 98.85042 50.17638 74.85637       91.70686 
1 1 1 -14 5  28 o 111.1028 53.22747 1.972827       6.567402      5.403105       9.345901      -1.373326      9.230590  122.4978 59.81204 109.5652 54.56958 12.93257       80.96493 
1 1 1 -14 5  29 f 90.39442 45.13354 -4.526099      6.481391      -5.079453      8.880901      -3.895489      9.480604  97.80432 49.36440 100.7631 50.87511 -2.958794      70.88809 
1 1 1 -14 6  1  o 572.3085 25.31177 64.02061       5.625754      58.85247       9.261779      67.04227       7.081909  543.3719 44.27532 583.8218 31.34975 -40.44983      54.25045 
1 1 1 -14 6  2  o 106.9374 49.24398 -3.418726      4.723246      -1.826275      7.780308      -4.348140      5.943859  151.5675 67.03743 119.3410 55.05832 32.22646       86.74927 
1 1 1 -14 6  3  o 333.0779 40.47350 22.24117       5.127755      34.67109       8.697401      15.61859       6.348472  412.0786 55.78146 272.8661 61.39383 139.2124       82.95043 
1 1 1 -14 6  4  o 182.0796 58.40625 6.589834       4.678755      4.131604       6.891825      8.691351       6.372200  176.0108 69.07682 208.5449 68.26302 -32.53406      97.11564 
1 1 1 -14 6  5  o 1179.988 17.69547 271.3864       8.109009      294.7366       12.25163      253.1827       10.81754  1227.147 25.70805 1137.775 24.48184 89.37219       35.50020 
1 1 1 -14 6  6  o 475.0399 28.76572 44.42724       5.281790      45.59243       7.963704      43.51218       7.057318  477.1460 43.45324 467.3585 39.24654 9.787506       58.55318 
1 1 1 -14 6  7  o 835.0071 20.21972 136.1001       6.556821      158.3833       10.48589      121.7936       8.402038  897.9293 30.07011 788.1640 27.44985 109.7653       40.71494 
1 1 1 -14 6  8  o 620.6920 24.97170 75.43322       6.019386      75.12221       9.157625      75.66982       7.987280  614.7665 38.55209 618.7999 33.36016 -4.033447      50.98199 
1 1 1 -14 6  9  o 906.1880 20.90890 160.4295       7.358300      167.5472       11.46217      155.4397       9.596933  922.3146 32.00071 889.9197 27.76858 32.39484       42.36909 
1 1 1 -14 6  10 o 367.3434 43.66096 27.28424       6.106662      37.73765       9.762231      20.56431       7.827124  425.8115 60.75710 310.0872 66.95635 115.7243       90.41338 
1 1 1 -14 6  11 o 693.1284 26.92084 94.36289       7.246535      99.38466       11.29789      90.85291       9.445413  704.7295 41.46338 676.1479 36.10146 28.58154       54.97752 
1 1 1 -14 6  12 o 364.3046 45.95117 27.08677       6.356517      27.68377       9.849999      26.66072       8.321110  355.8688 73.69724 354.3181 62.77047 1.550751       96.80606 
1 1 1 -14 6  13 o 233.7864 68.73935 11.88858       6.655918      15.20768       9.930321      9.181164       8.968737  261.2624 85.20157 217.7652 80.34621 43.49719       117.1103 
1 1 1 -14 6  14 o 329.2265 53.32841 22.81082       6.585172      23.97760       9.669882      21.80174       8.992634  325.0092 77.67081 310.8662 75.28712 14.14294       108.1707 
1 1 1 -14 6  15 o 469.0180 40.17449 44.68288       7.246961      40.94750       10.79212      47.75046       9.779970  433.1795 66.25841 476.9767 53.73340 -43.79724      85.30800 
1 1 1 -14 6  16 o 179.8106 71.54689 5.096262       7.488826      10.85080       11.37682      0.6963891      9.948004  229.8883 89.16108 174.0596 76.44048 55.82875       117.4429 
1 1 1 -14 6  17 o 120.5014 57.77185 -8.962490      7.767827      -25.80366      11.05605      7.454757       10.91602  117.1837 58.57485 208.6382 85.17372 -91.45442      103.3711 
1 1 1 -14 6  18 o 341.4486 73.81450 27.29153       9.502775      42.19366       16.08034      19.29446       11.77976  394.9413 103.5660 274.3240 92.88886 120.6174       139.1196 
1 1 1 -14 6  19 o 437.6869 81.43867 46.78715       13.33330      19.69670       17.28327      86.61080       20.95503  266.4503 107.7639 574.6337 97.37828 -308.1833      145.2432 
1 1 1 -14 6  20 o 265.2485 86.51244 18.87750       10.23812      6.277403       11.86020      55.72270       20.28129  197.1902 85.05750 409.5867 119.8666 -212.3965      146.9788 
1 1 1 -14 6  21 o 325.5064 68.31934 26.00676       8.361123      16.63356       11.65449      35.94724       12.00199  238.6155 90.82816 361.2099 86.66721 -122.5944      125.5427 
1 1 1 -14 6  22 o 210.4345 77.17935 12.34797       8.257624      4.150794       11.71932      20.43067       11.63720  175.5132 79.57494 248.8187 91.56644 -73.30548      121.3119 
1 1 1 -14 6  23 o 166.6574 75.98735 4.491295       10.87967      10.91670       17.86306      0.7021837      13.71748  192.9258 91.08093 164.3210 78.22817 28.60477       120.0641 
1 1 1 -14 6  24 o 304.5651 92.62379 35.21988       11.93006      37.58484       18.31430      33.47665       15.72376  243.0657 105.2692 248.1968 101.8762 -5.131104      146.4935 
1 1 1 -14 6  25 o 130.8400 61.08294 1.116067       7.654958      8.520680       11.13147      -5.527477      10.54390  161.2981 74.74154 126.2902 62.04786 35.00790       97.14029 
1 1 1 -14 6  26 o 85.64103 43.43129 -17.19902      7.399740      -20.27386      10.53059      -14.19982      10.40025  100.2537 50.94093 106.5428 53.73045 -6.289108      74.04013 
1 1 1 -14 6  27 o 88.81071 44.59670 -9.943289      6.767950      -15.48650      9.743831      -4.775962      9.407672  97.01189 49.26410 109.9455 54.81198 -12.93356      73.69739 
1 1 1 -14 6  28 o 100.1802 49.19316 -1.747172      6.599514      -2.696473      9.374130      -0.8143020     9.292648  106.7081 53.42687 109.4941 54.56927 -2.785965      76.36908 
1 1 1 -14 7  1  o 269.7447 41.35982 14.68506       4.194495      16.83248       5.578231      11.89119       6.362704  286.4355 52.06446 238.5299 66.29762 47.90561       84.29758 
1 1 1 -14 7  2  o 1142.652 19.80828 254.5736       8.790000      244.5607       14.50187      260.3886       11.05151  1115.714 33.46903 1154.328 24.65269 -38.61475      41.56839 
1 1 1 -14 7  3  o 1017.479 20.00638 201.9055       7.905364      207.6831       13.71639      199.0318       9.673636  1027.567 34.37176 1009.062 24.68561 18.50494       42.31781 
1 1 1 -14 7  4  o 390.4334 35.97533 30.27766       5.393453      23.99856       9.052407      33.73332       6.715537  336.2714 71.51792 410.4794 42.75451 -74.20804      83.32323 
1 1 1 -14 7  5  o 775.1552 21.27310 117.2979       6.403943      123.3726       9.268155      111.7479       8.858792  792.8653 30.09996 754.5526 30.23131 38.31268       42.66075 
1 1 1 -14 7  6  o 259.5263 51.29950 13.93365       4.987107      18.07997       7.686616      10.91946       6.553743  291.3047 69.00625 228.6294 68.45487 62.67529       97.20047 
1 1 1 -14 7  7  o 356.8883 37.29586 25.43030       5.092811      27.38702       7.864508      24.01717       6.683419  364.0437 57.53983 342.3864 51.88983 21.65726       77.48152 
1 1 1 -14 7  8  f 132.0651 56.62464 0.7861293E-01  5.196798      4.320094       8.251362      -2.709929      6.690452  186.8395 74.84749 134.9500 60.74925 51.88945       96.39822 
1 1 1 -14 7  9  o 513.1910 31.18725 52.02689       6.186150      53.41954       9.525263      51.01102       8.135311  514.0448 48.27993 504.7021 41.88448 9.342651       63.91605 
1 1 1 -14 7  10 o 210.1941 64.35468 9.220463       5.746118      2.170157       9.322289      13.54034       7.297166  182.4631 76.93797 250.7653 71.46211 -68.30226      105.0061 
1 1 1 -14 7  11 o 281.6259 55.44335 16.66812       5.848015      19.87491       9.724778      14.85155       7.319312  298.6257 81.55403 261.4098 70.48759 37.21591       107.7941 
1 1 1 -14 7  12 o 179.8698 67.04238 5.643288       6.275988      -19.13419      9.649661      23.80769       8.262170  118.3424 58.37771 332.1985 66.36459 -213.8560      88.38673 
1 1 1 -14 7  13 o 537.3118 32.29714 57.44971       6.708059      51.23470       10.48137      61.76143       8.730171  495.8412 55.37700 553.2017 40.92650 -57.36041      68.85921 
1 1 1 -14 7  14 o 291.7023 62.25959 18.53217       6.838257      25.35752       10.41862      13.36651       9.063812  331.3200 81.52728 244.7197 81.47703 86.60028       115.2615 
1 1 1 -14 7  15 o 179.7108 70.18872 5.330096       7.088348      11.51877       11.19157      1.184484       9.159808  234.6822 89.08356 171.3684 74.33254 63.31377       116.0224 
1 1 1 -14 7  16 o 510.8981 40.15972 53.22685       7.903843      51.53878       11.77821      54.60977       10.66061  485.6198 64.01335 507.2650 54.99603 -21.64517      84.39355 
1 1 1 -14 7  17 o 195.6736 77.20545 6.940109       8.652439      12.61966       14.47260      3.780935       10.79385  242.8900 98.48052 190.6048 81.66228 52.28522       127.9341 
1 1 1 -14 7  18 o 222.5267 81.42085 11.28904       9.182390      30.68075       15.48069      0.7631965      11.40541  329.1664 106.3089 180.0925 80.32236 149.0739       133.2414 
1 1 1 -14 7  19 o 187.1511 83.26865 2.428030       12.17812      -4.895783      15.72001      13.42031       19.25874  183.6969 86.32703 243.7431 106.7168 -60.04613      137.2619 
1 1 1 -14 7  20 o 200.3625 82.21792 8.489766       10.23733      21.10625       12.11089      -23.08950      19.16055  270.2466 94.09217 164.1119 81.19682 106.1348       124.2830 
1 1 1 -14 7  21 o 228.0701 78.29955 14.11500       8.372427      13.36157       11.94949      14.84153       11.73424  218.6814 89.17593 226.0753 89.68433 -7.393875      126.4738 
1 1 1 -14 7  22 o 197.8919 75.77347 10.76748       8.141227      23.31529       11.68604      -1.065417      11.34825  261.9261 92.34518 156.5285 73.49141 105.3976       118.0196 
1 1 1 -14 7  23 o 198.7030 83.91240 13.36745       11.11602      -6.237819      16.60195      29.29905       14.96589  157.5988 77.51546 252.3634 100.9055 -94.76456      127.2422 
1 1 1 -14 7  24 o 202.3639 85.78689 17.48387       11.68984      28.58652       18.03191      9.434937       15.35316  212.8422 97.34666 173.0580 82.49030 39.78426       127.5971 
1 1 1 -14 7  25 o 254.4209 73.64960 22.00322       7.694021      17.88531       11.59926      25.23862       10.28150  188.7844 82.73289 237.0906 86.24615 -48.30617      119.5121 
1 1 1 -14 7  26 o 143.5817 63.57438 6.952475       7.015800      10.62256       10.61131      4.102184       9.351375  152.4969 71.42774 134.5758 64.21117 17.92111       96.04684 
1 1 1 -14 7  27 o 103.2871 50.62077 -2.597009      6.882067      -11.22686      10.01592      5.121382       9.472243  101.8280 51.51624 127.4992 61.78674 -25.67120      80.44579 
1 1 1 -14 7  28 o 127.5275 58.84485 7.409166       6.793665      0.5011622      9.356094      15.11364       9.880746  110.5324 55.03293 141.1968 66.97939 -30.66446      86.68831 
1 1 1 -14 8  1  o 557.0091 23.07674 60.56482       4.991886      56.80718       6.769886      65.04237       7.389988  537.0866 32.61140 574.6737 33.25483 -37.58710      46.57668 
1 1 1 -14 8  2  o 668.1236 20.85851 87.06985       5.412129      84.42627       7.593937      89.79863       7.715319  656.3705 29.79133 677.0242 29.34416 -20.65369      41.81631 
1 1 1 -14 8  3  o 871.1087 21.70562 148.0982       7.342985      143.4949       12.67543      150.4233       9.008601  852.9186 38.26723 876.8420 26.45502 -23.92340      46.52148 
1 1 1 -14 8  4  o 654.8561 25.10948 83.86209       6.385746      97.06175       11.49392      77.96877       7.680105  698.6931 42.56273 630.1789 31.38162 68.51416       52.88092 
1 1 1 -14 8  5  o 793.2216 27.32140 123.2487       8.416384      0.000000       0.000000      123.2487       8.416384  ?        ?        793.2216 27.32140 0.000000       27.32140 
1 1 1 -14 8  6  o 544.6514 26.42965 58.09625       5.590336      67.23332       8.482465      51.08033       7.432945  582.2028 37.71914 507.0587 38.02318 75.14407       53.55834 
1 1 1 -14 8  7  o 348.7979 40.23916 24.41453       5.350690      37.27551       8.261645      15.12219       7.022508  428.4333 50.63301 266.3014 67.74245 162.1319       84.57388 
1 1 1 -14 8  8  o 283.0326 49.71568 16.50294       5.265196      20.77018       8.982121      14.26906       6.498828  309.5254 75.41604 258.8803 64.79406 50.64511       99.42761 
1 1 1 -14 8  9  o 859.4513 21.15773 144.3674       7.061847      154.9785       11.41944      137.7966       8.986150  886.2891 33.17733 837.7521 27.62041 48.53705       43.16969 
1 1 1 -14 8  10 o 448.9950 34.95634 40.12822       6.047263      36.57776       9.759623      42.34083       7.704486  417.7985 62.03396 458.1442 43.83772 -40.34576      75.96024 
1 1 1 -14 8  11 o 310.8208 52.13174 20.10160       6.069931      13.12949       9.537633      24.84789       7.869297  247.9165 83.58436 342.3404 61.44831 -94.42381      103.7412 
1 1 1 -14 8  12 o 560.8694 30.98154 62.39829       6.722110      68.70527       10.80968      58.42142       8.583666  580.0443 48.42996 538.2160 41.38365 41.82831       63.70296 
1 1 1 -14 8  13 o 493.1675 36.88538 48.85509       7.013272      45.18726       10.55194      51.75750       9.386557  461.7161 60.28682 501.5766 48.80645 -39.86047      77.56655 
1 1 1 -14 8  14 o 273.1937 63.84758 16.43321       6.652213      16.36843       10.04748      16.48377       8.876302  265.6314 85.63017 267.6625 79.55890 -2.031097      116.8852 
1 1 1 -14 8  15 o 476.7436 40.08422 46.26216       7.352531      53.59307       11.19811      40.70682       9.748126  500.8647 58.68227 435.5498 59.16193 65.31485       83.32912 
1 1 1 -14 8  16 o 175.7630 76.63644 1.439463       9.841137      0.000000       0.000000      1.439463       9.841137  ?        ?        175.7630 76.63644 0.000000       76.63644 
1 1 1 -14 8  17 o 487.0152 47.63519 49.65896       8.894102      47.30282       15.00410      50.93540       11.04355  435.9673 91.53400 483.3120 60.13787 -47.34460      109.5219 
1 1 1 -14 8  18 f 275.6302 79.17530 18.65163       8.922781      9.425426       15.18116      23.52101       11.02885  226.4625 96.93121 302.3677 88.36501 -75.90523      131.1641 
1 1 1 -14 8  19 o 143.0284 67.73109 -6.929291      10.01849      -9.985871      12.04257      -0.5884241E-01 18.05485  149.8839 71.87827 202.5819 94.31851 -52.69803      118.5853 
1 1 1 -14 8  20 o 274.3550 76.91048 19.54251       8.524565      19.59680       12.42259      19.49419       11.71924  256.6577 94.58257 258.2508 92.32265 -1.593109      132.1716 
1 1 1 -14 8  21 o 207.0548 77.09875 11.47138       8.295968      10.40735       11.91672      12.47199       11.55613  202.3046 86.21650 211.2500 87.09697 -8.945404      122.5527 
1 1 1 -14 8  22 o 108.7613 53.41955 -10.55440      7.796793      -13.10711      10.99861      -7.975783      11.05427  126.5731 62.41662 136.7578 66.38335 -10.18478      91.11851 
1 1 1 -14 8  23 o 138.1906 66.96609 -5.096248      11.12501      6.516073       17.01539      -13.76679      14.70299  176.6266 84.89739 138.6976 69.04510 37.92900       109.4294 
1 1 1 -14 8  24 o 126.4375 60.99394 -3.394393      8.973275      -8.813199      11.33387      5.707584       14.68907  126.5339 62.57684 161.7359 78.02618 -35.20202      100.0197 
1 1 1 -14 8  25 o 238.7586 74.21067 20.52209       7.608292      20.76693       11.78276      20.34701       9.963981  193.8484 84.19490 206.3053 82.38924 -12.45686      117.7997 
1 1 1 -14 8  26 o 160.7873 66.88142 10.70934       6.900301      10.89868       10.62442      10.57121       9.074776  149.3888 70.44006 151.5910 69.22672 -2.202240      98.76305 
1 1 1 -14 8  27 o 105.8239 51.13367 -0.3023993     6.370195      1.050730       9.859569      -1.271983      8.346047  117.4959 58.15295 109.9824 54.26079 7.513519       79.53614 
1 1 1 -14 8  28 o 107.4879 51.95670 1.828944       6.592072      -6.385223      9.438159      9.652775       9.211179  99.68910 50.38367 127.3278 61.51547 -27.63874      79.51520 
1 1 1 -14 9  1  o 608.5043 22.81791 72.27544       5.392217      83.76469       7.660215      60.99068       7.591739  653.8155 30.16878 555.8846 35.35012 97.93085       46.47350 
1 1 1 -14 9  2  o 195.8472 56.37706 7.880862       4.519705      3.010529       6.138248      13.64827       6.679678  162.2835 64.71115 254.6205 66.73971 -92.33698      92.96086 
1 1 1 -14 9  3  o 677.5842 24.05269 89.71217       6.329289      91.34889       10.41795      88.75462       7.968472  678.9905 39.68119 672.6792 30.50275 6.311279       50.05013 
1 1 1 -14 9  4  o 842.1296 22.14149 138.4749       7.241253      149.3058       12.67278      133.2242       8.823586  869.9445 37.51045 824.7573 27.54805 45.18713       46.53954 
1 1 1 -14 9  5  o 181.4809 59.91982 6.441404       4.905839      -11.87980      6.952874      24.60566       6.923029  106.9786 52.09193 346.6084 53.12530 -239.6298      74.40340 
1 1 1 -14 9  6  o 498.6145 32.40960 49.10960       6.241697      58.50034       12.75358      46.15191       7.157456  532.7103 62.85783 481.5829 38.59437 51.12738       73.76064 
1 1 1 -14 9  7  o 462.2429 30.98459 42.20014       5.529978      34.27453       8.482361      48.05877       7.292870  408.8638 54.79961 491.2439 38.53645 -82.38004      66.99294 
1 1 1 -14 9  8  o 384.7268 36.57116 29.53498       5.398389      38.21032       8.553508      23.79163       6.959594  432.6456 51.94627 339.1569 54.70000 93.48865       75.43543 
1 1 1 -14 9  9  o 377.3695 39.26405 28.58925       5.670007      47.28527       9.526957      18.33472       7.055656  481.2147 51.79430 293.2256 63.77532 187.9891       82.15802 
1 1 1 -14 9  10 o 365.7810 41.43331 27.04211       5.781898      31.18106       9.589954      24.67836       7.247232  382.0361 67.08496 343.6688 56.24685 38.36725       87.54485 
1 1 1 -14 9  11 o 258.8609 60.16624 14.38168       5.933541      -4.512994      9.324782      27.23756       7.691657  152.8987 69.95730 360.2529 56.86398 -207.3542      90.15285 
1 1 1 -14 9  12 o 258.2075 62.04439 14.46708       6.144114      26.28936       10.11531      7.555250       7.734375  341.6972 77.95105 200.8336 74.51033 140.8637       107.8339 
1 1 1 -14 9  13 o 360.3963 49.26370 27.00102       6.714456      14.90150       10.44921      35.51078       8.763108  256.7311 87.48303 410.1301 56.51995 -153.3990      104.1527 
1 1 1 -14 9  14 o 192.2869 69.50356 7.321757       6.661782      1.910404       9.744734      12.06968       9.127856  179.1127 77.18005 234.1279 81.67683 -55.01517      112.3738 
1 1 1 -14 9  15 o 529.5369 36.94300 56.68197       7.549647      51.90589       11.04789      60.86624       10.34078  492.0702 58.98859 540.3339 49.84093 -48.26373      77.22547 
1 1 1 -14 9  16 o 465.5043 46.91249 45.13145       8.365257      69.39277       14.52643      33.09406       10.23217  558.4755 68.40737 381.3170 71.72877 177.1585       99.11904 
1 1 1 -14 9  17 o 243.1004 78.79556 14.08813       8.498832      27.45916       15.52081      8.362054       10.15689  312.8491 106.6201 208.2992 83.18387 104.5500       135.2309 
1 1 1 -14 9  18 o 109.0266 54.14267 -18.03254      8.822177      -16.41629      15.51244      -18.80520      10.72561  160.3548 78.02179 123.8090 61.16240 36.54578       99.13747 
1 1 1 -14 9  19 o 427.4924 63.44020 42.09241       10.21272      42.28358       12.28106      41.66386       18.38800  410.4944 79.91201 351.3673 116.0059 59.12708       140.8663 
1 1 1 -14 9  20 o 137.6022 63.23393 -1.869940      7.733525      4.272511       10.95108      -7.980586      10.92269  179.5858 79.47624 142.4304 68.34380 37.15538       104.8206 
1 1 1 -14 9  21 o 345.4667 64.07150 29.50396       8.279537      32.79097       12.12949      26.63626       11.32948  323.5152 92.11316 290.2117 90.61650 33.30350       129.2137 
1 1 1 -14 9  22 o 275.3607 74.29174 21.71605       8.127920      18.87644       11.38966      24.66280       11.60253  228.7374 89.07267 260.5256 91.99706 -31.78821      128.0523 
1 1 1 -14 9  23 o 136.8652 66.61935 -5.202092      11.34062      -10.89039      18.26421      -1.632962      14.46741  150.4267 75.20562 153.9460 75.00153 -3.519318      106.2126 
1 1 1 -14 9  24 o 154.8724 69.35844 6.618499       8.598165      -3.010605      10.72767      23.91590       14.37814  132.7176 64.64278 203.1397 90.42363 -70.42215      111.1536 
1 1 1 -14 9  25 o 148.6961 64.68566 7.241275       6.976761      11.39022       10.63985      4.111772       9.240692  159.9341 73.74336 138.0932 65.29059 21.84085       98.49337 
1 1 1 -14 9  26 o 134.8313 60.59227 6.175036       6.622727      1.695755       10.13554      9.512354       8.748661  124.7968 61.21680 144.9999 66.86154 -20.20313      90.65298 
1 1 1 -14 9  27 o 167.9790 67.21449 14.02253       6.645820      1.937374       9.887778      23.98058       8.975525  117.0504 57.98652 193.0989 77.81244 -76.04849      97.04232 
1 1 1 -14 10 1  o 765.7804 23.60472 114.5291       7.019903      130.0354       8.547086      82.38699       12.30556  815.2526 26.99590 641.3745 49.79428 173.8781       56.64141 
1 1 1 -14 10 2  o 473.2487 31.57379 44.14531       5.769579      42.29583       7.389715      47.03301       9.233786  460.6148 41.76476 483.3411 49.91097 -22.72632      65.07996 
1 1 1 -14 10 3  o 384.7170 38.85028 29.50800       5.724968      32.77174       9.372115      27.56526       7.230820  397.9261 62.72392 367.9155 52.06052 30.01068       81.51434 
1 1 1 -14 10 4  o 298.6471 50.25514 18.27456       5.621655      24.20635       9.677004      15.25298       6.906600  335.8912 75.96426 268.2704 66.60085 67.62088       101.0259 
1 1 1 -14 10 5  o 358.0216 37.81613 25.59643       5.178356      30.09777       7.501939      21.49969       7.156847  384.3386 51.56118 321.2191 59.56426 63.11948       78.78107 
1 1 1 -14 10 6  o 868.9011 20.06205 147.3784       6.769767      155.4582       10.07432      140.7259       9.141328  889.7980 29.15388 847.0154 27.79009 42.78259       40.27702 
1 1 1 -14 10 7  o 215.3208 66.04801 9.654176       6.049245      -5.260689      11.90473      14.84575       7.023589  174.6499 79.57529 263.1650 68.17423 -88.51515      104.7853 
1 1 1 -14 10 8  o 779.0107 25.02580 118.9632       7.571107      136.2200       14.81459      112.8627       8.808259  822.9019 46.54762 757.2266 29.95272 65.67523       55.35202 
1 1 1 -14 10 9  o 410.5017 36.05036 33.66470       5.688935      30.74202       8.775963      35.78299       7.471327  382.3311 61.16737 419.4757 46.65340 -37.14459      76.92845 
1 1 1 -14 10 10 o 312.8538 49.95519 20.28385       5.865288      39.03404       9.474910      8.634765       7.468237  432.3152 57.88818 208.9132 73.80457 223.4020       93.79848 
1 1 1 -14 10 11 o 425.2578 38.79584 36.43234       6.336628      40.64088       10.04319      33.64899       8.167513  438.6280 60.57513 402.0641 53.64614 36.56390       80.91512 
1 1 1 -14 10 12 o 350.9455 47.28156 25.44795       6.280054      32.21930       10.02094      21.06855       8.058936  383.2735 69.89980 308.8497 68.93658 74.42377       98.17450 
1 1 1 -14 10 13 o 411.2457 43.14552 34.60003       6.788062      25.38106       10.51500      41.18720       8.888277  330.3209 82.27617 443.8387 52.58890 -113.5178      97.64712 
1 1 1 -14 10 14 o 269.2594 67.07816 16.23913       6.988303      28.10228       10.51412      6.850853       9.353317  348.0642 79.52340 201.2509 79.99644 146.8133       112.7981 
1 1 1 -14 10 15 o 565.8775 35.31212 64.54079       7.721478      58.54770       11.58807      69.32655       10.35527  523.0262 58.02866 578.9929 46.44414 -55.96667      74.32619 
1 1 1 -14 10 16 o 468.6022 47.49683 45.92386       8.524225      47.81261       15.00427      45.02371       10.35818  440.0404 90.81174 454.5437 60.15664 -14.50330      108.9293 
1 1 1 -14 10 17 o 611.6459 38.13839 76.51566       9.014087      88.07240       16.18078      71.31514       10.85440  624.0107 67.86385 581.4711 48.51015 42.53961       83.41904 
1 1 1 -14 10 18 o 171.5981 71.87727 4.115574       8.049010      4.332925       11.87605      3.930909       10.94670  191.6900 83.86752 185.8589 80.93842 5.831085       116.5538 
1 1 1 -14 10 19 o 401.8201 65.93227 38.20376       9.931679      21.39421       12.19486      71.31452       17.11525  268.9373 94.37364 517.2396 88.37894 -248.3023      129.2951 
1 1 1 -14 10 20 o 483.1489 64.95772 56.51772       11.87940      56.51772       11.87940      0.000000       0.000000  483.1489 64.95772 ?        ?        0.000000       64.95772 
1 1 1 -14 10 21 o 303.0615 68.50975 24.01889       7.873852      26.82907       11.37966      21.43775       10.90605  285.1313 91.04807 253.9258 89.23958 31.20551       127.4890 
1 1 1 -14 10 22 o 210.5793 79.42401 14.48091       8.860171      18.61559       11.53720      8.536632       13.83341  221.5750 88.59563 180.8169 83.62163 40.75806       121.8268 
1 1 1 -14 10 23 o 138.2068 67.12572 -3.432252      11.34688      -14.20403      17.19703      4.873132       15.10044  141.1848 70.92275 163.4999 78.93620 -22.31516      106.1177 
1 1 1 -14 10 24 o 123.2454 58.36055 -0.4259839     7.436673      6.701825       10.56925      -7.414670      10.46560  152.9631 71.53138 121.0121 59.89683 31.95101       93.29721 
1 1 1 -14 10 25 o 110.0168 53.11963 -2.056280      6.842029      -0.6936359     10.27816      -3.140641      9.168771  125.7056 61.65926 117.5402 57.77152 8.165466       84.49505 
1 1 1 -14 10 26 o 101.9032 49.91628 -2.975302      6.665893      3.773723       9.750275      -8.897976      9.133878  125.7109 61.31713 102.0695 51.32987 23.64140       79.96590 
1 1 1 -14 10 27 o 110.2007 52.93924 1.936300       6.595298      1.783865       9.577121      2.073798       9.095801  114.5375 56.79964 114.5142 56.52443 0.2323151E-01  80.13245 
1 1 1 -14 11 1  o 168.0511 61.96793 4.679075       5.333586      9.468863       6.254216      -8.093206      10.21290  215.3817 67.33929 152.4422 70.96196 62.93954       97.82729 
1 1 1 -14 11 2  o 223.4668 55.95320 10.42709       4.844953      13.73274       7.129124      7.590046       6.604506  254.6283 69.94678 200.1956 69.49645 54.43266       98.60178 
1 1 1 -14 11 3  o 559.0056 27.64902 61.23590       6.002385      67.53366       7.562940      50.51764       9.866425  584.9037 33.43370 499.7310 51.58065 85.17270       61.46850 
1 1 1 -14 11 4  o 421.7618 41.16290 35.59204       6.656249      43.19236       9.679148      28.77278       9.168326  459.9176 55.29976 370.0767 66.22402 89.84085       86.27679 
1 1 1 -14 11 5  o 582.0323 28.41401 66.49065       6.422551      51.56398       10.47337      75.48673       8.130771  502.8294 54.50639 617.8380 34.01776 -115.0086      64.25072 
1 1 1 -14 11 6  o 286.0992 49.00331 16.85021       5.248805      17.37100       7.821055      16.42343       7.080007  283.7385 71.11627 277.0209 66.62555 6.717529       97.44993 
1 1 1 -14 11 7  o 771.1195 21.84285 116.3049       6.541223      116.0955       9.878784      116.4684       8.728932  766.8057 33.17342 769.4678 29.21075 -2.662109      44.20117 
1 1 1 -14 11 8  o 523.3353 28.66011 54.05509       5.802724      53.55343       8.955084      54.41819       7.618558  514.7681 45.25476 521.9921 37.83900 -7.223999      58.98969 
1 1 1 -14 11 9  f 353.9009 50.60894 25.86399       6.757564      21.71667       12.74833      27.48468       7.969285  306.3973 96.19746 361.4518 58.79368 -55.05453      112.7415 
1 1 1 -14 11 10 o 113.0921 52.80548 -4.816467      5.724360      -10.71327      9.134584      -1.003177      7.345652  131.8437 63.06121 148.0761 65.33326 -16.23238      90.80282 
1 1 1 -14 11 11 o 529.0183 31.07100 55.61985       6.355407      65.87091       9.892170      48.41439       8.293495  568.8566 45.14871 487.6621 44.27411 81.19449       63.23450 
1 1 1 -14 11 12 o 583.7919 30.15441 67.71024       6.813205      66.16074       10.38080      68.88281       9.030379  567.6776 47.52425 583.8429 40.06993 -16.16528      62.16232 
1 1 1 -14 11 13 o 218.4595 70.09177 10.43929       6.737940      0.1090103      10.45102      17.78752       8.814424  176.6710 77.94038 277.5551 78.34807 -100.8842      110.5130 
1 1 1 -14 11 14 o 495.5722 38.80043 49.84298       7.407808      41.93191       11.68842      55.15380       9.576765  432.4528 72.13804 515.4263 48.41090 -82.97348      86.87642 
1 1 1 -14 11 15 o 465.1417 45.37490 44.84864       8.092129      20.01949       14.26352      56.63331       9.826625  280.2781 101.6407 520.3192 49.21476 -240.0411      112.9289 
1 1 1 -14 11 16 o 344.4292 64.95504 26.71552       8.369802      26.15784       14.27643      27.00758       10.33159  309.5776 102.2173 334.1908 80.55080 -24.61319      130.1415 
1 1 1 -14 11 17 o 449.7718 49.88079 43.27213       8.565985      35.42862       14.52879      47.45140       10.60534  356.6342 100.5591 461.5317 60.63667 -104.8974      117.4263 
1 1 1 -14 11 18 o 129.1893 61.62859 -7.430024      8.605175      -0.4659387     10.97047      -18.56738      13.87344  167.5161 76.34976 143.8687 70.78108 23.64735       104.1117 
1 1 1 -14 11 19 o 198.4248 79.54443 9.376004       9.326632      -4.202003      11.50486      35.40525       15.92921  155.4258 73.29090 319.3056 108.0176 -163.8799      130.5349 
1 1 1 -14 11 20 o 676.3671 32.41768 94.65707       8.515152      96.43958       12.49879      93.11312       11.63233  655.4092 49.46971 649.1309 46.45002 6.278259       67.85909 
1 1 1 -14 11 21 o 325.0945 64.56749 27.20005       7.864342      15.51643       11.35180      37.98273       10.90535  213.1614 86.92013 362.6376 79.61672 -149.4762      117.8725 
1 1 1 -14 11 22 o 297.9273 89.57644 31.79882       11.20472      21.57826       16.63676      40.28323       15.15800  208.3251 94.59023 292.1915 104.9401 -83.86633      141.2790 
1 1 1 -14 11 23 o 137.5057 66.63341 -1.815156      11.01394      -18.06079      15.87881      13.24801       15.29001  130.4130 65.84479 175.3773 83.23030 -44.96426      106.1264 
1 1 1 -14 11 24 o 103.8725 51.10253 -6.508989      7.230346      -2.304873      10.14766      -10.84420      10.30466  126.6331 61.93596 112.5690 56.31041 14.06412       83.70738 
1 1 1 -14 11 25 o 170.0452 69.18891 12.64921       7.173182      8.223604       10.26032      16.88033       10.03235  142.1379 67.66431 170.6192 75.76098 -28.48135      101.5785 
1 1 1 -14 11 26 f 113.2251 53.95290 1.821961       6.556786      0.6057957      9.580346      2.893554       8.992900  116.6591 57.66309 120.3784 58.75385 -3.719223      82.32282 
1 1 1 -14 11 27 o 147.9942 63.85757 11.73502       6.689211      3.100449       9.571232      19.97945       9.352505  115.1732 57.05554 160.5899 72.09835 -45.41666      91.94296 
1 1 1 -14 12 1  o 403.8908 35.88298 32.41230       5.569722      31.70124       6.493454      34.39183       10.83441  397.5276 42.73199 403.4028 71.78855 -5.875214      83.54411 
1 1 1 -14 12 2  o 460.5308 32.35876 41.92262       5.750588      43.68618       6.760873      37.30880       10.93551  468.7807 37.44946 421.2612 69.25059 47.51947       78.72805 
1 1 1 -14 12 3  o 545.0260 25.98306 58.19267       5.499655      70.20787       8.143895      48.11932       7.456816  595.4271 35.37789 491.3347 39.41111 104.0923       52.96065 
1 1 1 -14 12 4  o 206.3361 62.15916 8.836563       5.391535      23.94954       9.179155      0.8762827      6.661804  333.5649 72.89520 152.7977 64.76694 180.7672       97.51137 
1 1 1 -14 12 5  o 1045.543 25.62960 214.2979       10.40667      213.4652       14.79980      215.1123       14.63607  1038.352 36.70145 1042.652 36.14574 -4.299805      51.51225 
1 1 1 -14 12 6  o 352.7938 40.14344 25.06267       5.402075      33.10681       7.958323      18.18917       7.356495  401.5903 52.26679 291.0556 66.53348 110.5347       84.60805 
1 1 1 -14 12 7  o 692.7873 23.27436 94.03004       6.261893      94.81796       9.009383      93.29369       8.709536  692.3990 33.50508 687.1306 32.63831 5.268433       46.77446 
1 1 1 -14 12 8  o 214.0473 63.80850 9.730675       5.703501      24.35246       8.784230      -0.9261945     7.499257  334.8841 69.80585 150.4865 66.22176 184.3976       96.21942 
1 1 1 -14 12 9  o 195.1408 65.90450 7.712214       5.929638      8.593234       8.981433      7.031479       7.894810  214.3643 80.14172 198.8252 74.97684 15.53905       109.7462 
1 1 1 -14 12 10 o 364.5680 43.81730 27.15324       6.079455      14.23680       9.377533      36.51778       7.984732  253.1983 82.80710 420.6382 49.84903 -167.4399      96.65372 
1 1 1 -14 12 11 o 428.9698 44.71855 37.64278       7.340245      55.38775       15.61153      32.60653       8.316899  492.8228 84.61734 393.3604 56.02636 99.46240       101.4842 
1 1 1 -14 12 12 o 420.6983 40.88065 36.00781       6.594736      43.20087       10.84053      31.78190       8.309103  447.2822 64.25298 386.8987 57.00911 60.38342       85.89811 
1 1 1 -14 12 13 o 402.3439 46.10104 33.47859       7.073383      4.008759       10.87883      55.06145       9.309957  195.2751 82.76830 516.5224 46.92400 -321.2473      95.14438 
1 1 1 -14 12 14 o 618.4210 35.18628 77.03038       8.415628      81.16142       14.98837      75.12844       10.17004  610.3800 64.19233 604.9773 43.57869 5.402710       77.58709 
1 1 1 -14 12 15 o 417.4822 48.89149 36.71336       7.776709      46.64882       14.36128      32.59130       9.250307  437.1761 87.63954 382.4476 64.58102 54.72849       108.8641 
1 1 1 -14 12 16 o 390.2171 53.21662 32.91101       7.854280      43.20416       14.03535      28.21793       9.477169  412.1485 90.19345 346.1491 72.80748 65.99936       115.9128 
1 1 1 -14 12 17 o 449.0666 44.86028 42.70692       7.718804      43.28872       11.72802      42.26233       10.25228  424.4401 73.83200 430.0989 63.27034 -5.658813      97.23323 
1 1 1 -14 12 18 o 348.7297 68.77058 29.50924       8.982681      24.08129       11.67565      37.38190       14.06124  286.9743 92.28671 353.6665 98.64921 -66.69217      135.0870 
1 1 1 -14 12 19 o 356.4728 70.57140 32.15714       9.424021      31.14085       11.90438      33.86330       15.42434  321.6566 91.13998 305.6280 106.1990 16.02863       139.9454 
1 1 1 -14 12 20 o 298.5352 87.30457 27.85763       10.76246      0.000000       0.000000      27.85763       10.76246  ?        ?        298.5352 87.30457 0.000000       87.30457 
1 1 1 -14 12 21 o 257.4031 81.25480 21.33389       9.083320      24.69147       11.40520      15.51064       15.02009  256.9647 91.16066 200.9722 90.69446 55.99252       128.5914 
1 1 1 -14 12 22 o 131.9180 64.27819 -5.283310      10.63627      -1.382219      16.04803      -8.339428      14.20410  155.1603 76.29591 140.1596 69.44643 15.00075       103.1692 
1 1 1 -14 12 23 o 124.2586 59.76286 -1.954974      8.462650      -10.75766      10.12577      18.43710       15.41172  114.5324 57.06162 179.7277 84.77386 -65.19531      102.1892 
1 1 1 -14 12 24 o 168.5364 68.26931 11.12508       6.947960      12.84012       9.789164      9.384062       9.863053  163.9907 73.68420 151.8376 70.35661 12.15306       101.8794 
1 1 1 -14 12 25 o 105.4441 51.31753 -2.087357      6.722144      -4.406773      9.398310      0.3420696      9.618611  111.1038 55.29123 120.2497 59.11721 -9.145935      80.94420 
1 1 1 -14 12 26 o 132.7748 60.52858 7.698149       6.899652      -1.884526      9.770012      17.23221       9.745198  110.7771 55.32592 155.0526 71.15344 -44.27549      90.13196 
1 1 1 -14 13 1  o 722.2320 23.16170 102.0014       6.496436      101.3190       7.640666      103.7817       12.34154  718.8141 27.37075 720.5669 44.31775 -1.752747      52.08858 
1 1 1 -14 13 2  o 724.2724 25.20607 102.7429       7.089816      106.5184       8.685015      95.20116       12.27484  736.0278 30.38424 688.8464 46.15131 47.18140       55.25527 
1 1 1 -14 13 3  o 342.4202 38.41043 23.51586       5.019775      25.80126       7.474203      21.63793       6.775225  352.8129 56.45306 322.6053 56.11619 30.20752       79.59884 
1 1 1 -14 13 4  o 266.0279 59.97980 14.99421       6.048711      17.49525       10.54490      13.76772       7.384356  282.0880 87.31506 252.8781 71.82655 29.20982       113.0618 
1 1 1 -14 13 5  o 132.7989 58.61665 -1.204666      5.918860      2.583375       10.18633      -3.135545      7.272568  190.5835 80.39661 138.9042 62.85744 51.67928       102.0523 
1 1 1 -14 13 6  o 226.6997 60.48573 10.95545       5.423809      15.40245       7.881128      6.954135       7.475765  265.4199 73.79053 197.3413 73.24625 68.07858       103.9714 
1 1 1 -14 13 7  o 763.7866 26.32338 114.6626       7.808034      112.2170       9.950004      118.5824       12.59682  752.5446 34.04576 768.3219 42.38113 -15.77734      54.36243 
1 1 1 -14 13 8  o 694.7388 24.56382 94.78422       6.627434      88.08263       9.975916      100.0787       8.866994  663.1045 38.90891 711.0599 32.11014 -47.95538      50.44764 
1 1 1 -14 13 9  o 454.6653 57.13995 43.28451       9.866415      43.28451       9.866415      0.000000       0.000000  454.6653 57.13995 ?        ?        0.000000       57.13995 
1 1 1 -14 13 10 f 330.3914 49.24965 22.69385       6.126081      23.44426       9.207355      22.09779       8.206023  323.3097 74.81422 316.8059 68.67829 6.503845       101.5573 
1 1 1 -14 13 11 o 261.9230 62.18660 14.99936       6.231114      18.51744       9.633094      12.46839       8.170647  282.7792 82.56841 237.2843 77.28008 45.49489       113.0918 
1 1 1 -14 13 12 o 573.9196 42.30207 67.08117       9.361995      0.000000       0.000000      67.08117       9.361995  ?        ?        573.9196 42.30207 0.000000       42.30207 
1 1 1 -14 13 13 o 197.7399 77.27694 7.012794       8.596298      0.000000       0.000000      7.012794       8.596298  ?        ?        197.7399 77.27694 0.000000       77.27694 
1 1 1 -14 13 14 o 491.4171 42.31758 49.69996       7.997290      65.66025       14.17510      42.24786       9.686021  541.8472 68.92289 442.3312 57.76527 99.51599       89.92881 
1 1 1 -14 13 15 o 153.0798 66.67482 0.9022015      7.431217      -12.42932      13.15879      7.144905       9.004558  154.8845 74.50002 196.1615 78.32759 -41.27701      108.0993 
1 1 1 -14 13 16 o 183.0683 80.92187 2.681390       11.32040      2.681390       11.32040      0.000000       0.000000  183.0683 80.92187 ?        ?        0.000000       80.92187 
1 1 1 -14 13 17 o 409.3863 47.95564 36.32046       7.479859      43.10653       11.09035      30.65779       10.13088  423.7133 69.83085 348.7451 76.87194 74.96820       103.8540 
1 1 1 -14 13 18 o 109.9503 54.46508 -15.27574      8.717285      -2.725550      10.92178      -37.30418      14.46971  155.2330 72.63150 120.8373 61.22121 34.39571       94.99143 
1 1 1 -14 13 19 o 336.1435 61.51168 27.58905       7.733989      14.88422       11.12248      39.48254       10.76148  218.9684 87.17287 385.7857 74.52636 -166.8174      114.6878 
1 1 1 -14 13 20 f 90.77018 45.73098 -18.36011      7.431946      -13.46716      11.23206      -22.17053      9.911998  126.0830 62.34283 104.7215 52.76654 21.36148       81.67580 
1 1 1 -14 13 21 o 127.5849 60.97789 -3.401795      8.507453      -7.067253      10.82197      2.528099       13.76467  131.4675 64.22861 161.5258 77.29832 -30.05832      100.5005 
1 1 1 -14 13 22 o 142.8102 68.58154 0.5718490      11.04820      -8.259212      16.44170      7.842146       14.91820  142.2627 71.15877 164.0693 79.02012 -21.80663      106.3379 
1 1 1 -14 13 23 o 113.2858 54.45834 -2.300785      7.006221      6.341909       9.676479      -11.82430      10.15761  147.4465 68.78226 110.6000 55.41047 36.84651       88.32508 
1 1 1 -14 13 24 o 189.6833 69.92773 14.74993       6.791207      11.94345       9.391790      17.82551       9.831741  156.2941 71.00573 177.4673 76.99437 -21.17322      104.7375 
1 1 1 -14 13 25 o 145.2007 62.86448 9.094969       6.527023      7.683733       9.017054      10.64829       9.460084  133.8372 63.63240 141.5975 66.67540 -7.760391      92.16665 
1 1 1 -14 14 1  o 319.7238 48.34430 20.90925       5.815312      19.54992       6.703181      25.04517       11.69240  305.5150 58.62855 335.0359 88.53191 -29.52087      106.1848 
1 1 1 -14 14 2  o 438.6650 35.30253 38.27410       5.963131      42.85266       7.033775      26.57391       11.24399  462.9746 39.49825 346.1629 84.40119 116.8116       93.18623 
1 1 1 -14 14 3  o 233.6081 68.72781 11.62078       6.651931      31.05740       8.356080      -22.00601      10.99094  386.8417 57.35906 126.1824 62.25594 260.6593       84.65142 
1 1 1 -14 14 4  o 989.2294 22.31628 191.5210       8.573277      198.3311       14.84619      188.1138       10.50119  999.0811 38.26365 978.3416 27.63886 20.73950       47.20184 
1 1 1 -14 14 5  o 228.3995 60.10905 11.12327       5.404144      15.17853       7.861897      7.490872       7.440711  263.5029 73.85795 201.0104 73.33207 62.49248       104.0797 
1 1 1 -14 14 6  o 322.4167 69.01597 22.55331       8.380761      22.55331       8.380761      0.000000       0.000000  322.4167 69.01597 ?        ?        0.000000       69.01597 
1 1 1 -14 14 7  o 528.1498 29.63075 55.21095       6.052994      66.63382       8.811430      45.00379       8.329350  576.2191 39.61663 470.2014 46.21108 106.0177       60.86823 
1 1 1 -14 14 8  o 622.8852 31.72947 77.01303       7.649938      79.05300       9.829875      73.88004       12.18192  626.8115 40.59976 598.6254 52.94616 28.18610       66.72058 
1 1 1 -14 14 9  o 439.9589 44.56038 39.48628       7.508567      34.27087       9.863886      46.67234       11.57843  398.4810 66.05357 466.3808 65.75111 -67.89975      93.20022 
1 1 1 -14 14 10 o 826.1757 27.46707 134.7711       8.812775      160.7216       16.43907      124.3055       10.43967  886.2288 47.94258 789.9573 34.02945 96.27148       58.79197 
1 1 1 -14 14 11 o 236.5591 70.19862 12.48350       6.914746      3.422937       12.71026      16.29246       8.240996  203.9892 88.02144 267.0287 75.88984 -63.03949      116.2198 
1 1 1 -14 14 12 o 246.2963 71.58981 13.78884       7.256387      5.990138       12.57127      17.68555       8.886219  211.7922 89.32700 274.9700 79.02085 -63.17783      119.2628 
1 1 1 -14 14 13 o 363.1905 53.45441 28.18097       7.314051      18.46493       13.15842      32.52505       8.798483  271.7164 97.75403 385.7981 60.73231 -114.0817      115.0837 
1 1 1 -14 14 14 o 168.9153 73.02956 2.050104       8.783822      0.000000       0.000000      2.050104       8.783822  ?        ?        168.9153 73.02956 0.000000       73.02956 
1 1 1 -14 14 15 o 565.2176 47.25435 67.68416       10.27739      0.000000       0.000000      67.68416       10.27739  ?        ?        565.2176 47.25435 0.000000       47.25435 
1 1 1 -14 14 16 o 137.4738 62.43345 -1.470453      7.252817      12.66618       10.75557      -13.25939      9.821955  223.7034 86.71199 125.1093 61.13638 98.59409       106.0973 
1 1 1 -14 14 17 o 119.7036 56.91159 -5.777482      7.212251      9.416917       11.14749      -16.71674      9.458650  201.8649 84.57322 113.8871 56.47205 87.97782       101.6943 
1 1 1 -14 14 18 o 355.4932 67.60325 31.71721       8.992028      35.82228       11.33966      24.76325       14.75896  356.7491 83.35094 259.0565 101.2517 97.69257       131.1460 
1 1 1 -14 14 19 o 164.1434 68.55835 5.750118       7.293122      2.889704       10.82888      8.124590       9.866262  164.0483 75.17970 181.5821 77.94308 -17.53383      108.2918 
1 1 1 -14 14 20 o 191.4517 76.54176 11.42310       8.610234      11.77011       10.74868      10.80167       14.38402  190.1246 81.47484 185.8541 85.71139 4.270554       118.2565 
1 1 1 -14 14 21 o 124.1240 61.24540 -9.002629      10.64468      -14.13489      16.67103      -5.469925      13.83126  139.3169 69.96338 142.3284 70.14864 -3.011490      99.07425 
1 1 1 -14 14 22 o 195.5238 82.94489 18.59402       10.94026      14.37898       15.24578      23.06869       15.70833  169.8735 81.30830 188.2142 87.74500 -18.34067      119.6254 
1 1 1 -14 14 23 o 116.3608 55.45682 -0.2932773     6.933795      -3.028772      9.282501      3.159731       10.42908  118.9813 58.40846 135.1063 65.31741 -16.12501      87.62370 
1 1 1 -14 14 24 o 111.0966 53.43304 -0.2433265     6.765327      2.456867       9.100437      -3.579159      10.11502  124.3269 60.32220 115.0033 57.25285 9.323563       83.16644 
1 1 1 -14 14 25 o 114.4308 54.13029 2.551737       6.366087      15.41065       8.790767      -11.62859      9.231402  157.2471 70.29707 96.75011 49.00448 60.49704       85.69199 
1 1 1 -14 15 1  o 717.0664 29.24262 101.0970       8.143359      120.2687       10.68360      74.51324       12.58039  779.9101 35.27320 604.4714 54.16526 175.4387       64.63803 
1 1 1 -14 15 2  o 781.9916 24.18838 119.8019       7.345762      125.8393       8.865760      106.5812       13.11957  800.0681 28.53389 727.5182 46.68163 72.54987       54.71158 
1 1 1 -14 15 3  o 243.4596 61.94077 12.65983       5.870562      12.86563       7.014606      12.17869       10.72548  244.4526 70.19519 245.8898 88.27721 -1.437149      112.7840 
1 1 1 -14 15 4  o 265.3092 67.95836 15.24984       7.033071      23.30777       9.061188      3.038873       11.15445  326.6809 73.23257 198.7299 83.99780 127.9510       111.4389 
1 1 1 -14 15 5  o 795.6848 23.04403 124.0758       7.120780      134.8881       10.95628      116.1686       9.369488  825.0894 34.19275 766.8773 31.46023 58.21210       46.46386 
1 1 1 -14 15 6  o 440.8237 39.91764 39.12511       6.759601      38.43643       12.07709      39.43927       8.156949  417.8114 77.27738 438.8897 48.67674 -21.07834      91.33028 
1 1 1 -14 15 7  o 550.5689 33.84831 60.38243       7.202232      75.05919       13.41107      54.43395       8.537910  599.9487 58.29619 518.7416 42.76221 81.20709       72.29836 
1 1 1 -14 15 8  o 479.7529 37.93970 46.28290       7.011028      54.58131       13.84571      43.42141       8.130448  499.3859 73.59891 460.8876 46.04071 38.49829       86.81328 
1 1 1 -14 15 9  o 134.5176 60.82885 -2.554589      6.796674      19.76351       12.70285      -11.50658      8.045118  288.4541 96.46566 118.1393 57.17590 170.3148       112.1370 
1 1 1 -14 15 10 o 408.3679 55.02665 35.21161       8.504579      23.42536       13.30690      43.35011       11.05761  307.8530 98.47270 446.5841 65.72281 -138.7311      118.3907 
1 1 1 -14 15 11 o 156.9151 67.05467 1.424603       7.243842      6.336529       12.83478      -0.8713931     8.775020  214.5212 90.35635 158.9522 70.70448 55.56902       114.7318 
1 1 1 -14 15 12 o 109.0406 52.98834 -10.60621      7.095957      -22.84766      13.14710      -5.574206      8.429159  137.6587 67.95003 137.3599 64.11694 0.2987671      93.42477 
1 1 1 -14 15 13 o 312.5385 61.07824 21.80199       7.147630      28.41313       10.76923      16.59679       9.555764  340.8968 82.28375 259.6379 83.48872 81.25885       117.2219 
1 1 1 -14 15 14 o 542.8365 35.10987 60.10187       7.361969      46.89953       11.36195      69.65583       9.665389  452.4189 66.66541 577.3759 43.42350 -124.9570      79.56052 
1 1 1 -14 15 15 o 422.5579 47.06756 38.35046       7.592639      34.32305       11.70928      41.27237       9.973587  362.8371 84.64772 424.0458 62.43190 -61.20871      105.1807 
1 1 1 -14 15 16 o 212.6301 78.55639 11.59086       8.579298      4.273221       19.48747      13.35012       9.555095  205.8813 96.54842 223.3482 82.82648 -17.46689      127.2078 
1 1 1 -14 15 17 o 609.7468 41.24548 79.67410       9.709394      81.85246       12.39854      76.21988       15.61283  598.8178 53.89212 539.8919 76.61324 58.92590       93.66936 
1 1 1 -14 15 18 o 307.1722 73.60207 25.66045       8.665109      32.62263       11.10031      14.79987       13.86401  329.0166 85.93577 211.7454 91.64769 117.2712       125.6354 
1 1 1 -14 15 19 o 151.9432 67.92249 3.262052       8.205791      -2.672343      10.21501      14.05851       13.77816  141.6765 67.46397 199.0778 88.57287 -57.40121      111.3398 
1 1 1 -14 15 20 o 237.4851 78.94386 19.14186       8.510199      19.72508       10.51372      18.03365       14.49270  223.3223 85.96420 198.6880 89.42888 24.63437       124.0458 
1 1 1 -14 15 21 o 207.1308 84.49635 19.60964       10.73318      28.96827       16.00316      11.95794       14.47033  209.2822 94.10644 170.0257 80.77132 39.25652       124.0162 
1 1 1 -14 15 22 o 121.6156 58.82596 -1.517547      8.486886      4.540118       14.54282      -4.646019      10.45110  145.4230 71.72337 122.3812 60.44159 23.04184       93.79461 
1 1 1 -14 15 23 o 290.5769 65.38957 27.62282       7.200707      33.09590       9.816136      21.24665       10.59509  265.9821 84.52301 184.9254 80.07861 81.05673       116.4333 
1 1 1 -14 15 24 o 136.4147 60.76412 7.225199       6.504877      9.569445       8.657145      4.185518       9.857961  140.9050 65.50543 126.0008 61.50175 14.90414       89.85225 
1 1 1 -14 16 1  o 932.9633 39.45373 173.1281       14.29488      0.000000       0.000000      173.1281       14.29488  ?        ?        932.9633 39.45373 0.000000       39.45373 
1 1 1 -14 16 2  o 421.4338 44.33786 35.93598       7.147746      35.03437       9.034698      37.44450       11.68638  410.1953 58.36030 415.6871 75.15757 -5.491852      95.15559 
1 1 1 -14 16 3  f 380.8081 51.76405 29.88851       7.456913      22.79056       9.595714      40.71006       11.84828  320.7897 77.82011 434.4753 72.79539 -113.6855      106.5605 
1 1 1 -14 16 4  o 542.1627 46.67200 59.65933       9.731066      77.74978       16.21424      49.47520       12.16561  603.7874 70.47484 482.6829 66.68053 121.1044       97.02059 
1 1 1 -14 16 5  o 171.2698 66.03204 4.582084       6.211106      -20.13560      11.55584      14.62376       7.365478  133.4055 65.42468 258.0527 71.18315 -124.6472      96.68211 
1 1 1 -14 16 6  o 550.6301 34.40147 60.46609       7.319535      44.06684       13.12446      67.86945       8.818277  445.4749 78.74329 581.1963 39.30001 -135.7214      88.00565 
1 1 1 -14 16 7  o 367.7053 49.82071 28.03860       6.931194      22.03053       12.63532      30.62471       8.289779  304.2393 95.81084 380.5222 57.92446 -76.28284      111.9596 
1 1 1 -14 16 8  o 239.0555 69.65735 12.66645       6.862338      5.702231       12.59135      15.60908       8.184715  213.9366 89.77005 262.6029 75.94558 -48.66626      117.5857 
1 1 1 -14 16 9  o 252.5070 69.31916 14.31066       7.004410      5.938700       12.59767      18.05697       8.427101  213.3553 89.67307 280.7330 75.60701 -67.37770      117.2931 
1 1 1 -14 16 10 o 199.2774 70.22480 8.288756       6.757266      0.1167040      12.49158      11.66930       8.034250  188.4930 84.06524 228.2786 76.71571 -39.78555      113.8080 
1 1 1 -14 16 11 o 147.2395 63.34112 0.9927331      6.541505      -3.627283      10.11988      4.308636       8.573429  157.9274 72.48584 180.4502 74.76263 -22.52280      104.1328 
1 1 1 -14 16 12 o 162.5536 68.62814 2.708909       7.432155      0.5441241      9.420746      6.276903       12.09456  166.4537 73.68697 204.8850 87.07563 -38.43132      114.0699 
1 1 1 -14 16 13 o 127.6727 58.60506 -2.798674      6.617295      -9.618634      9.978543      2.554891       8.840925  136.4205 65.42374 169.2605 73.22256 -32.84000      98.19271 
1 1 1 -14 16 14 o 270.2135 67.85580 17.58154       7.110693      13.90210       10.87226      20.33180       9.399763  231.4039 87.81205 278.9040 81.59821 -47.50014      119.8717 
1 1 1 -14 16 15 f 450.8563 42.35503 43.27804       7.329090      33.60411       11.15037      50.63682       9.725018  355.9820 82.30048 475.9712 53.54102 -119.9892      98.18355 
1 1 1 -14 16 16 o 212.0809 71.92850 11.75245       7.063467      23.69237       10.63527      2.329045       9.448256  281.9559 87.75674 162.7936 72.82024 119.1623       114.0352 
1 1 1 -14 16 17 o 263.5995 88.63492 22.40798       10.72479      7.240376       16.61388      33.24398       14.04259  192.5977 89.93926 301.1557 101.4217 -108.5580      135.5560 
1 1 1 -14 16 18 o 257.7916 88.30994 23.00279       10.64823      12.53980       15.92031      31.47235       14.32367  196.1820 90.36572 273.5188 101.4139 -77.33681      135.8335 
1 1 1 -14 16 19 o 158.1843 76.26842 0.8045060      13.98668      0.000000       0.000000      0.8045060      13.98668  ?        ?        158.1843 76.26842 0.000000       76.26842 
1 1 1 -14 16 20 o 185.1308 73.49835 11.96966       7.886551      8.657087       9.355078      20.10694       14.66238  165.4385 73.32415 194.2651 88.43496 -28.82655      114.8790 
1 1 1 -14 16 21 o 130.9533 61.80010 1.541086       8.209796      6.091806       13.46178      -1.153742      10.35924  150.5723 73.12752 130.8201 63.67574 19.75221       96.96512 
1 1 1 -14 16 22 o 111.2923 53.65147 -1.684100      6.915218      4.737236       9.386792      -9.305281      10.22623  136.3016 64.83905 110.9813 55.60089 25.32026       85.41406 
1 1 1 -14 16 23 o 92.66363 46.23625 -8.004076      6.755387      -8.256798      9.170673      -7.704253      9.988791  104.4598 52.37947 108.3055 54.35727 -3.845779      75.48724 
1 1 1 -14 17 1  o 491.7330 32.41009 47.99845       6.154543      48.62564       7.256808      46.39140       11.61615  492.8781 38.21078 468.1529 65.70091 24.72519       76.00443 
1 1 1 -14 17 2  o 383.4075 48.73005 30.16270       7.091892      30.40268       9.187763      29.80897       11.15493  377.4828 65.02016 365.3579 80.76530 12.12494       103.6854 
1 1 1 -14 17 3  o 919.1177 26.44166 166.1743       9.438170      159.8052       12.15573      175.8425       14.97662  897.0641 34.89230 936.9395 41.15990 -39.87537      53.95934 
1 1 1 -14 17 4  o 197.1548 72.84620 7.209539       7.377745      13.64663       9.830285      -1.092595      11.16390  250.2430 84.85462 180.0310 79.93076 70.21207       116.5729 
1 1 1 -14 17 5  o 253.9079 65.39776 14.11347       6.487947      17.83163       7.816512      5.878003       11.63304  283.3707 71.13509 211.4117 87.29747 71.95897       112.6102 
1 1 1 -14 17 6  o 316.6909 53.40597 21.15147       6.334643      24.12476       9.321692      18.60024       8.634769  327.4478 74.92572 286.3976 76.27241 41.05014       106.9175 
1 1 1 -14 17 7  o 276.9314 56.45150 16.48782       5.865290      25.23076       8.831306      9.587867       7.845477  336.8097 69.80984 214.1588 75.64694 122.6509       102.9363 
1 1 1 -14 17 8  o 142.0915 60.81233 0.8198008      5.974233      -16.78080      8.811076      15.79684       8.127897  113.3341 55.88379 262.0689 75.64982 -148.7348      94.05260 
1 1 1 -14 17 9  o 165.4843 64.43562 4.491841       5.959971      -3.625684      9.028828      10.76041       7.934212  149.7440 68.63285 220.4129 76.19126 -70.66896      102.5455 
1 1 1 -14 17 10 o 195.7259 67.82518 8.245633       6.289337      6.159520       9.469079      9.892442       8.413183  194.4248 79.34481 213.1932 77.94656 -18.76839      111.2262 
1 1 1 -14 17 11 o 165.4413 65.94966 4.436842       6.373626      9.726527       9.595909      0.2609710      8.525989  212.5276 82.03706 158.3021 70.08829 54.22548       107.9002 
1 1 1 -14 17 12 o 640.3539 44.02320 85.97768       10.88136      85.97768       10.88136      0.000000       0.000000  640.3539 44.02320 ?        ?        0.000000       44.02320 
1 1 1 -14 17 13 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -14 17 14 o 224.4713 77.75395 13.17799       8.265062      7.681596       10.56067      21.86599       13.27738  193.8811 81.82806 264.2319 97.70536 -70.35077      127.4448 
1 1 1 -14 17 15 o 128.5025 59.58193 -2.551819      7.090001      -2.038102      10.54518      -2.975625      9.578008  153.9243 71.80382 145.3318 68.00455 8.592468       98.89594 
1 1 1 -14 17 16 o 232.1378 73.11842 14.87642       7.358477      30.14336       10.89433      2.067756       9.978758  316.8388 86.23213 160.6761 73.07143 156.1628       113.0284 
1 1 1 -14 17 17 o 178.3759 77.35271 7.902115       9.914297      7.902115       9.914297      0.000000       0.000000  178.3759 77.35271 ?        ?        0.000000       77.35271 
1 1 1 -14 17 18 o 111.7864 54.69611 -8.350120      7.937283      -6.015805      9.596026      -13.40673      14.12348  127.8371 62.00642 136.2485 67.80058 -8.411331      91.87881 
1 1 1 -14 17 19 o 132.3410 63.36421 -1.756865      9.275846      13.66467       12.09746      -23.75906      14.44985  183.2287 82.14889 121.1470 61.35593 62.08167       102.5329 
1 1 1 -14 17 20 o 103.2456 51.16896 -9.063920      7.728894      1.180281       11.08097      -18.76933      10.78563  139.4548 67.39754 106.3364 53.75704 33.11839       86.21049 
1 1 1 -14 17 21 o 167.5876 70.30399 11.54238       7.719575      4.306476       11.62738      17.24578       10.32292  139.8925 67.94580 180.0768 78.50443 -40.18430      103.8247 
1 1 1 -14 17 22 o 128.1872 59.12375 4.212512       6.847256      6.783684       9.315088      1.190166       10.09935  137.9465 65.32041 125.4139 61.43458 12.53262       89.67142 
1 1 1 -14 18 1  o 353.2193 44.04049 25.50411       5.909979      27.18726       6.849414      20.59957       11.69206  362.3396 50.00815 297.3162 91.92757 65.02341       104.6494 
1 1 1 -14 18 2  o 762.3040 24.15682 114.1995       7.151480      117.5946       8.456881      105.6774       13.39848  771.8797 28.21192 719.2238 48.24887 52.65588       55.89155 
1 1 1 -14 18 3  o 339.2241 58.45405 24.51377       7.422687      20.38459       9.316888      31.68866       12.28137  298.9550 79.04317 368.9310 87.11258 -69.97595      117.6283 
1 1 1 -14 18 4  o 205.9623 72.88574 8.657292       7.286417      15.28249       9.425713      -1.181103      11.48622  258.9425 82.88229 180.1265 80.45229 78.81604       115.5078 
1 1 1 -14 18 5  o 668.1688 28.19435 88.35432       7.316042      93.40264       8.726295      76.41074       13.42220  684.7086 32.81679 601.0569 58.23191 83.65161       66.84233 
1 1 1 -14 18 6  o 404.0446 42.54272 33.48903       6.575173      30.72601       7.696467      40.95360       12.65034  381.1102 53.47280 421.3795 80.23428 -40.26938      96.42033 
1 1 1 -14 18 7  o 539.3082 45.35522 60.04785       9.411114      60.04785       9.411114      0.000000       0.000000  539.3082 45.35522 ?        ?        0.000000       45.35522 
1 1 1 -14 18 8  o 236.5490 64.98519 12.67721       6.153338      11.05233       9.136511      14.02606       8.324350  223.1352 81.28186 244.2980 77.85749 -21.16283      112.5546 
1 1 1 -14 18 9  o 346.4073 48.74445 25.49864       6.376143      26.16735       9.386804      24.92577       8.688126  333.0862 74.43909 328.0199 70.31475 5.066223       102.3980 
1 1 1 -14 18 10 f 157.4426 64.43903 3.431721       6.268292      0.3824707      9.302279      5.967861       8.483584  163.5866 72.78031 185.5895 75.34631 -22.00293      104.7571 
1 1 1 -14 18 11 f 140.3262 61.79548 0.2721606      6.540774      2.901011       9.748176      -1.880511      8.821232  174.9305 76.27353 149.7752 68.34126 25.15527       102.4118 
1 1 1 -14 18 12 o 113.3910 53.96683 -6.008758      6.518683      3.363795       9.951159      -13.05375      8.627502  175.4089 76.75674 115.3004 56.54256 60.10851       95.33446 
1 1 1 -14 18 13 o 119.9557 56.22707 -4.018331      6.596109      -5.750319      9.683971      -2.519316      9.009156  140.1125 66.41977 145.1382 67.24872 -5.025726      94.51971 
1 1 1 -14 18 14 o 288.8542 63.67109 20.42827       6.950122      32.42510       10.27253      10.30087       9.438288  348.9854 77.78237 200.3140 80.11906 148.6714       111.6654 
1 1 1 -14 18 15 o 200.5688 76.08382 11.07207       8.160166      8.559819       9.833514      16.62798       14.62361  186.9261 78.93035 220.3097 94.73824 -33.38358      123.3099 
1 1 1 -14 18 16 f 165.7525 74.49612 4.662519       10.01401      4.662519       10.01401      0.000000       0.000000  165.7525 74.49612 ?        ?        0.000000       74.49612 
1 1 1 -14 18 17 o 190.3190 80.36703 12.04033       10.19557      12.04033       10.19557      0.000000       0.000000  190.3190 80.36703 ?        ?        0.000000       80.36703 
1 1 1 -14 18 18 o 229.6822 77.21870 18.17812       8.139983      22.11317       9.548372      7.711949       15.57212  242.0513 83.58801 168.0421 80.88303 74.00914       116.3143 
1 1 1 -14 18 19 o 146.5766 63.28828 5.712695       6.579354      7.719085       8.442130      2.608791       10.50022  156.9727 69.60927 142.7850 68.10406 14.18768       97.38384 
1 1 1 -14 18 20 o 148.9612 65.14606 7.274896       7.159167      3.854280       9.640213      11.48121       10.69018  138.2164 65.73782 160.4757 73.96670 -22.25931      98.95723 
1 1 1 -14 18 21 o 114.8052 55.41235 -0.8802542     7.429661      8.451775       10.68064      -9.629579      10.34181  144.3663 68.81081 109.9077 55.18192 34.45866       88.20415 
1 1 1 -14 19 1  o 819.6471 23.14480 132.1134       7.367301      150.0222       9.001861      95.78401       12.82115  871.6846 26.59163 681.9068 48.73549 189.7778       55.51812 
1 1 1 -14 19 2  o 477.4295 34.94004 45.80836       6.433299      49.07347       7.631846      37.79222       11.95814  491.5278 40.33657 407.0103 78.49863 84.51755       88.25573 
1 1 1 -14 19 3  o 203.8479 72.11370 8.642934       7.132305      1.322520       8.980302      21.14922       11.73782  170.4887 73.77563 294.2855 92.29173 -123.7968      118.1550 
1 1 1 -14 19 4  o 189.7784 72.61237 6.618083       7.472644      8.763560       9.621946      3.357342       11.86203  212.5105 82.11522 196.9159 85.00133 15.59459       118.1869 
1 1 1 -14 19 5  o 654.5811 34.34088 86.21384       8.699306      62.36379       10.74845      131.5054       14.81186  544.6398 51.42556 795.8339 48.15136 -251.1940      70.44957 
1 1 1 -14 19 6  o 656.2814 31.04290 86.09735       7.911893      86.34235       9.607142      85.58096       13.94770  651.5285 38.13559 630.8565 57.56437 20.67200       69.05056 
1 1 1 -14 19 7  o 462.3449 42.37153 44.25156       7.523330      49.53769       9.335773      34.45983       12.70606  483.2984 50.48531 369.8389 89.44384 113.4594       102.7082 
1 1 1 -14 19 8  o 172.4178 65.69368 5.650816       6.100458      -11.83327      8.771601      22.03027       8.489990  121.4651 59.00004 304.4550 72.79095 -182.9899      93.69913 
1 1 1 -14 19 9  o 203.4501 68.18427 9.533272       6.346484      15.12960       9.444594      4.925819       8.569633  244.4979 83.17203 179.1734 74.53188 65.32445       111.6807 
1 1 1 -14 19 10 o 299.0040 57.21207 20.20562       6.401397      25.29031       9.449420      15.89297       8.702518  317.5347 77.34402 248.8564 79.63770 68.67833       111.0147 
1 1 1 -14 19 11 o 131.7744 59.28329 -0.8008845     6.360027      5.572195       9.480982      -6.015196      8.575849  182.1155 77.23362 132.0310 62.56425 50.08455       99.39475 
1 1 1 -14 19 12 o 180.8945 68.55068 7.429481       6.620015      21.50155       9.755084      -4.583333      9.013104  277.4884 83.61507 138.1168 65.05002 139.3716       105.9386 
1 1 1 -14 19 13 o 119.8958 56.24114 -3.660467      6.620544      -10.66039      9.710845      2.418879       9.049795  126.0245 61.40910 160.5876 71.59125 -34.56310      94.32064 
1 1 1 -14 19 14 o 127.9752 60.45774 -3.905802      7.894312      -6.704954      9.500913      2.336102       14.18766  131.5838 63.29522 175.6559 82.37605 -44.07210      103.8850 
1 1 1 -14 19 15 o 250.3502 77.27455 18.79482       8.265742      17.74573       9.796420      21.38736       15.40006  231.0867 84.16796 225.0206 96.99297 6.066071       128.4207 
1 1 1 -14 19 16 o 129.0928 61.92884 -4.099916      8.956408      -4.099916      8.956408      0.000000       0.000000  129.0928 61.92884 ?        ?        0.000000       61.92884 
1 1 1 -14 19 17 o 195.8910 79.21560 14.35371       9.337591      14.35371       9.337591      0.000000       0.000000  195.8910 79.21560 ?        ?        0.000000       79.21560 
1 1 1 -14 19 18 o 130.0552 59.61095 1.946720       6.811970      16.61193       8.898978      -18.80753      10.58643  202.3383 78.74989 106.2515 53.65976 96.08686       95.29384 
1 1 1 -14 19 19 o 133.3140 59.96986 3.875439       6.506258      6.931402       8.542790      -0.3455114     10.03993  148.3967 67.53444 130.0930 63.17495 18.30367       92.47689 
1 1 1 -14 19 20 o 161.7866 67.60581 10.45613       7.096603      5.471809       10.00376      15.50546       10.06878  138.8078 66.28104 170.6461 75.82969 -31.83827      100.7140 
1 1 1 -14 20 1  o 369.5903 47.34219 28.55396       6.638930      34.93533       8.396221      17.90865       10.84442  404.6936 54.83533 271.3828 89.06275 133.3108       104.5901 
1 1 1 -14 20 2  o 123.0933 56.67973 -3.469213      6.255862      -1.158754      7.658768      -8.101258      10.84416  147.1227 65.70418 150.5384 71.03784 -3.415756      96.76473 
1 1 1 -14 20 3  o 206.2160 86.17031 6.512271       11.52893      0.000000       0.000000      6.512271       11.52893  ?        ?        206.2160 86.17031 0.000000       86.17031 
1 1 1 -14 20 4  o 359.0265 48.67669 27.28238       6.611968      36.23136       8.029542      8.432732       11.65348  412.7324 51.19404 214.3631 87.81357 198.3693       101.6467 
1 1 1 -14 20 5  o 259.5866 64.65242 15.43558       6.493159      21.32375       7.699040      0.9298927      12.08413  304.7732 66.88367 184.3532 82.41692 120.4200       106.1413 
1 1 1 -14 20 6  o 305.8615 57.77849 20.79416       6.611555      20.40473       7.953587      21.66504       11.89399  294.0887 70.54560 285.0561 93.25979 9.032654       116.9362 
1 1 1 -14 20 7  o 205.2416 68.85354 9.723838       6.471750      14.86954       7.699443      -2.663903      11.94629  246.8898 74.25980 169.0714 78.02055 77.81844       107.7113 
1 1 1 -14 20 8  o 130.7843 58.14384 -0.4326299     5.926537      1.721521       8.506757      -2.464314      8.261407  161.7831 70.87656 142.8533 65.53962 18.92978       96.53459 
1 1 1 -14 20 9  o 147.4136 67.79441 -2.241634      8.912390      -2.241634      8.912390      0.000000       0.000000  147.4136 67.79441 ?        ?        0.000000       67.79441 
1 1 1 -14 20 10 o 204.4781 73.64758 10.33158       7.470807      14.86692       9.313585      2.147559       12.51109  234.2751 82.45701 180.0205 81.84977 54.25458       116.1832 
1 1 1 -14 20 11 o 124.3713 58.80628 -4.904763      7.498339      -6.278425      9.067994      -1.934608      13.33402  132.9527 63.37971 168.9550 79.43349 -36.00223      101.6202 
1 1 1 -14 20 12 o 336.0239 64.34993 27.83224       8.091629      28.44513       9.911875      26.60770       14.01032  320.1784 79.95494 271.8404 100.3963 48.33801       128.3441 
1 1 1 -14 20 13 f 203.5940 76.69356 11.84239       8.255585      13.47398       10.02106      8.396140       14.56405  210.0211 83.01721 190.7918 87.34405 19.22929       120.5024 
1 1 1 -14 20 14 o 149.0074 66.58673 2.720018       7.878824      7.588052       9.528691      -7.801793      14.00883  175.2336 75.91174 148.2944 72.58145 26.93916       105.0269 
1 1 1 -14 20 15 o 147.8145 65.67767 3.598906       7.551482      4.681870       8.953213      0.9295517      14.05643  156.8168 70.46379 159.4836 76.78436 -2.666809      104.2160 
1 1 1 -14 20 16 o 191.8695 77.61765 13.38983       8.968199      13.38983       8.968199      0.000000       0.000000  191.8695 77.61765 ?        ?        0.000000       77.61765 
1 1 1 -14 20 17 o 161.2551 66.10600 8.069072       6.610105      9.262905       8.580602      6.326437       10.36691  164.9209 71.74012 153.9896 71.61978 10.93134       101.3708 
1 1 1 -14 20 18 o 99.16969 48.73892 -6.516391      6.522233      -6.308183      8.531886      -6.809152      10.11703  112.1081 55.22320 118.4968 58.69445 -6.388695      80.58933 
1 1 1 -14 20 19 o 116.3461 56.65921 -2.411592      8.231611      -5.252959      10.74274      1.629144       12.81096  120.0144 59.62428 135.6268 66.97116 -15.61242      89.66711 
1 1 1 -14 21 1  o 270.7838 61.78381 16.52970       6.353664      13.45935       7.906256      22.12807       10.67599  238.4272 75.86551 296.0332 87.06184 -57.60600      115.4787 
1 1 1 -14 21 2  o 348.0320 50.12565 25.91455       6.579552      27.79825       8.148107      22.38460       11.15415  352.7378 61.72943 294.5969 89.55412 58.14084       108.7679 
1 1 1 -14 21 3  o 160.7219 69.39214 1.844847       7.908796      -1.927026      11.22391      5.564506       11.14595  168.4678 76.95519 196.3462 83.52222 -27.87840      113.5696 
1 1 1 -14 21 4  o 134.1281 60.33453 -1.279618      6.585135      0.7335897      8.073964      -5.279668      11.38087  155.9689 68.67155 158.5075 74.15682 -2.538513      101.0694 
1 1 1 -14 21 5  o 482.8409 39.68476 48.35670       7.375568      46.34566       9.081511      52.25339       12.64139  462.9464 51.37917 471.1691 71.31631 -8.222748      87.89674 
1 1 1 -14 21 6  o 171.2703 68.07561 5.377625       6.773080      4.475400       8.494986      6.951948       11.22153  174.7861 73.55904 198.1005 84.01926 -23.31439      111.6699 
1 1 1 -14 21 7  o 141.9030 62.86466 0.2908694      6.868950      -2.177579      8.587515      4.675457       11.44511  145.2773 66.71400 187.4803 82.17084 -42.20308      105.8433 
1 1 1 -14 21 8  o 390.1161 49.90688 33.47825       7.387739      39.90076       9.055589      20.69675       12.77482  419.0348 57.13597 261.0614 95.95798 157.9734       111.6801 
1 1 1 -14 21 9  o 207.6168 87.59109 10.61167       12.09302      0.000000       0.000000      10.61167       12.09302  ?        ?        207.6168 87.59109 0.000000       87.59109 
1 1 1 -14 21 10 o 134.3419 61.41427 -1.120145      7.165814      -5.762756      8.766521      8.227492       12.43933  131.1301 62.45736 194.6218 85.47411 -63.49173      105.8619 
1 1 1 -14 21 11 o 452.1624 46.00050 45.40737       7.965158      50.12648       9.881409      36.65265       13.45891  461.5182 56.29866 330.8229 97.88309 130.6953       112.9187 
1 1 1 -14 21 12 o 152.3697 67.13225 3.194560       7.728704      14.04097       9.508878      -17.91896      13.26681  212.1168 81.72430 131.3979 65.43982 80.71889       104.6959 
1 1 1 -14 21 13 o 119.9902 57.50932 -4.922240      7.684417      1.326861       9.422805      -17.33057      13.27786  149.3520 69.05079 129.5133 64.65487 19.83862       94.59526 
1 1 1 -14 21 14 o 100.6193 49.37161 -8.323757      6.608138      -0.5484724     9.010717      -17.37165      9.720196  138.0879 65.03790 107.3534 53.84364 30.73444       84.43380 
1 1 1 -14 21 15 o 162.3124 68.46122 7.569458       7.384745      9.120769       9.058545      4.495643       12.75111  169.5084 73.72330 157.7180 75.17760 11.79048       105.2939 
1 1 1 -14 21 16 o 111.5081 53.93269 -4.206402      7.130183      -9.736593      8.599642      7.957140       12.75382  108.5303 53.82106 159.7973 75.88819 -51.26703      93.03614 
1 1 1 -14 21 17 o 162.7978 65.58429 8.888706       6.374312      7.133673       8.294958      11.41973       9.961380  150.8757 67.80630 165.8197 74.42992 -14.94395      100.6852 
1 1 1 -14 22 1  o 96.28832 46.90522 -8.716444      5.653364      -8.830177      6.659770      -8.423111      10.69536  107.4742 52.01587 144.6399 68.91827 -37.16563      86.34453 
1 1 1 -14 22 2  f 110.3568 52.25140 -5.356644      5.957869      -2.728328      7.215954      -10.98573      10.56024  133.1810 61.15752 137.0033 66.11046 -3.822281      90.06017 
1 1 1 -14 22 3  o 112.1064 53.71102 -7.170697      6.689175      -5.970868      8.929429      -8.705049      10.09779  136.5717 64.45161 138.3542 66.20870 -1.782501      92.39915 
1 1 1 -14 22 4  o 146.8303 62.94209 1.883699       6.418633      0.8225045      7.869936      3.992003       11.09278  152.3667 67.40511 183.9382 80.75033 -31.57153      105.1859 
1 1 1 -14 22 5  o 213.7768 69.95783 11.20090       6.692698      8.754717       8.204194      16.06709       11.57140  195.9498 75.79418 240.1956 90.72472 -44.24579      118.2190 
1 1 1 -14 22 6  o 345.8585 54.69008 27.04971       7.101464      36.14775       8.872594      10.83244       11.84583  395.6157 59.59913 210.9436 87.67785 184.6720       106.0163 
1 1 1 -14 22 7  o 561.1529 35.39559 65.46490       7.674096      68.31228       9.484058      60.06532       13.06025  563.7610 43.65871 493.5948 70.10210 70.16623       82.58564 
1 1 1 -14 22 8  o 309.2064 61.40233 23.01083       7.113272      19.59577       8.677749      30.00535       12.41901  266.2447 78.54671 308.5323 94.63438 -42.28763      122.9848 
1 1 1 -14 22 9  o 203.5934 71.92025 11.06977       7.091639      14.84691       8.592576      3.000552       12.55907  226.8336 79.23938 174.5089 80.33760 52.32478       112.8406 
1 1 1 -14 22 10 o 153.7014 66.43948 3.714369       7.267335      1.474791       8.978401      7.969476       12.37574  152.2439 69.26580 185.8523 83.22340 -33.60838      108.2769 
1 1 1 -14 22 11 o 150.7049 63.31526 4.387920       6.276174      0.7348579      8.800250      8.169262       8.953431  145.9947 67.22502 177.6738 75.18538 -31.67909      100.8566 
1 1 1 -14 22 12 o 155.8428 64.31091 5.624831       6.307566      11.74712       8.781833      -0.8992507     9.065416  192.4132 77.16796 139.2263 65.46944 53.18686       101.1985 
1 1 1 -14 22 13 o 118.9099 55.42231 -1.227896      6.260998      10.76209       8.653234      -14.40139      9.070256  182.1439 75.25800 107.0601 53.44455 75.08386       92.30431 
1 1 1 -14 22 14 o 204.9203 69.50156 13.36860       6.594856      19.03349       9.238541      7.482631       9.417091  222.1781 81.61234 161.8533 72.52836 60.32477       109.1830 
1 1 1 -14 22 15 o 98.70800 48.83970 -8.963252      6.935465      -9.352988      8.526476      -8.201201      11.92275  108.8005 53.89016 126.9119 63.01046 -18.11144      82.91241 
1 1 1 -14 22 16 o 127.8264 58.17276 2.419456       6.338437      21.95016       8.566438      -21.20919      9.422380  235.8767 79.21605 95.53387 48.50642 140.3428       92.88733 
1 1 1 -14 23 1  o 158.4231 61.51459 4.758966       5.420192      7.564944       6.466183      -1.871386      9.939718  184.0262 68.15735 155.2032 71.45763 28.82298       98.75027 
1 1 1 -14 23 2  o 151.5561 65.24875 2.273193       6.952402      -5.398203      8.997499      13.64089       10.95269  136.9017 64.63468 225.8702 87.51664 -88.96849      108.7971 
1 1 1 -14 23 3  o 680.9841 31.97579 94.69690       8.456414      85.86308       10.54965      110.5755       14.14391  634.8757 43.04222 706.9522 51.87938 -72.07654      67.40997 
1 1 1 -14 23 4  o 338.4305 49.12883 25.39181       6.268366      17.85431       7.141320      50.69214       13.08362  266.9861 68.52876 441.4016 79.23673 -174.4156      104.7600 
1 1 1 -14 23 5  o 239.8558 64.27519 14.25413       6.108456      8.024184       7.086047      32.27588       12.05203  184.4681 70.67861 329.8700 91.08108 -145.4019      115.2876 
1 1 1 -14 23 6  o 131.6383 58.66933 0.3169853      6.073251      3.121169       7.059430      -7.669203      11.91341  152.8500 65.77763 146.2162 70.47045 6.633804       96.39907 
1 1 1 -14 23 7  o 138.1972 60.80026 1.459913       6.318517      -6.381495      7.312263      24.57143       12.55362  116.3002 55.83561 266.1391 95.50919 -149.8389      110.6328 
1 1 1 -14 23 8  o 327.7692 52.95486 25.17746       6.510832      22.31128       7.537107      33.60499       12.92418  292.1391 67.74922 311.4744 96.70696 -19.33530      118.0771 
1 1 1 -14 23 9  o 323.6455 54.60000 25.14365       6.618412      36.78569       7.691890      -8.053043      12.98871  396.6351 51.12627 144.7150 70.62727 251.9200       87.19006 
1 1 1 -14 23 10 o 149.9163 65.26125 3.919055       7.111147      4.559786       8.432370      2.341336       13.23204  157.6079 69.74555 164.2191 77.78722 -6.611145      104.4763 
1 1 1 -14 23 11 o 190.7695 68.21611 10.67084       6.398574      6.903951       8.547943      15.47147       9.649822  165.2947 71.75253 208.1498 81.72278 -42.85516      108.7522 
1 1 1 -14 23 12 o 174.4900 66.72839 8.951465       6.308627      13.72334       8.681530      3.612308       9.183071  197.4080 77.51141 150.1543 68.96653 47.25366       103.7516 
1 1 1 -14 23 13 o 138.7740 64.88787 1.564597       8.692456      1.564597       8.692456      0.000000       0.000000  138.7740 64.88787 ?        ?        0.000000       64.88787 
1 1 1 -14 24 1  o 194.5087 62.97930 9.205354       5.430474      7.783545       6.303047      13.30066       10.69727  181.8792 67.30599 218.2721 85.93307 -36.39296      109.1540 
1 1 1 -14 24 2  o 135.3441 60.94666 -0.1665602     6.740474      -6.540379      8.454785      10.95031       11.16591  126.8406 60.66850 204.9225 85.14557 -78.08188      104.5487 
1 1 1 -14 24 3  o 200.5633 64.91872 10.11999       5.770434      -0.3572027     6.590439      44.53887       11.94511  132.6672 59.95398 408.6161 78.12174 -275.9488      98.47581 
1 1 1 -14 24 4  o 181.9609 65.63165 8.177376       5.935643      2.615191       6.756639      26.98353       12.42390  147.4745 63.90475 283.1759 95.39715 -135.7014      114.8235 
1 1 1 -14 24 5  o 242.4719 62.82339 14.88617       5.963713      16.91230       6.855184      8.580316       12.09364  253.4243 68.16647 189.7434 83.76782 63.68085       107.9987 
1 1 1 -14 24 6  o 159.0429 63.86869 5.499269       6.024362      1.957204       6.919173      16.59854       12.24822  142.8721 63.20378 219.6926 90.01508 -76.82050      109.9883 
1 1 1 -14 24 7  o 223.6516 67.24927 13.63638       6.315047      13.82838       7.334002      13.08584       12.41906  218.2712 73.29659 200.6256 86.78767 17.64561       113.5979 
1 1 1 -14 24 8  o 115.5545 54.35603 -2.829253      6.257678      -2.925023      7.190678      -2.530366      12.70304  122.6507 57.86826 152.3659 73.26593 -29.71521      93.36291 
1 1 1 -14 24 9  o 195.6126 67.62447 10.99868       6.250371      12.46790       7.156462      6.273722       12.83380  202.7137 72.17958 171.1091 79.61686 31.60463       107.4650 
1 1 1 -14 24 10 o 147.1018 62.87475 4.502715       6.371370      8.711583       7.285766      -9.178894      13.13594  173.2330 70.00108 137.0600 67.70439 36.17305       97.38601 
1 1 1 -14 24 11 o 166.0735 65.69938 7.865528       6.281023      6.205569       8.469378      9.894315       9.363131  157.9815 69.90527 174.6002 75.44347 -16.61870      102.8517 
1 1 1 -14 25 1  o 185.7144 61.59201 8.508775       5.181356      6.163029       5.950946      15.85938       10.53434  166.0693 64.46374 226.8422 86.35150 -60.77292      107.7597 
1 1 1 -14 25 2  o 199.3230 68.77945 10.46549       6.464252      16.20058       8.009360      -0.2507034     10.94834  238.8666 76.39603 157.6517 73.41557 81.21486       105.9538 
1 1 1 -14 25 3  o 90.48383 44.34440 -8.103433      5.279943      -8.080618      6.057541      -8.175574      10.77183  99.02773 48.30833 135.6624 65.77757 -36.63467      81.61117 
1 1 1 -14 25 4  o 153.5111 61.35695 4.993593       5.531197      9.108741       6.360339      -7.775397      11.20381  185.8931 67.80221 137.9200 66.92062 47.97310       95.26547 
1 1 1 -14 25 5  o 150.4585 61.65382 4.586920       5.746675      4.435952       6.610223      5.054142       11.62880  152.9751 64.66064 171.4937 78.33488 -18.51859      101.5744 
1 1 1 -14 25 6  o 204.2653 65.72845 11.42712       5.921884      15.40453       6.835941      -0.5339423     11.85450  233.2696 69.92874 154.4776 73.30418 78.79196       101.3091 
1 1 1 -14 25 7  o 251.1180 62.78963 16.73198       6.107228      19.37897       7.067347      8.926891       12.13584  263.7880 68.41100 179.8723 81.31538 83.91573       106.2650 
1 1 1 -13 0  1  o 519.6069 44.72591 54.10523       8.871470      54.10523       8.871470      54.10523       8.871470  519.6069 44.72591 519.6069 44.72591 0.000000       0.000000 
1 1 1 -13 0  2  o 142.3144 72.07369 5.931653       4.960654      5.931653       4.960654      5.931653       4.960654  142.3144 72.07369 142.3144 72.07369 0.000000       0.000000 
1 1 1 -13 0  3  o 685.2589 26.19050 91.90295       6.946783      91.90295       6.946783      91.90295       6.946783  685.2589 26.19050 685.2589 26.19050 0.000000       0.000000 
1 1 1 -13 0  4  f 566.3649 28.62912 63.02103       6.260264      63.02103       6.260264      63.02103       6.260264  566.3649 28.62912 566.3649 28.62912 0.000000       0.000000 
1 1 1 -13 0  5  o 487.3032 35.66547 47.13640       6.666459      47.13640       6.666459      47.13640       6.666459  487.3032 35.66547 487.3032 35.66547 0.000000       0.000000 
1 1 1 -13 0  6  o 94.85144 62.40832 -0.9301636     5.838917      -0.9301636     5.838917      -0.9301636     5.838917  94.85144 62.40832 94.85144 62.40832 0.000000       0.000000 
1 1 1 -13 0  7  o 1076.523 24.19251 225.9988       10.10268      225.9988       10.10268      225.9988       10.10268  1076.523 24.19251 1076.523 24.19251 0.000000       0.000000 
1 1 1 -13 0  8  o 159.4325 81.92382 7.458528       6.462906      7.458528       6.462906      7.458528       6.462906  159.4325 81.92382 159.4325 81.92382 0.000000       0.000000 
1 1 1 -13 0  9  o 573.1721 35.28235 64.85883       7.785448      64.85883       7.785448      64.85883       7.785448  573.1721 35.28235 573.1721 35.28235 0.000000       0.000000 
1 1 1 -13 0  10 o 409.9698 50.51535 34.42088       7.715055      34.42088       7.715055      34.42088       7.715055  409.9698 50.51535 409.9698 50.51535 0.000000       0.000000 
1 1 1 -13 0  11 o 366.9827 62.84676 28.69035       8.168279      28.69035       8.168279      28.69035       8.168279  366.9827 62.84676 366.9827 62.84676 0.000000       0.000000 
1 1 1 -13 0  12 o 395.3563 57.33412 32.54768       8.264060      32.54768       8.264060      32.54768       8.264060  395.3563 57.33412 395.3563 57.33412 0.000000       0.000000 
1 1 1 -13 0  13 o 906.0981 32.06017 160.6303       11.24953      160.6303       11.24953      160.6303       11.24953  906.0981 32.06017 906.0981 32.06017 0.000000       0.000000 
1 1 1 -13 0  14 f 1142.728 30.48866 254.9811       13.50858      254.9811       13.50858      254.9811       13.50858  1142.728 30.48866 1142.728 30.48866 0.000000       0.000000 
1 1 1 -13 0  15 o 425.4667 73.00692 38.70821       10.99691      38.70821       10.99691      38.70821       10.99691  425.4667 73.00692 425.4667 73.00692 0.000000       0.000000 
1 1 1 -13 0  16 o 368.5953 83.07190 30.63604       10.37541      30.63604       10.37541      30.63604       10.37541  368.5953 83.07190 368.5953 83.07190 0.000000       0.000000 
1 1 1 -13 0  17 o 718.3768 38.98957 101.7832       10.80427      101.7832       10.80427      101.7832       10.80427  718.3768 38.98957 718.3768 38.98957 0.000000       0.000000 
1 1 1 -13 0  18 o 208.7561 101.8697 13.07073       9.741323      13.07073       9.741323      13.07073       9.741323  208.7561 101.8697 208.7561 101.8697 0.000000       0.000000 
1 1 1 -13 0  19 o 900.6184 35.75299 159.3663       12.46016      159.3663       12.46016      159.3663       12.46016  900.6184 35.75299 900.6184 35.75299 0.000000       0.000000 
1 1 1 -13 0  20 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -13 0  21 o 469.1128 105.5873 51.04599       16.78629      51.04599       16.78629      51.04599       16.78629  469.1128 105.5873 469.1128 105.5873 0.000000       0.000000 
1 1 1 -13 0  22 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -13 0  23 o 235.6168 109.2491 17.08959       11.05999      17.08959       11.05999      17.08959       11.05999  235.6168 109.2491 235.6168 109.2491 0.000000       0.000000 
1 1 1 -13 0  24 o 319.9104 103.4958 26.97686       11.36401      26.97686       11.36401      26.97686       11.36401  319.9104 103.4958 319.9104 103.4958 0.000000       0.000000 
1 1 1 -13 0  25 o 240.1058 123.9992 19.93203       14.84875      19.93203       14.84875      19.93203       14.84875  240.1058 123.9992 240.1058 123.9992 0.000000       0.000000 
1 1 1 -13 0  26 o 238.9123 126.7467 20.86043       15.83134      20.86043       15.83134      20.86043       15.83134  238.9123 126.7467 238.9123 126.7467 0.000000       0.000000 
1 1 1 -13 0  27 o 98.92656 69.60287 -9.347037      10.43459      -9.347037      10.43459      -9.347037      10.43459  98.92656 69.60287 98.92656 69.60287 0.000000       0.000000 
1 1 1 -13 0  28 o 141.8871 89.97876 4.592377       10.73803      4.592377       10.73803      4.592377       10.73803  141.8871 89.97876 141.8871 89.97876 0.000000       0.000000 
1 1 1 -13 0  29 o 114.3795 77.22775 -1.211821      9.997471      -1.211821      9.997471      -1.211821      9.997471  114.3795 77.22775 114.3795 77.22775 0.000000       0.000000 
1 1 1 -13 0  30 o 83.02688 59.81094 -13.38636      9.609255      -13.38636      9.609255      -13.38636      9.609255  83.02688 59.81094 83.02688 59.81094 0.000000       0.000000 
1 1 1 -13 1  1  o 685.3395 21.31889 91.76938       5.674118      92.67087       10.01971      91.34380       6.884375  683.1643 37.91502 682.7311 25.96491 0.4331665      45.95351 
1 1 1 -13 1  2  o 319.2883 36.44493 20.41634       4.438089      21.56889       8.062304      19.91525       5.316017  317.8845 67.39854 312.8274 45.05733 5.057159       81.07235 
1 1 1 -13 1  3  o 392.5334 31.01510 30.52596       4.689492      29.87261       8.675166      30.79569       5.574088  377.8600 61.21175 392.6482 36.99062 -14.78821      71.52052 
1 1 1 -13 1  4  f 596.4919 20.50381 69.53196       4.749711      67.62045       6.654583      71.51704       6.781423  586.3108 29.22570 603.0382 28.95663 -16.72742      41.14156 
1 1 1 -13 1  5  o 356.0735 31.28980 25.17792       4.282934      24.84076       6.068615      25.51252       6.045420  349.3116 45.84193 354.3905 44.93488 -5.078857      64.19210 
1 1 1 -13 1  6  o 476.8412 25.52942 44.72614       4.710473      50.05621       6.795444      39.79622       6.535391  501.7462 35.09534 446.1510 38.08392 55.59521       51.78869 
1 1 1 -13 1  7  o 454.9372 27.00909 40.78815       4.750491      42.64470       7.030369      39.22825       6.444249  461.3894 39.62015 443.0006 37.81997 18.38879       54.77322 
1 1 1 -13 1  8  o 250.0629 48.45213 12.97769       4.535402      18.53284       6.575652      7.937026       6.263762  296.2676 59.22180 199.7098 67.73444 96.55786       89.97320 
1 1 1 -13 1  9  o 866.9368 19.43937 146.8027       6.544816      137.1749       9.198096      156.6759       9.314539  835.2612 28.35618 893.2336 26.85149 -57.97241      39.05221 
1 1 1 -13 1  10 o 515.8878 28.19328 52.46947       5.627055      52.15052       7.912218      52.79588       8.004294  510.3589 40.24699 513.4390 40.47078 -3.080109      57.07630 
1 1 1 -13 1  11 o 1153.477 18.41587 259.6982       8.249526      246.6231       11.41415      273.9976       11.93656  1121.090 26.21652 1181.770 26.00868 -60.67944      36.92908 
1 1 1 -13 1  12 o 554.3732 28.91475 60.59080       6.203578      58.98537       8.618524      62.31687       8.936482  542.7703 41.19461 557.8250 41.54948 -15.05469      58.50945 
1 1 1 -13 1  13 o 1491.278 19.12462 434.2335       11.07591      439.0956       15.80537      429.5419       15.52577  1495.370 27.21623 1479.126 27.02838 16.24414       38.35696 
1 1 1 -13 1  14 o 756.8896 26.98801 112.5103       7.932889      109.8583       11.51522      114.9057       10.94415  741.8719 40.11737 761.1256 37.02523 -19.25372      54.59186 
1 1 1 -13 1  15 o 1035.395 33.15507 211.9822       13.33165      211.9822       13.33165      0.000000       0.000000  1035.395 33.15507 ?        ?        0.000000       33.15507 
1 1 1 -13 1  16 o 119.7572 56.53082 -6.841537      6.877455      -18.04039      10.26412      2.282916       9.264845  126.0948 61.80317 180.7903 76.49171 -54.69551      98.33928 
1 1 1 -13 1  17 o 148.4998 64.38691 0.1502199      6.867062      -5.867148      9.908345      5.712062       9.525926  152.5413 70.62452 198.6003 80.11584 -46.05899      106.8006 
1 1 1 -13 1  18 o 811.5920 37.91972 132.3597       11.95173      0.000000       0.000000      132.3597       11.95173  ?        ?        811.5920 37.91972 0.000000       37.91972 
1 1 1 -13 1  19 o 229.0371 72.09768 11.83338       7.155680      0.3469205      10.24180      22.78777       10.00179  174.5748 77.07876 309.5781 81.91849 -135.0033      112.4801 
1 1 1 -13 1  20 o 443.5753 48.35285 41.26127       8.194545      46.60745       11.85628      36.37166       11.33871  455.2419 69.24495 395.3445 76.61818 59.89740       103.2725 
1 1 1 -13 1  21 o 261.9879 94.74271 17.54952       12.38064      10.84672       17.13385      24.87305       17.90965  238.0799 102.4655 293.1934 112.3579 -55.11353      152.0641 
1 1 1 -13 1  22 o 97.10950 48.83498 -22.07178      8.266395      -30.33503      11.37097      -12.80992      12.03846  111.7688 56.34264 144.4814 69.92866 -32.71265      89.80261 
1 1 1 -13 1  23 o 179.8025 72.62031 6.289840       7.837058      -0.6165918     10.98333      13.45351       11.18600  165.6890 75.85152 226.4075 88.24287 -60.71849      116.3626 
1 1 1 -13 1  24 o 133.0052 62.23576 -3.340065      8.021459      4.983485       10.76916      -13.71308      12.02209  178.3370 78.87392 135.6544 66.56867 42.68259       103.2109 
1 1 1 -13 1  25 o 155.6960 72.28194 0.7510341      10.48295      22.36486       15.45485      -17.66696      14.26659  232.8759 98.67574 136.7413 68.06169 96.13461       119.8720 
1 1 1 -13 1  26 o 152.7755 71.85043 1.665500       10.92486      -11.76349      15.36075      15.41152       15.54101  142.6669 70.94785 194.2037 89.39073 -51.53682      114.1241 
1 1 1 -13 1  27 o 126.5438 59.77920 -0.6062067     7.716750      -9.294866      10.80386      8.443065       11.02579  121.9316 60.44198 163.1995 75.18414 -41.26787      96.46703 
1 1 1 -13 1  28 o 118.3215 56.40585 -0.4511504     7.182882      8.221534       10.02314      -9.607283      10.29872  150.4989 70.13823 113.0487 56.51171 37.45023       90.07188 
1 1 1 -13 1  29 o 124.5982 58.62976 3.723276       7.291377      11.92874       10.49685      -3.927346      10.13575  147.0713 69.55125 114.0893 56.88031 32.98203       89.84846 
1 1 1 -13 1  30 o 93.66660 46.72521 -5.682898      6.881202      0.7205266      9.858811      -11.76589      9.608975  113.7813 56.62468 96.38379 48.94275 17.39755       74.84482 
1 1 1 -13 2  1  o 153.1684 54.71260 4.147192       4.115046      -0.1355041     6.929143      6.480617       5.114672  150.0975 64.87841 182.3514 61.21009 -32.25389      89.19576 
1 1 1 -13 2  2  o 265.6428 43.82658 14.41180       4.363611      17.23881       7.631207      13.03840       5.318978  283.0894 69.84374 249.0332 56.31733 34.05627       89.72062 
1 1 1 -13 2  3  o 443.5807 28.44014 38.81115       4.873468      54.54865       8.693238      31.59841       5.885236  521.2672 43.33592 397.3393 38.62773 123.9279       58.05259 
1 1 1 -13 2  4  o 667.3446 22.14488 87.11508       5.739202      88.65017       10.07638      86.37796       6.982481  666.9917 39.07109 663.3051 27.10619 3.686646       47.55308 
1 1 1 -13 2  5  o 285.1319 37.62702 16.38728       4.064744      19.97440       5.870916      13.08468       5.633279  311.2751 50.27999 248.3348 59.24001 62.94029       77.70107 
1 1 1 -13 2  6  o 670.8575 20.07051 87.93381       5.228975      95.24830       7.649745      81.51888       7.163916  696.0760 28.29843 643.8589 28.65047 52.21716       40.26972 
1 1 1 -13 2  7  f 522.5759 24.42632 53.51891       4.957188      53.82877       7.097314      53.22375       6.926838  520.3556 35.33023 517.6368 34.65755 2.718750       49.49112 
1 1 1 -13 2  8  o 320.8644 38.47532 20.72042       4.698760      21.50698       6.867033      20.02794       6.443289  320.5995 57.25491 309.7215 55.61216 10.87796       79.81753 
1 1 1 -13 2  9  o 182.9017 59.50259 6.717561       4.844376      1.123473       7.123511      11.53058       6.607514  158.1131 66.99429 232.6260 68.51477 -74.51286      95.82540 
1 1 1 -13 2  10 o 329.1534 41.24748 21.89524       5.156804      24.89697       7.382320      19.03480       7.206501  345.6688 56.97826 298.8045 64.02875 46.86432       85.70999 
1 1 1 -13 2  11 o 835.5383 21.22730 136.4860       6.887938      150.5722       10.13860      124.4114       9.386812  874.7015 29.84627 794.8911 30.40763 79.81042       42.60779 
1 1 1 -13 2  12 o 1079.312 19.41171 227.4831       8.136520      247.8105       12.09524      210.6807       10.99661  1123.211 27.72843 1035.818 27.33679 87.39270       38.93798 
1 1 1 -13 2  13 o 836.3655 23.40798 136.9534       7.603055      142.1766       10.70410      131.6349       10.80124  848.9501 32.46685 816.2216 34.07514 32.72845       47.06603 
1 1 1 -13 2  14 o 736.7140 27.44124 106.6328       7.851103      123.2060       11.41682      91.76373       10.81397  788.0096 37.30658 677.2851 41.31112 110.7245       55.66318 
1 1 1 -13 2  15 o 437.5916 45.16924 38.81476       7.565673      39.32340       11.08159      38.37069       10.35435  429.2106 68.80640 426.1005 64.59789 3.110107       94.37801 
1 1 1 -13 2  16 o 930.6883 23.60726 169.9379       8.532531      148.3129       12.05231      191.6674       12.08138  863.6360 35.93450 984.4055 31.60201 -120.7694      47.85368 
1 1 1 -13 2  17 o 256.3466 69.34374 14.56172       7.070311      7.216794       9.992145      21.92663       10.00573  209.1852 82.83055 308.7624 82.04546 -99.57713      116.5863 
1 1 1 -13 2  18 o 284.2130 67.64664 18.02489       7.358716      11.11974       10.41706      24.90289       10.39656  231.0142 86.32067 326.4112 82.09431 -95.39705      119.1249 
1 1 1 -13 2  19 o 423.5851 47.45891 37.35917       7.672852      37.02372       10.96506      37.68102       10.74053  404.7054 72.42516 410.2654 69.91824 -5.559906      100.6676 
1 1 1 -13 2  20 o 106.3805 52.35504 -13.97911      7.611773      -31.55632      10.93951      2.517636       10.59795  108.5979 54.80931 184.0725 79.89919 -75.47464      96.89138 
1 1 1 -13 2  21 o 199.3949 87.11509 4.121392       12.77334      12.84887       16.79070      -7.867889      19.67982  244.0924 103.1080 198.9530 94.42070 45.13933       139.8089 
1 1 1 -13 2  22 o 95.57555 48.18204 -23.45528      8.321370      -8.019826      11.28861      -41.82400      12.31460  149.9975 71.28133 106.4540 54.18861 43.54353       89.54013 
1 1 1 -13 2  23 o 194.8926 75.19730 8.661574       8.059797      8.877594       11.05920      8.416868       11.77059  202.7490 84.53130 202.3903 85.95580 0.3587646      120.5568 
1 1 1 -13 2  24 o 419.9534 50.35806 39.64944       8.049135      32.50949       11.34620      46.88327       11.42056  335.9792 86.45541 430.8595 70.70673 -94.88034      111.6870 
1 1 1 -13 2  25 o 121.4638 60.34026 -15.88939      10.99506      -10.53033      14.88268      -22.32920      16.31449  149.4043 73.46707 139.6300 69.99398 9.774261       101.4720 
1 1 1 -13 2  26 o 138.0772 65.24697 -1.015421      9.205324      4.586419       11.67181      -10.23388      14.97278  162.3456 75.66856 142.9808 70.92426 19.36484       103.7111 
1 1 1 -13 2  27 o 165.6963 70.55550 8.928585       7.968424      14.81804       11.27599      3.053591       11.26213  184.2175 81.12981 147.9748 70.56619 36.24268       107.5250 
1 1 1 -13 2  28 o 217.5748 73.40458 18.23712       7.355968      13.07332       10.47609      23.25912       10.33125  164.7637 74.90716 209.9651 83.87862 -45.20140      112.4576 
1 1 1 -13 2  29 o 161.6411 67.91795 12.21386       7.223229      10.69536       10.22736      13.72515       10.20306  143.7495 68.17686 152.4819 70.96288 -8.732437      98.40639 
1 1 1 -13 2  30 o 81.92487 41.53292 -12.38174      6.729793      -15.65695      9.617075      -9.238920      9.420691  92.20959 47.02397 98.46252 49.83090 -6.252922      68.51549 
1 1 1 -13 3  1  o 86.86510 40.72765 -3.427697      3.464855      -6.247934      4.645773      0.1072377      5.201227  93.62964 44.83304 132.3581 56.69674 -38.72844      72.28086 
1 1 1 -13 3  2  o 650.3967 22.21307 82.69836       5.610672      80.18346       9.486699      84.05125       6.958023  634.9981 38.65331 654.5504 27.37252 -19.55231      47.36384 
1 1 1 -13 3  3  o 131.8688 54.15930 1.383697       4.447072      12.08497       8.073342      -3.277579      5.328292  239.8386 76.69991 115.4457 52.84340 124.3929       93.14130 
1 1 1 -13 3  4  o 557.5212 24.41636 60.88169       5.286527      58.57913       9.119985      62.04689       6.487686  540.0867 43.86019 560.8610 29.89347 -20.77429      53.07858 
1 1 1 -13 3  5  o 434.8712 26.92111 37.25565       4.524191      36.80964       6.696627      37.63015       6.136366  428.3305 40.74876 434.4165 36.71669 -6.085938      54.85049 
1 1 1 -13 3  6  o 355.3169 31.90153 25.08164       4.355150      32.39693       6.487616      19.08075       5.875937  401.0436 42.29260 303.6810 51.67401 97.36261       66.77475 
1 1 1 -13 3  7  o 592.0927 22.47301 68.59759       5.167481      71.37104       7.465373      66.04637       7.160031  600.7411 32.11530 577.8612 32.03065 22.87994       45.35808 
1 1 1 -13 3  8  o 332.8945 39.38189 22.30851       4.992664      21.41406       7.357853      23.07176       6.796854  318.3227 61.74694 333.5649 54.33950 -15.24222      82.25245 
1 1 1 -13 3  9  o 377.5263 50.54292 29.19135       7.224315      29.19135       7.224315      0.000000       0.000000  377.5263 50.54292 ?        ?        0.000000       50.54292 
1 1 1 -13 3  10 o 228.4191 56.93840 11.02397       5.033065      18.91141       7.427576      4.327536       6.843859  297.2696 66.05330 175.5466 68.85474 121.7230       95.41496 
1 1 1 -13 3  11 o 250.7471 55.71953 13.22932       5.285048      9.224066       7.522466      17.13337       7.426825  215.4294 74.20391 282.0912 68.48161 -66.66188      100.9750 
1 1 1 -13 3  12 o 255.6803 59.27306 13.84124       5.770802      16.78070       8.270904      11.05279       8.055646  277.7251 74.94767 231.3492 76.80197 46.37593       107.3112 
1 1 1 -13 3  13 o 1278.186 19.42176 319.0396       9.640748      333.5087       14.16740      306.5611       13.15678  1302.890 27.99977 1249.599 27.11133 53.29041       38.97449 
1 1 1 -13 3  14 o 653.9319 29.09405 84.13953       7.388645      80.39954       10.63607      87.62766       10.27170  632.7468 43.54875 662.3250 40.12330 -29.57819      59.21463 
1 1 1 -13 3  15 o 230.0919 70.57475 11.30707       6.906973      8.659033       10.04433      13.68245       9.513166  221.0261 84.27589 252.2518 83.44782 -31.22569      118.6000 
1 1 1 -13 3  16 o 297.1561 62.85131 19.00634       7.026614      15.92156       10.59237      21.43062       9.390157  267.1495 88.03854 309.1187 78.17085 -41.96924      117.7347 
1 1 1 -13 3  17 o 414.1127 43.62564 35.01151       6.910429      43.44586       10.10703      27.60730       9.469720  453.3266 58.79426 353.0725 71.51440 100.2541       92.58009 
1 1 1 -13 3  18 o 176.7071 68.95309 5.087481       6.836217      4.101447       9.868803      5.997109       9.478731  190.0713 79.60034 197.6030 79.84563 -7.531723      112.7455 
1 1 1 -13 3  19 o 221.2715 73.78765 10.91280       7.432673      2.153162       10.83519      18.69834       10.21498  185.5024 80.65438 278.2916 85.90504 -92.78915      117.8338 
1 1 1 -13 3  20 f 203.5037 80.27407 7.800310       9.351646      24.60570       16.04631      -0.8433447     11.50799  299.8315 107.9409 176.8430 79.63444 122.9885       134.1376 
1 1 1 -13 3  21 o 528.6581 65.77987 62.77079       13.21300      61.31950       17.00647      64.98101       20.98715  492.4183 92.32262 475.3882 114.9428 17.03012       147.4290 
1 1 1 -13 3  22 o 255.5307 78.26193 16.35684       8.497149      9.090796       11.20387      26.19498       13.03693  209.8599 86.05135 304.3969 97.47939 -94.53697      130.0272 
1 1 1 -13 3  23 o 288.2657 71.72292 20.76907       7.996776      15.57570       11.29342      25.99148       11.32495  236.3029 89.53843 302.5138 89.85299 -66.21083      126.8491 
1 1 1 -13 3  24 o 139.8301 64.48613 -1.449520      8.142040      -6.240427      11.15697      4.008967       11.90895  145.0923 69.47565 177.4422 80.35373 -32.34996      106.2242 
1 1 1 -13 3  25 o 157.3808 73.05681 1.377354       10.70502      -0.9644321     15.43214      3.549391       14.86230  167.0382 80.42976 175.0770 82.78440 -8.038788      115.4219 
1 1 1 -13 3  26 o 119.1332 58.36205 -8.292988      9.119177      -7.329336      11.68270      -9.795753      14.58911  134.3922 65.88323 141.5665 70.18610 -7.174301      96.26363 
1 1 1 -13 3  27 o 226.1155 76.38895 18.47173       7.966368      32.32130       11.44436      5.452475       11.09600  270.8090 91.55764 152.9375 72.07461 117.8716       116.5228 
1 1 1 -13 3  28 o 98.47015 48.94281 -8.494537      7.269974      -20.35793      10.59914      2.045376       9.990436  100.4090 51.02857 132.5330 64.03851 -32.12395      81.88313 
1 1 1 -13 3  29 o 105.0217 51.32836 -2.377874      6.931437      -2.349474      9.812503      -2.406158      9.792592  114.8691 57.05375 114.7235 56.98388 0.1456375      80.63680 
1 1 1 -13 3  30 o 124.0453 57.74181 6.039251       6.761415      0.8612256      9.444381      11.48370       9.684302  112.7212 55.98457 134.8253 64.60396 -22.10416      85.48651 
1 1 1 -13 4  1  o 271.3737 35.71008 14.76713       3.672062      14.76876       4.912470      14.76507       5.528016  267.8940 49.02480 266.1300 55.29306 1.763977       73.89690 
1 1 1 -13 4  2  o 716.4333 17.85966 100.0875       4.969091      101.7513       6.880355      98.27352       7.184201  721.0111 24.57202 708.2172 26.12065 12.79388       35.86185 
1 1 1 -13 4  3  o 447.7095 28.83694 39.52276       4.987204      24.18543       8.582989      47.34056       6.127817  337.2584 67.88091 489.2143 32.43764 -151.9560      75.23309 
1 1 1 -13 4  4  o 486.7237 27.30821 46.62604       5.140982      37.10405       8.699782      51.73528       6.372686  425.5629 53.84482 511.4614 32.24862 -85.89850      62.76335 
1 1 1 -13 4  5  f 461.3773 28.53200 41.97266       5.087213      48.30655       9.063313      39.05925       6.146840  488.4486 48.41717 442.9923 36.04206 45.45627       60.35936 
1 1 1 -13 4  6  o 513.7755 24.12230 51.69354       4.813047      53.51143       6.946030      50.01455       6.675388  519.3120 34.64012 502.0440 34.44622 17.26801       48.85161 
1 1 1 -13 4  7  o 431.9843 28.70063 36.83080       4.787502      33.31286       7.084900      39.78698       6.494642  405.6478 45.77396 446.4797 37.81156 -40.83194      59.37146 
1 1 1 -13 4  8  o 278.3526 45.02201 15.85038       4.700687      9.389813       6.790349      21.79546       6.513820  214.4370 70.48055 324.4899 53.55878 -110.0528      88.52148 
1 1 1 -13 4  9  o 376.6234 35.07526 28.27211       5.071228      27.33140       7.437889      29.08929       6.932365  363.8744 54.29614 377.8293 48.35455 -13.95483      72.70649 
1 1 1 -13 4  10 o 812.8060 20.79499 129.0974       6.564076      126.6306       9.422798      131.4229       9.149256  802.1884 30.24653 817.7288 28.81035 -15.54034      41.77186 
1 1 1 -13 4  11 o 846.1910 20.72112 139.9095       6.809413      133.1171       9.716463      146.4653       9.545735  822.4420 30.42110 863.4068 28.46859 -40.96478      41.66418 
1 1 1 -13 4  12 o 720.6498 23.69251 101.6709       6.630761      102.1304       9.496079      101.2337       9.262893  719.1821 33.99989 716.2601 33.30028 2.921936       47.59097 
1 1 1 -13 4  13 o 251.9436 64.68227 13.57666       6.361139      16.68689       9.536741      11.08380       8.537924  276.0166 82.56214 232.7460 79.07957 43.27058       114.3245 
1 1 1 -13 4  14 o 536.0001 33.41776 56.97865       6.921534      62.86047       9.951174      51.46626       9.633602  557.8459 46.35359 502.8034 49.99895 55.04251       68.18027 
1 1 1 -13 4  15 o 353.7951 54.55811 26.04350       7.255151      17.32410       10.35444      34.45296       10.16875  278.5544 86.57270 401.4727 67.62373 -122.9183      109.8535 
1 1 1 -13 4  16 o 156.5992 65.32642 1.935171       6.610096      -5.633407      9.613997      8.720697       9.103086  151.3477 69.89415 215.3434 80.64827 -63.99570      106.7208 
1 1 1 -13 4  17 o 149.6591 64.59098 0.4775559      6.846961      11.35872       10.55075      -7.438941      8.999370  234.6166 87.02900 138.9470 65.30353 95.66956       108.8053 
1 1 1 -13 4  18 o 203.6284 72.69353 8.535048       7.263226      3.326226       10.29067      13.70574       10.25294  188.7437 80.27018 246.1908 86.52598 -57.44707      118.0256 
1 1 1 -13 4  19 o 531.7476 38.58146 57.45901       7.913085      52.53825       11.09914      62.54573       11.28475  494.0989 59.01002 543.5474 54.18179 -49.44846      80.11147 
1 1 1 -13 4  20 o 168.5521 74.16404 0.7480552      9.403892      6.107280       15.22444      -2.558061      11.95775  219.1222 95.43709 173.8725 79.42677 45.24973       124.1646 
1 1 1 -13 4  21 o 182.7948 83.08218 -0.6740319     12.87636      1.581483       16.59750      -4.083762      20.40702  206.6838 94.08895 208.0929 97.96893 -1.409088      135.8331 
1 1 1 -13 4  22 o 449.3192 49.79950 43.51623       8.543615      32.19310       11.83701      55.82991       12.34391  350.7733 87.25347 491.8722 66.31080 -141.0989      109.5915 
1 1 1 -13 4  23 o 389.3224 55.88727 34.37569       8.207564      50.72222       11.36865      16.58106       11.86153  462.7254 65.06136 239.5809 91.52738 223.1446       112.2953 
1 1 1 -13 4  24 o 156.2416 68.79153 2.831527       8.102180      -5.700270      11.11724      12.49668       11.83262  145.3828 69.54543 208.5824 87.24037 -63.19958      111.5681 
1 1 1 -13 4  25 o 202.4311 84.04328 13.38070       10.86626      16.62880       15.74459      10.42637       15.01574  208.0448 93.46516 190.7231 87.81773 17.32170       128.2486 
1 1 1 -13 4  26 o 197.8002 78.93966 13.82324       9.141352      11.82239       11.22016      17.77336       15.76513  183.5133 80.86850 195.5601 90.02173 -12.04686      121.0108 
1 1 1 -13 4  27 o 148.8958 65.97536 5.888663       7.569143      3.712139       10.73036      8.044235       10.67859  146.4831 69.57777 158.6945 73.41870 -12.21147      101.1502 
1 1 1 -13 4  28 f 205.1008 73.72964 17.36164       7.484061      32.13546       10.99874      4.623296       10.21300  244.6365 89.17127 137.6433 66.05721 106.9932       110.9733 
1 1 1 -13 4  29 o 103.5993 50.64876 -2.401024      6.764637      -9.701942      9.465593      5.220193       9.670997  102.0652 51.44534 128.4659 62.29688 -26.40066      80.79309 
1 1 1 -13 4  30 o 105.8854 51.49510 0.4610750      6.736370      4.333306       9.377723      -3.667317      9.682940  118.4105 58.24398 105.6584 53.09575 12.75208       78.81319 
1 1 1 -13 5  1  o 333.3706 30.29258 21.99418       3.879049      19.94078       5.317149      24.33046       5.671597  313.6909 44.92964 347.6555 42.91871 -33.96463      62.13444 
1 1 1 -13 5  2  o 482.8243 22.63886 45.56089       4.244942      43.32641       5.947397      47.88134       6.060716  468.0453 32.92962 492.4223 31.86340 -24.37695      45.82179 
1 1 1 -13 5  3  o 659.6267 19.04420 84.89143       4.878531      79.51180       6.609048      91.33201       7.231455  636.9198 26.71937 682.4866 27.28372 -45.56683      38.18803 
1 1 1 -13 5  4  o 949.2255 19.74252 175.8857       7.277796      198.5291       13.24094      166.0837       8.711756  1003.304 33.98275 921.1318 24.35320 82.17175       41.80796 
1 1 1 -13 5  5  o 92.05758 44.13536 -6.205638      4.533732      -6.743349      8.260453      -5.973835      5.423629  136.4155 63.60764 105.5205 49.93001 30.89505       80.86370 
1 1 1 -13 5  6  o 277.9825 42.23101 15.70075       4.415646      10.24693       6.549557      20.24536       5.978739  221.6805 68.84595 313.6856 50.81630 -92.00514      85.56905 
1 1 1 -13 5  7  o 308.8892 40.09048 19.24128       4.695779      15.66152       6.870876      22.37877       6.432452  270.6904 65.96367 329.6980 51.95821 -59.00754      83.96941 
1 1 1 -13 5  8  o 726.5002 20.03453 103.0768       5.652530      113.4334       8.481022      94.79930       7.582073  759.8286 28.74118 694.8000 28.09960 65.02856       40.19506 
1 1 1 -13 5  9  o 235.9800 54.08480 11.68054       4.850483      20.99691       7.265964      4.191308       6.514615  315.7384 61.46796 172.4010 67.30087 143.3374       91.14668 
1 1 1 -13 5  10 o 248.5021 54.68548 12.94661       5.134356      6.975729       7.817840      17.47525       6.808501  200.6563 74.81881 287.0335 62.82276 -86.37714      97.69623 
1 1 1 -13 5  11 o 320.6472 45.98973 20.93842       5.562882      21.45727       8.159015      20.48770       7.604437  316.7753 68.32975 310.5192 65.13836 6.256073       94.40318 
1 1 1 -13 5  12 o 542.6960 29.97678 58.09932       6.293357      43.86989       9.106853      71.10639       8.706916  464.0537 51.39571 597.9305 37.68892 -133.8769      63.73362 
1 1 1 -13 5  13 o 378.4447 44.86712 29.00958       6.465728      24.70800       9.413677      32.85115       8.896100  337.5637 73.86119 397.2367 59.49753 -59.67307      94.84425 
1 1 1 -13 5  14 o 285.5246 60.82422 17.32027       6.537976      10.02082       9.543684      23.77531       8.974711  228.0323 83.07214 331.0575 71.86688 -103.0252      109.8446 
1 1 1 -13 5  15 o 580.8458 32.12173 66.90019       7.217674      76.21898       10.57445      58.77183       9.875971  614.3273 44.62786 537.5209 47.80950 76.80640       65.40179 
1 1 1 -13 5  16 o 371.7458 47.69860 28.45356       6.727361      12.78432       9.657249      43.22593       9.376797  243.4942 84.06454 455.9739 54.00166 -212.4797      99.91509 
1 1 1 -13 5  17 o 504.9842 37.95171 51.41500       7.388381      53.61827       10.63404      49.35887       10.27281  505.8045 55.02383 484.7696 55.57014 21.03497       78.20270 
1 1 1 -13 5  18 o 286.2237 67.38726 18.35676       7.366405      7.170838       10.33371      29.91373       10.50371  207.4183 83.52420 360.7443 77.30035 -153.3260      113.8053 
1 1 1 -13 5  19 o 172.0356 70.88468 3.746737       7.648461      14.58433       10.92943      -6.654424      10.70711  249.4244 89.15845 153.7222 71.92130 95.70221       114.5509 
1 1 1 -13 5  20 o 295.0016 95.34665 22.60326       12.45088      20.98147       16.28696      24.88388       19.31385  280.5181 107.2308 295.6509 115.7513 -15.13278      157.7872 
1 1 1 -13 5  21 o 510.6534 68.00148 59.48106       13.15043      75.27474       18.52040      43.42157       18.67560  546.3440 90.45307 376.3843 116.1498 169.9597       147.2159 
1 1 1 -13 5  22 o 198.5927 75.94630 8.777016       8.172009      -13.80519      11.15609      34.92420       12.00442  134.8425 65.73103 366.0516 85.91838 -231.2091      108.1783 
1 1 1 -13 5  23 o 214.5293 76.73357 11.93997       8.096715      6.958377       11.13521      17.52858       11.79414  191.0510 82.41308 242.8010 91.62145 -51.75000      123.2331 
1 1 1 -13 5  24 o 173.5054 72.31957 6.503593       8.091621      13.20067       11.30375      -0.5346628     11.58811  210.2368 86.34644 160.1132 74.88290 50.12366       114.2942 
1 1 1 -13 5  25 o 231.4650 87.26183 19.17247       10.69208      8.272610       15.40705      29.29854       14.85010  183.4604 85.97446 255.4589 101.0334 -71.99846      132.6626 
1 1 1 -13 5  26 o 144.0802 66.81022 2.107564       8.917295      -9.261970      10.85935      25.64691       15.62535  125.4362 61.88671 215.8974 95.27048 -90.46116      113.6065 
1 1 1 -13 5  27 o 374.0236 54.34542 36.88918       7.662877      45.68930       11.27530      29.33591       10.44603  357.8420 82.78065 260.6999 87.47635 97.14215       120.4357 
1 1 1 -13 5  28 o 127.9152 59.64904 3.295403       7.266658      -8.608229      10.45574      14.41682       10.10637  112.3074 56.25879 164.9250 74.41391 -52.61762      93.28709 
1 1 1 -13 5  29 o 108.4585 52.58103 -0.4069876     6.877585      -22.02456      10.02923      18.78325       9.449398  90.67741 46.38855 169.9668 74.57507 -79.28939      87.82561 
1 1 1 -13 5  30 o 122.6608 57.18940 6.012014       6.675362      15.51896       9.161066      -4.749767      9.746922  146.6674 67.90643 103.7917 52.30147 42.87569       85.71305 
1 1 1 -13 6  1  f 821.0895 17.05962 131.3529       5.439860      138.3275       7.622727      124.1146       7.765506  841.3785 23.32872 796.5886 25.10196 44.78992       34.26861 
1 1 1 -13 6  2  o 187.0263 50.56598 7.237300       3.760739      8.723164       5.073192      5.424758       5.603195  205.2534 59.91661 176.0501 63.72601 29.20332       87.47002 
1 1 1 -13 6  3  f 237.0997 44.67814 11.53025       3.962999      9.867117       5.524762      13.29303       5.687850  217.2937 62.26719 251.4118 59.22919 -34.11809      85.93777 
1 1 1 -13 6  4  o 218.4029 55.16283 9.987478       4.680070      15.10915       7.872200      7.187763       5.820323  265.4474 73.73113 192.4271 65.29269 73.02034       98.48560 
1 1 1 -13 6  5  o 849.2750 21.27198 140.8901       7.015914      145.4915       12.32673      138.6853       8.532840  857.8901 36.99886 841.3377 26.11531 16.55237       45.28714 
1 1 1 -13 6  6  o 615.7612 31.53126 74.79659       7.514885      74.79659       7.514885      0.000000       0.000000  615.7612 31.53126 ?        ?        0.000000       31.53126 
1 1 1 -13 6  7  o 394.2415 30.87897 30.75152       4.689947      37.94032       7.220132      25.50435       6.168500  434.5081 43.36707 354.6908 45.85545 79.81723       63.11438 
1 1 1 -13 6  8  o 860.5123 18.88034 144.4855       6.309498      150.7976       9.301694      139.1061       8.587047  876.7852 27.31750 842.4377 26.24690 34.34753       37.88331 
1 1 1 -13 6  9  o 508.3346 26.63020 50.79840       5.238884      47.07686       7.935016      53.67411       6.975235  484.6689 42.58960 520.3724 34.71493 -35.70349      54.94543 
1 1 1 -13 6  10 o 198.6705 61.36744 8.108162       5.211890      4.701200       8.065190      10.55107       6.829436  187.6240 74.37730 225.0616 70.36823 -37.43761      102.3898 
1 1 1 -13 6  11 o 544.6423 28.73458 58.41842       6.056259      58.81564       9.140841      58.10762       8.085597  541.5273 43.84101 540.0952 38.80777 1.432068       58.54979 
1 1 1 -13 6  12 o 746.0166 23.78955 108.9464       6.892275      123.2367       10.58484      98.42753       9.081297  789.9277 34.50397 706.4258 33.10193 83.50189       47.81487 
1 1 1 -13 6  13 o 276.3176 59.86132 16.16246       6.237952      20.19773       9.531131      13.13879       8.250411  302.6707 79.90913 247.8638 77.31796 54.80688       111.1914 
1 1 1 -13 6  14 o 229.5724 67.22251 11.26221       6.377068      18.26893       9.697365      5.923403       8.464834  286.5722 82.60498 196.3584 76.69853 90.21379       112.7220 
1 1 1 -13 6  15 o 306.6742 58.57510 19.95113       6.721786      4.774406       9.478270      35.30703       9.534057  194.9582 79.45245 408.5188 62.04612 -213.5606      100.8088 
1 1 1 -13 6  16 o 438.0359 56.74838 40.28960       9.426742      0.000000       0.000000      40.28960       9.426742  ?        ?        438.0359 56.74838 0.000000       56.74838 
1 1 1 -13 6  17 o 424.2281 45.04874 36.97363       7.308249      48.57962       10.55551      26.28756       10.12855  478.8329 57.94235 338.5250 78.55826 140.3079       97.61514 
1 1 1 -13 6  18 o 722.6122 29.71483 103.7603       8.338858      110.7835       12.04660      97.29900       11.55463  737.0876 42.26044 689.7794 43.35437 47.30829       60.54376 
1 1 1 -13 6  19 o 642.6891 35.27843 83.31287       8.771498      94.85748       13.15536      74.07243       11.76955  672.8557 50.71748 593.4882 51.57744 79.36755       72.33599 
1 1 1 -13 6  20 o 404.5077 81.60319 39.26255       12.37702      61.66531       16.55908      10.90271       18.63104  501.6752 88.21369 243.3976 105.7940 258.2776       137.7462 
1 1 1 -13 6  21 o 272.3759 93.95759 19.90630       12.06279      21.73484       16.41291      17.75834       17.78876  275.0463 106.9758 258.5286 107.4488 16.51767       151.6215 
1 1 1 -13 6  22 o 529.2774 41.27597 58.77619       8.417088      80.87029       12.08562      37.96500       11.72949  608.9476 51.58962 386.5085 80.74667 222.4391       95.82022 
1 1 1 -13 6  23 o 97.65450 48.84517 -17.34651      7.745355      -30.97066      10.95874      -3.747965      10.94844  105.0589 53.23293 152.3388 71.73192 -47.27990      89.32644 
1 1 1 -13 6  24 f 161.9853 72.81014 3.142205       9.568636      12.13849       16.31277      -1.576789      11.81465  203.6833 92.93774 156.8741 74.06453 46.80916       118.8401 
1 1 1 -13 6  25 o 259.5150 90.89317 25.13728       11.30939      12.80289       16.03430      37.34808       15.95378  192.0823 89.24785 278.2985 106.1887 -86.21620      138.7127 
1 1 1 -13 6  26 o 134.6685 63.32878 0.1447934      8.483767      -8.677942      10.64985      15.46659       14.03448  124.3409 61.33522 186.4316 85.49243 -62.09067      105.2187 
1 1 1 -13 6  27 o 160.4614 68.00954 8.881025       7.344542      17.61484       10.64444      0.9445683      10.14692  188.8697 81.01173 135.0656 65.08111 53.80409       103.9156 
1 1 1 -13 6  28 o 104.1435 50.98497 -3.891078      6.925401      -8.500287      10.54384      -0.3938790     9.184298  111.5707 55.97537 121.1036 59.16619 -9.532845      81.44863 
1 1 1 -13 6  29 o 182.2440 70.29391 16.31715       7.041150      11.63056       10.13250      20.69372       9.791630  140.3340 66.92555 171.9698 75.67249 -31.63585      101.0216 
1 1 1 -13 7  1  o 718.9589 21.36235 100.8753       5.964597      104.9877       9.853709      98.49705       7.493342  730.4695 34.73519 709.3314 27.20185 21.13812       44.11887 
1 1 1 -13 7  2  o 324.8547 33.00450 20.95294       4.105981      26.33683       5.711870      15.19591       5.906487  362.5461 41.30573 269.7790 58.09336 92.76712       71.28114 
1 1 1 -13 7  3  o 193.7997 52.57120 7.783869       4.056983      7.187826       5.640513      8.422718       5.839542  191.9840 64.28045 204.2050 65.22384 -12.22105      91.57579 
1 1 1 -13 7  4  o 156.6266 55.13964 4.425558       4.164982      8.620882       5.977605      0.4670132      5.806470  206.3147 66.00017 141.7752 60.29558 64.53947       89.39563 
1 1 1 -13 7  5  o 326.8313 41.89118 21.51962       5.194718      14.87393       9.455593      24.39250       6.216958  264.5305 82.81454 346.6308 47.42718 -82.10028      95.43367 
1 1 1 -13 7  6  o 128.5027 55.46191 -0.2234150     5.048608      -1.226783      9.130257      0.2184875      6.059211  166.4232 73.15565 142.9843 61.22016 23.43889       95.39212 
1 1 1 -13 7  7  o 150.8493 56.11153 3.660181       4.391909      1.706831       6.876652      5.005845       5.707624  160.0207 66.68169 172.9758 64.04076 -12.95512      92.45360 
1 1 1 -13 7  8  o 270.8629 48.32031 15.08123       4.896424      9.273951       7.232264      19.99567       6.653111  215.8059 72.78486 309.9224 57.39051 -94.11646      92.68929 
1 1 1 -13 7  9  o 363.5244 36.71239 26.36555       5.111904      27.10554       7.711245      25.78540       6.827761  362.2692 56.66761 355.1594 50.96287 7.109833       76.21307 
1 1 1 -13 7  10 o 111.4672 51.09902 -3.235484      5.008133      -0.9358342     7.891554      -4.786179      6.480296  155.8443 68.27042 123.6797 57.21028 32.16460       89.07225 
1 1 1 -13 7  11 o 237.9771 60.90068 11.98447       5.651799      5.891746       8.796000      16.26870       7.375916  199.7896 78.14406 275.3774 69.08608 -75.58784      104.3043 
1 1 1 -13 7  12 o 299.8148 54.04448 18.67581       6.061152      11.58720       9.301977      23.90622       7.990295  238.9826 82.50394 336.5374 63.46399 -97.55478      104.0893 
1 1 1 -13 7  13 o 225.9509 65.08701 10.84569       6.022282      -4.592281      9.284318      22.05928       7.912749  153.4912 70.06607 321.5267 65.59169 -168.0355      95.97668 
1 1 1 -13 7  14 o 321.1784 51.10569 21.36483       6.160880      23.47602       9.469544      19.81534       8.112599  326.2296 76.13325 301.5051 70.53848 24.72452       103.7880 
1 1 1 -13 7  15 o 613.4553 41.42210 75.81397       9.810508      0.000000       0.000000      75.81397       9.810508  ?        ?        613.4553 41.42210 0.000000       41.42210 
1 1 1 -13 7  16 o 259.6385 66.09746 14.85755       6.682035      6.120602       9.606757      23.04604       9.300341  200.7859 80.64561 319.3186 76.08041 -118.5327      110.8690 
1 1 1 -13 7  17 o 134.3479 60.93859 -2.660868      6.882454      4.764277       9.845162      -9.757769      9.625089  193.3796 80.11737 137.4188 65.45042 55.96077       103.4531 
1 1 1 -13 7  18 o 154.9131 72.04546 -5.875817      10.48826      -5.875817      10.48826      0.000000       0.000000  154.9131 72.04546 ?        ?        0.000000       72.04546 
1 1 1 -13 7  19 o 562.3652 53.33051 67.00766       11.50795      0.000000       0.000000      67.00766       11.50795  ?        ?        562.3652 53.33051 0.000000       53.33051 
1 1 1 -13 7  20 o 333.9729 93.52364 29.07379       12.61204      43.44416       16.71884      10.09757       19.21219  395.8555 106.4447 240.6361 105.9406 155.2194       150.1795 
1 1 1 -13 7  21 o 158.9781 74.49832 -5.332240      11.56639      3.411030       15.03687      -18.00132      18.10060  202.1131 91.02000 170.2205 83.14124 31.89255       123.2765 
1 1 1 -13 7  22 f 344.4821 61.05375 27.50785       7.868816      23.74699       11.26815      31.08749       10.99331  288.8268 90.40148 342.6966 83.39326 -53.86975      122.9913 
1 1 1 -13 7  23 o 302.0500 86.46173 26.63125       10.65747      0.000000       0.000000      26.63125       10.65747  ?        ?        302.0500 86.46173 0.000000       86.46173 
1 1 1 -13 7  24 o 118.3478 57.96830 -10.38586      8.986200      2.676394       16.39738      -15.99285      10.74312  178.4596 85.11599 120.0612 59.64373 58.39842       103.9332 
1 1 1 -13 7  25 o 144.5627 69.19717 -1.928783      11.04547      20.68331       16.97655      -18.52754      14.54511  207.1037 94.61925 131.6858 66.02242 75.41794       115.3766 
1 1 1 -13 7  26 o 131.8810 62.62107 -0.5558080     8.677779      3.912320       10.99651      -7.931338      14.12826  151.3285 71.44872 137.0147 68.12162 14.31383       98.71917 
1 1 1 -13 7  27 o 128.7473 59.80904 2.340378       7.195473      0.6883643      10.52952      3.787729       9.855731  133.3239 64.73308 139.3671 66.33744 -6.043167      92.68780 
1 1 1 -13 7  28 o 217.1623 73.73305 20.12294       7.422410      20.72300       10.71552      19.56947       10.29109  177.9786 78.69822 176.7839 77.68954 1.194656       110.5851 
1 1 1 -13 7  29 o 146.4517 64.35968 10.65484       7.062579      15.97296       10.10193      5.570064       9.877828  150.3266 70.17683 124.9086 61.09557 25.41805       93.04545 
1 1 1 -13 8  1  o 600.5945 20.82771 70.35701       4.857927      77.65794       6.921603      63.26923       6.819820  629.7967 28.29947 567.1611 31.08104 62.63562       42.03441 
1 1 1 -13 8  2  o 846.3538 20.22296 139.7069       6.646985      137.8735       11.18553      140.7077       8.264501  837.3000 34.39913 848.3749 25.08423 -11.07489      42.57369 
1 1 1 -13 8  3  o 439.0929 29.90341 37.98284       5.068871      30.95008       8.149509      42.42025       6.473411  389.0822 55.50749 462.6261 36.32289 -73.54385      66.33576 
1 1 1 -13 8  4  o 898.8462 17.84968 157.4582       6.230801      165.3216       9.063358      150.4114       8.579873  919.2932 25.38675 876.9077 25.19411 42.38550       35.76633 
1 1 1 -13 8  5  o 319.2621 40.86496 20.49025       4.950439      25.57920       8.413825      17.79580       6.122295  349.6863 64.32686 292.9555 55.85136 56.73077       85.18990 
1 1 1 -13 8  6  o 200.4464 60.52958 8.251134       5.108061      5.010180       9.702513      9.493872       6.008105  201.7721 81.04482 214.6043 65.82217 -12.83218      104.4070 
1 1 1 -13 8  7  o 557.5624 24.10544 60.79661       5.219592      60.47000       7.734864      61.06971       7.072730  552.4675 36.25214 556.1826 32.89099 -3.715088      48.94931 
1 1 1 -13 8  8  o 400.0603 31.69386 31.65620       4.883819      34.61923       7.558569      29.53262       6.398905  413.8325 47.91780 383.1222 43.79395 30.71030       64.91553 
1 1 1 -13 8  9  o 157.2155 64.82066 1.987411       6.401000      0.000000       0.000000      1.987411       6.401000  ?        ?        157.2155 64.82066 0.000000       64.82066 
1 1 1 -13 8  10 o 345.3827 39.64639 23.93205       5.221431      23.58831       8.418076      24.14699       6.656652  333.5301 67.31104 343.2882 51.52124 -9.758148      84.76564 
1 1 1 -13 8  11 o 430.5524 34.71345 36.81922       5.755003      58.96310       9.333972      23.23837       7.309762  541.9076 44.75242 333.9077 58.50235 207.9999       73.65666 
1 1 1 -13 8  12 o 689.3769 40.48888 94.81262       10.79220      94.81262       10.79220      0.000000       0.000000  689.3769 40.48888 ?        ?        0.000000       40.48888 
1 1 1 -13 8  13 o 331.8803 47.44683 22.55606       5.941230      13.14435       8.950119      29.97054       7.943925  248.1054 80.88615 380.1898 55.43374 -132.0844      98.05849 
1 1 1 -13 8  14 f 675.6824 26.95993 89.82108       7.074395      100.3227       10.52996      81.18142       9.550944  708.3964 38.41932 636.8569 38.80189 71.53949       54.60431 
1 1 1 -13 8  15 o 339.9027 51.77226 24.10288       6.618197      24.38093       10.13641      23.89628       8.737669  327.6003 80.29641 329.4376 70.42988 -1.837311      106.8077 
1 1 1 -13 8  16 o 402.4752 45.95370 33.33186       7.053930      45.87695       10.75057      23.84768       9.347475  463.6433 61.20210 324.4805 75.58392 139.1628       97.25546 
1 1 1 -13 8  17 o 126.8259 59.08633 -5.110871      7.103977      -1.763830      10.38194      -8.057815      9.741679  168.5497 75.79342 142.8929 67.39944 25.65672       101.4265 
1 1 1 -13 8  18 o 119.5876 57.09469 -8.166368      7.417104      -5.631872      10.88210      -10.36537      10.13630  158.4601 73.59198 139.3241 66.58057 19.13596       99.24088 
1 1 1 -13 8  19 o 204.3531 77.74111 8.448403       8.534844      10.02780       14.37280      7.588121       10.60758  231.2696 96.38970 207.2947 84.21780 23.97487       127.9985 
1 1 1 -13 8  20 o 491.1223 65.26099 54.28212       12.13898      65.67947       16.45186      40.66220       17.98458  518.2778 84.66168 368.0342 114.0481 150.2436       142.0372 
1 1 1 -13 8  21 o 161.5812 70.04260 2.185685       8.122689      2.159521       11.72667      2.209817       11.26186  181.9364 81.27322 179.7859 80.02759 2.150436       114.0603 
1 1 1 -13 8  22 f 228.2731 75.73627 13.56837       7.834058      17.14981       11.22452      10.16677       10.93906  243.4290 89.87048 206.0637 84.82336 37.36526       123.5787 
1 1 1 -13 8  23 o 116.5646 56.24658 -7.484630      7.643070      -8.149045      11.17671      -6.900998      10.47523  140.1705 67.73011 138.7568 66.67340 1.413788       95.04057 
1 1 1 -13 8  24 o 197.4458 79.57653 11.85192       9.388694      12.72398       17.12098      11.47691       11.22736  197.7661 91.99972 194.1164 83.22961 3.649673       124.0609 
1 1 1 -13 8  25 o 158.7813 70.71246 5.619692       8.804315      1.698822       11.06617      12.38207       14.53302  151.7804 71.66591 184.2069 85.37254 -32.42653      111.4651 
1 1 1 -13 8  26 o 138.5150 64.51987 2.477885       8.464207      4.347879       10.41934      -1.150820      14.51430  148.7669 70.02788 145.2075 71.62375 3.559433       100.1692 
1 1 1 -13 8  27 o 180.1158 71.16375 13.25137       7.360558      19.29242       10.47136      7.351231       10.34853  187.8470 80.45565 146.3897 69.17646 41.45731       106.1060 
1 1 1 -13 8  28 o 109.9111 53.35637 -1.035192      7.145555      -8.230329      10.28995      5.665809       9.930326  108.2004 54.42242 131.7071 63.68911 -23.50669      83.77412 
1 1 1 -13 8  29 o 130.5324 60.18240 7.419277       7.084571      8.771690       10.07120      6.094494       9.967791  129.9063 63.12782 124.3939 60.95580 5.512466       87.75381 
1 1 1 -13 9  1  o 504.6698 23.96809 49.73300       4.697520      45.53930       6.351883      54.79551       6.978889  480.3482 34.27507 527.1236 34.27777 -46.77536      48.47417 
1 1 1 -13 9  2  o 684.8599 27.86379 91.79694       7.410883      0.000000       0.000000      91.79694       7.410883  ?        ?        684.8599 27.86379 0.000000       27.86379 
1 1 1 -13 9  3  f 438.8904 27.12959 37.83521       4.601428      29.66556       6.377810      46.70433       6.645227  384.7452 43.44548 485.9676 35.45534 -101.2224      56.07666 
1 1 1 -13 9  4  o 570.7773 25.96524 63.72594       5.755553      51.31456       9.893795      70.07461       7.076098  504.5320 51.20418 596.9230 30.62755 -92.39108      59.66502 
1 1 1 -13 9  5  o 434.8979 30.82159 37.29747       5.171875      52.85730       9.101539      29.87723       6.285231  513.7245 46.11114 386.1390 42.62352 127.5856       62.79332 
1 1 1 -13 9  6  o 626.1572 25.07456 76.68194       6.097399      96.54546       11.65058      69.18896       7.155612  696.4042 43.29258 592.8237 31.19058 103.5806       53.35822 
1 1 1 -13 9  7  o 686.4672 21.58848 92.00787       5.755325      101.8643       8.686139      84.29424       7.684170  720.1931 31.05631 655.3470 30.19240 64.84601       43.31369 
1 1 1 -13 9  8  f 1012.938 18.38872 200.0549       7.233730      192.8655       10.57148      206.3852       9.919683  992.0771 27.43862 1027.094 24.86908 -35.01648      37.03173 
1 1 1 -13 9  9  o 666.2117 23.18621 86.76984       5.998878      90.98010       9.309559      83.78032       7.844678  678.2370 35.46754 652.9141 30.93792 25.32288       47.06486 
1 1 1 -13 9  10 o 187.0990 62.77020 6.843202       5.378689      -0.1057914E-01 8.893150      10.79636       6.754026  169.4918 73.38046 227.3221 69.79959 -57.83031      101.2752 
1 1 1 -13 9  11 o 450.2779 32.32492 40.14783       5.614957      45.74374       9.100801      36.70851       7.134782  474.6341 50.13195 427.0335 43.63501 47.60065       66.46221 
1 1 1 -13 9  12 f 358.1199 42.08373 25.90111       5.741298      16.20704       9.039316      32.45623       7.433151  272.0841 80.13718 398.8694 49.01755 -126.7853      93.93980 
1 1 1 -13 9  13 o 189.4310 66.18229 6.948103       5.994206      13.88131       9.453746      2.286788       7.751595  253.3581 83.15669 169.4369 70.71729 83.92120       109.1603 
1 1 1 -13 9  14 o 205.4912 66.97586 8.813473       6.136597      21.70651       9.382956      -0.8233681     8.112027  310.9764 77.86742 156.1862 68.79724 154.7902       103.9057 
1 1 1 -13 9  15 f 511.3602 33.88380 52.24137       6.690818      43.77183       10.10676      58.84925       8.927147  455.4052 58.49847 538.3465 43.05988 -82.94135      72.63762 
1 1 1 -13 9  16 o 561.2802 33.66716 63.03196       7.304712      72.72999       11.23727      55.93522       9.612765  593.4235 49.20436 520.7010 48.08001 72.72247       68.79503 
1 1 1 -13 9  17 o 592.3728 33.66483 70.35416       7.712637      82.82476       11.78994      61.02529       10.19723  632.5989 48.35676 542.1320 48.96227 90.46692       68.81628 
1 1 1 -13 9  18 o 452.5489 44.55203 42.34308       7.728466      34.24683       11.23135      49.62440       10.65112  383.6231 78.04359 480.3534 58.29016 -96.73026      97.40916 
1 1 1 -13 9  19 o 190.8169 76.71755 6.249919       8.703099      17.61946       14.74292      0.1686029      10.78229  263.8116 101.7268 174.9289 78.05268 88.88272       128.2208 
1 1 1 -13 9  20 o 563.1059 54.74767 68.83474       11.82110      83.23311       15.70310      50.00440       17.95800  602.7131 68.29371 414.7360 109.7778 187.9772       129.2872 
1 1 1 -13 9  21 f 226.5993 76.77959 12.94532       8.048287      1.723692       11.51326      23.66939       11.25512  177.2255 79.74406 291.1174 90.22370 -113.8919      120.4136 
1 1 1 -13 9  22 o 376.1130 79.75713 37.49664       11.28843      0.000000       0.000000      37.49664       11.28843  ?        ?        376.1130 79.75713 0.000000       79.75713 
1 1 1 -13 9  23 f 122.6980 58.53755 -5.314748      7.767491      -17.04536      11.05122      6.138417       10.91974  121.5255 60.39197 178.2185 79.09250 -56.69300      99.51288 
1 1 1 -13 9  24 o 182.2314 80.01161 9.376019       10.89393      -15.98944      16.49565      28.99632       14.50777  144.4285 72.09494 254.7484 100.1444 -110.3199      123.3960 
1 1 1 -13 9  25 o 173.2010 74.21061 9.486264       8.914877      2.588211       11.00348      22.66421       15.20865  151.3152 71.45126 207.0610 92.52215 -55.74580      116.9001 
1 1 1 -13 9  26 o 141.3448 63.82360 4.577445       7.451071      20.46479       10.77440      -9.985104      10.31540  204.1802 84.13106 115.8386 57.69292 88.34162       102.0123 
1 1 1 -13 9  27 o 119.4314 56.67416 0.8874006      7.086195      1.354678       10.65626      0.5169657      9.487966  129.7377 63.45754 125.5590 61.07469 4.178734       88.07371 
1 1 1 -13 9  28 o 138.7125 62.26810 7.935546       6.973598      2.892174       10.21309      12.34076       9.545083  123.8135 60.87871 147.4735 68.63357 -23.66005      91.74303 
1 1 1 -13 10 1  o 341.8799 43.34777 23.44097       5.626024      23.44097       5.626024      0.000000       0.000000  341.8799 43.34777 ?        ?        0.000000       43.34777 
1 1 1 -13 10 2  o 537.0546 24.51869 56.33334       5.113799      48.19199       7.159810      64.81153       7.306427  493.4171 37.64867 573.8017 32.92583 -80.38461      50.01532 
1 1 1 -13 10 3  o 722.0559 19.40540 101.6220       5.441536      102.1752       7.587281      101.0361       7.808473  722.7325 27.03215 718.5039 27.98395 4.228638       38.90808 
1 1 1 -13 10 4  o 774.8149 27.14718 117.4707       8.168658      117.4707       8.168658      0.000000       0.000000  774.8149 27.14718 ?        ?        0.000000       27.14718 
1 1 1 -13 10 5  o 101.1058 47.91943 -5.830443      5.035773      2.697648       8.857943      -9.902893      6.121175  183.8164 76.06169 102.2920 49.59464 81.52448       90.80203 
1 1 1 -13 10 6  o 309.3936 44.84937 19.37160       5.231736      31.89325       9.561944      14.02142       6.250281  391.5507 65.17353 258.1172 62.92303 133.4335       90.59193 
1 1 1 -13 10 7  f 839.2891 19.26653 137.3718       6.279760      142.8276       9.381016      132.9418       8.453129  853.6667 28.29655 824.0847 26.41299 29.58203       38.70841 
1 1 1 -13 10 8  o 596.7237 25.34224 69.68336       5.872814      79.19627       8.927461      62.42607       7.797561  632.5210 36.49840 561.5035 35.94715 71.01752       51.22822 
1 1 1 -13 10 9  o 121.3383 53.51024 -1.147676      4.921733      1.793583       7.935314      -2.986521      6.274371  170.1973 71.33308 128.9746 58.37244 41.22278       92.17239 
1 1 1 -13 10 10 o 163.3494 60.28447 4.474401       5.049711      9.820683       8.384748      1.431666       6.325519  223.8524 78.27089 152.7247 63.82394 71.12770       100.9942 
1 1 1 -13 10 11 o 828.2383 21.40715 134.1122       6.885607      150.3525       10.73664      122.7662       8.974110  873.4424 31.65236 790.1083 29.24669 83.33417       43.09572 
1 1 1 -13 10 12 o 237.8069 61.60749 12.09435       5.735542      0.7960604E-01  9.042622      20.18156       7.418845  169.6355 73.71830 307.1240 64.26445 -137.4885      97.79727 
1 1 1 -13 10 13 o 136.1767 58.66198 0.1250780      5.626278      -1.059772      8.840090      0.9318040      7.294373  162.0421 71.57443 157.5875 67.31370 4.454529       98.25494 
1 1 1 -13 10 14 o 296.9526 73.32784 19.67048       8.406035      0.000000       0.000000      19.67048       8.406035  ?        ?        296.9526 73.32784 0.000000       73.32784 
1 1 1 -13 10 15 o 185.1265 67.85223 6.461179       6.380842      12.86027       9.548700      1.298142       8.577046  241.8604 83.58562 168.6596 72.54199 73.20085       110.6747 
1 1 1 -13 10 16 o 184.2219 68.83582 6.294170       6.624347      3.462108       9.783165      8.692019       9.001996  186.5436 78.74621 211.2819 79.96848 -24.73828      112.2316 
1 1 1 -13 10 17 o 208.5015 71.51003 9.355177       6.982552      23.78195       10.62024      -1.629586      9.267125  314.8032 84.91665 159.6983 71.72839 155.1049       111.1566 
1 1 1 -13 10 18 o 293.2212 70.86754 19.81026       7.980371      16.17524       13.39962      21.80830       9.934416  258.7449 97.65356 300.1235 82.62141 -41.37860      127.9160 
1 1 1 -13 10 19 o 353.2805 67.19900 28.49757       8.882661      44.91602       14.71431      19.08364       11.14190  419.0277 92.86211 272.5862 90.31567 146.4415       129.5388 
1 1 1 -13 10 20 o 501.3482 59.01626 56.06656       11.27047      52.18036       14.64261      61.71575       17.65422  452.3268 86.50877 475.5744 98.81506 -23.24756      131.3323 
1 1 1 -13 10 21 o 234.6316 75.82703 14.25042       7.874905      30.28348       11.43212      -0.2266686     10.86324  331.0850 87.56641 165.0951 75.52678 165.9899       115.6381 
1 1 1 -13 10 22 o 169.3073 76.98861 2.354400       11.07361      2.354400       11.07361      0.000000       0.000000  169.3073 76.98861 ?        ?        0.000000       76.98861 
1 1 1 -13 10 23 f 233.5432 83.42629 17.45348       9.567756      -11.40201      17.30709      30.15334       11.48178  157.2018 77.66525 302.4722 90.61729 -145.2703      119.3456 
1 1 1 -13 10 24 o 128.2224 63.03616 -9.510637      10.93535      -1.158591      16.27936      -16.37794      14.76163  161.4990 78.87390 135.2142 67.60178 26.28484       103.8802 
1 1 1 -13 10 25 o 248.5912 79.78419 22.12778       8.729736      21.09099       10.86957      24.01175       14.65220  218.2864 86.40456 206.5659 91.64809 11.72044       125.9568 
1 1 1 -13 10 26 o 170.9361 68.94385 10.82868       7.053071      4.249497       10.30466      16.62750       9.674261  141.7960 67.58653 187.2480 78.63520 -45.45206      103.6891 
1 1 1 -13 10 27 o 127.0033 58.38339 3.941395       6.600319      6.525272       10.06399      1.991200       8.743258  137.5766 65.90535 124.8900 60.23722 12.68656       89.28626 
1 1 1 -13 10 28 o 111.4437 53.40823 1.157677       6.624135      12.45340       10.07678      -7.437987      8.790319  143.1717 67.83620 101.2903 50.85801 41.88141       84.78377 
1 1 1 -13 11 1  o 598.3450 28.74496 70.04850       6.679461      70.04850       6.679461      0.000000       0.000000  598.3450 28.74496 ?        ?        0.000000       28.74496 
1 1 1 -13 11 2  o 983.3494 20.17019 188.4966       7.702748      197.1229       9.812490      174.6460       12.43375  1004.516 25.15326 943.1825 33.94521 61.33374       42.24883 
1 1 1 -13 11 3  o 405.5257 29.49267 32.37474       4.612920      31.38001       6.544976      33.35661       6.502539  396.1115 43.24920 408.9801 41.51594 -12.86856      59.95053 
1 1 1 -13 11 4  o 195.7250 56.09134 7.873233       4.483010      1.375779       6.503448      13.75597       6.188164  155.2663 64.78611 256.0960 62.71927 -100.8298      90.17177 
1 1 1 -13 11 5  o 922.1992 20.84628 165.9123       7.465884      155.3197       13.17015      170.9280       9.062727  887.4012 38.21579 935.0906 24.95613 -47.68933      45.64269 
1 1 1 -13 11 6  o 300.3950 46.90455 18.34959       5.293031      16.11320       9.230062      19.44538       6.460931  274.8076 80.98933 306.6492 56.32896 -31.84161      98.65204 
1 1 1 -13 11 7  o 700.8787 25.16334 96.10197       6.849189      117.1543       12.49586      87.06097       8.188873  767.6510 42.07580 665.6474 31.67757 102.0036       52.66727 
1 1 1 -13 11 8  o 392.0529 41.93155 30.82660       6.285308      45.18491       12.61472      26.08494       7.249221  462.8793 72.55984 356.4638 54.06203 106.4155       90.48554 
1 1 1 -13 11 9  o 114.8215 55.45765 -11.07731      7.473001      -11.07731      7.473001      0.000000       0.000000  114.8215 55.45765 ?        ?        0.000000       55.45765 
1 1 1 -13 11 10 o 975.0475 26.71937 186.5391       10.11766      0.000000       0.000000      186.5391       10.11766  ?        ?        975.0475 26.71937 0.000000       26.71937 
1 1 1 -13 11 11 o 347.6610 42.41972 24.47464       5.608556      22.23210       9.024519      25.88587       7.158973  318.8290 74.26622 353.4775 53.85253 -34.64856      91.73640 
1 1 1 -13 11 12 o 306.6190 51.89641 19.58025       5.959182      13.83288       9.454216      23.36897       7.676041  252.4685 83.17299 331.3330 61.93180 -78.86444      103.6981 
1 1 1 -13 11 13 o 456.5418 36.72767 41.79311       6.456718      54.17942       10.15122      33.37733       8.367473  512.7107 51.68727 399.5939 55.41102 113.1168       75.77568 
1 1 1 -13 11 14 o 316.3313 52.63446 21.03815       6.238857      14.98657       9.333043      25.92682       8.388500  257.6732 82.47363 345.6864 64.86735 -88.01315      104.9270 
1 1 1 -13 11 15 o 495.7578 37.14915 49.52176       7.100311      52.90268       10.52959      46.70249       9.615289  502.1075 54.89341 472.4640 53.33786 29.64346       76.53896 
1 1 1 -13 11 16 o 198.9199 69.21255 8.237543       6.552461      0.8634796      9.979649      13.82545       8.687335  175.8189 76.90315 245.9899 79.65757 -70.17091      110.7223 
1 1 1 -13 11 17 o 119.6063 56.48783 -6.317772      6.882617      -5.786222      10.14569      -6.770935      9.367767  152.0117 70.75038 142.4535 66.84731 9.558167       97.33540 
1 1 1 -13 11 18 o 468.3868 45.86825 45.77898       8.236359      29.19392       13.53685      55.52774       10.37848  332.1271 98.13725 510.3769 53.14110 -178.2497      111.6015 
1 1 1 -13 11 19 o 189.9319 80.61082 5.134975       10.34101      5.825494       13.53547      4.166847       16.02701  206.0521 89.85923 209.6675 94.23786 -3.615417      130.2131 
1 1 1 -13 11 20 o 535.6483 86.84222 74.55344       17.44649      0.000000       0.000000      74.55344       17.44649  ?        ?        535.6483 86.84222 0.000000       86.84222 
1 1 1 -13 11 21 o 442.8260 47.65178 43.02985       8.065837      54.08487       11.61452      32.73172       11.20987  475.6061 64.54969 344.8563 84.38959 130.7498       106.2462 
1 1 1 -13 11 22 o 137.7757 63.16773 -0.7156240     7.656644      -1.802945      10.81122      0.3785272      10.84512  152.7289 71.71514 159.2598 73.78888 -6.530838      102.8973 
1 1 1 -13 11 23 o 315.3097 78.53935 29.31417       9.581359      41.69970       17.63849      24.12971       11.41183  288.5622 111.2696 257.0756 91.18856 31.48657       143.8620 
1 1 1 -13 11 24 o 160.9082 74.10056 5.487583       10.69655      2.136654       16.10048      8.135209       14.31148  162.4387 79.13525 172.1900 81.36299 -9.751297      113.5003 
1 1 1 -13 11 25 o 127.9297 60.96187 -0.6598459     8.372503      -1.228834      10.10795      0.5837778      14.94363  133.1318 64.34862 147.7290 72.83072 -14.59718      97.18569 
1 1 1 -13 11 26 o 120.7147 56.96749 0.8708623      6.975602      4.503939       10.20498      -2.315399      9.556867  138.6301 66.39822 121.8221 59.69357 16.80794       89.28632 
1 1 1 -13 11 27 o 166.6828 67.67835 12.37138       6.845561      18.84611       10.02971      6.724670       9.366456  172.7336 76.27062 134.9622 64.35883 37.77142       99.79613 
1 1 1 -13 11 28 o 123.8975 57.49026 5.200575       6.619237      2.712317       9.837392      7.259135       8.947754  119.3555 58.88965 129.1490 61.94074 -9.793503      85.46722 
1 1 1 -13 12 1  o 314.7091 47.08897 20.03724       5.578284      20.03724       5.578284      0.000000       0.000000  314.7091 47.08897 ?        ?        0.000000       47.08897 
1 1 1 -13 12 2  f 208.7002 58.69130 8.992211       4.955993      14.56942       5.842119      -5.324242      9.360078  264.6658 58.40396 153.8766 70.28446 110.7892       91.38342 
1 1 1 -13 12 3  o 420.9708 34.04384 35.03630       5.518042      32.95502       7.017836      38.40696       8.930898  405.3784 45.35463 435.3046 53.98793 -29.92624      70.51055 
1 1 1 -13 12 4  o 189.9700 60.75104 7.181978       5.064919      6.125554       6.343545      9.039834       8.412383  187.2120 67.79949 220.3730 78.27967 -33.16098      103.5591 
1 1 1 -13 12 5  o 408.1426 35.32177 33.03024       5.543446      31.54753       9.007913      33.93405       7.032894  390.8391 61.36868 411.2080 44.76281 -20.36887      75.95936 
1 1 1 -13 12 6  o 649.0588 25.86036 82.44623       6.518484      88.83730       11.58926      79.48871       7.883751  667.0826 44.99804 635.2021 32.06256 31.88049       55.25243 
1 1 1 -13 12 7  o 957.5801 18.91924 178.8508       7.035693      174.9872       10.03052      182.5928       9.871339  944.8903 27.33467 965.5305 26.32583 -20.64020      37.95041 
1 1 1 -13 12 8  o 384.6816 36.91426 29.51381       5.447001      18.90084       8.225068      37.80420       7.269565  296.2587 72.15826 433.6493 43.76464 -137.3906      84.39288 
1 1 1 -13 12 9  o 552.7087 31.21316 60.34913       6.672403      66.78535       12.93335      58.01474       7.788997  569.3309 59.36821 539.8828 37.37960 29.44806       70.15567 
1 1 1 -13 12 10 o 572.8441 27.78726 64.50715       6.181732      58.39685       9.374734      69.20796       8.222692  537.9133 45.29808 589.8583 36.06867 -51.94495      57.90393 
1 1 1 -13 12 11 o 785.1178 22.97633 120.8010       7.005571      125.9692       10.60489      116.7993       9.331559  797.2797 34.25054 769.0140 31.24582 28.26563       46.36163 
1 1 1 -13 12 12 o 466.0138 34.22965 43.33047       6.151478      56.47514       9.749400      34.63614       7.929047  525.7675 48.28774 409.6218 50.94413 116.1456       70.19267 
1 1 1 -13 12 13 o 366.4969 44.69332 27.51364       6.229471      33.15932       9.549914      23.33213       8.218783  392.4701 64.92638 326.9043 66.98930 65.56580       93.28987 
1 1 1 -13 12 14 o 683.6393 27.38735 92.29004       7.271183      109.5715       11.35254      80.26965       9.468092  737.1425 39.80399 631.2195 38.81181 105.9230       55.59419 
1 1 1 -13 12 15 o 448.7845 38.88702 40.81642       6.710526      53.61621       10.62488      32.32223       8.655329  504.8111 55.09036 388.4251 59.25456 116.3860       80.90767 
1 1 1 -13 12 16 o 412.1986 44.16232 35.03652       6.959406      35.09735       10.84862      34.99398       9.072098  393.4939 73.70029 402.6006 59.84409 -9.106659      94.93707 
1 1 1 -13 12 17 o 220.5284 90.94559 8.699907       12.60394      8.699907       12.60394      0.000000       0.000000  220.5284 90.94559 ?        ?        0.000000       90.94559 
1 1 1 -13 12 18 o 224.8707 75.57323 11.85828       7.796736      17.44417       13.11889      8.807870       9.694618  259.6830 96.90235 207.7087 81.79639 51.97432       126.8098 
1 1 1 -13 12 19 o 163.3818 73.97982 -0.5022368     10.09193      -3.635498      13.73758      3.171060       14.87441  174.8600 81.69910 198.7679 89.92558 -23.90788      121.4963 
1 1 1 -13 12 20 o 154.2644 67.43632 1.929624       7.664054      2.675443       11.07761      1.244868       10.61444  175.9179 78.75892 168.5729 76.14204 7.344986       109.5471 
1 1 1 -13 12 21 o 510.2662 41.22588 55.89264       8.099712      59.08807       11.72196      52.97287       11.20496  496.4474 62.16217 468.5103 63.19577 27.93710       88.64446 
1 1 1 -13 12 22 o 158.9122 68.25702 4.582528       7.575355      5.034264       10.71663      4.131375       10.70971  171.1643 76.98390 167.9588 76.11713 3.205551       108.2605 
1 1 1 -13 12 23 o 236.2307 83.81551 19.52297       9.641610      17.38115       16.90602      20.55540       11.73756  200.5316 92.63493 227.5314 89.87562 -26.99980      129.0692 
1 1 1 -13 12 24 o 127.0639 60.67101 -2.069287      8.380363      -0.5543228     10.13561      -5.343021      14.89945  138.6456 66.34405 144.0245 71.31930 -5.378952      97.40623 
1 1 1 -13 12 25 o 146.7585 67.17511 5.998345       8.609858      9.498425       10.13061      -3.105636      16.33850  158.9221 72.78814 140.3773 70.32101 18.54471       101.2085 
1 1 1 -13 12 26 o 144.9583 63.42662 7.488197       6.793646      12.06263       9.493545      2.687003       9.726006  157.5658 71.50866 130.1096 62.94412 27.45621       95.26516 
1 1 1 -13 12 27 o 111.2668 53.38796 0.5386881      6.663676      4.516408       9.689666      -3.030652      9.178796  126.9598 61.74786 111.2263 55.23354 15.73353       82.84650 
1 1 1 -13 13 1  o 818.4971 23.37151 130.8066       7.429028      130.8066       7.429028      0.000000       0.000000  818.4971 23.37151 ?        ?        0.000000       23.37151 
1 1 1 -13 13 2  o 158.9345 60.15181 3.810768       5.093099      3.791743       6.123336      3.853473       9.174323  167.7227 65.31121 192.6890 78.30712 -24.96626      101.9684 
1 1 1 -13 13 3  o 966.7321 21.07778 182.3513       7.913324      193.8317       9.934635      162.4238       13.08881  995.5333 25.69616 907.7927 37.12661 87.74060       45.15172 
1 1 1 -13 13 4  o 315.4560 38.95006 19.93829       4.670395      24.01798       6.556924      15.73689       6.654017  343.3364 50.70135 273.2533 63.85268 70.08316       81.53400 
1 1 1 -13 13 5  o 700.0236 29.20802 96.13454       7.940407      82.02517       11.11183      110.8574       11.35085  640.7078 44.94226 747.6903 39.22809 -106.9825      59.65443 
1 1 1 -13 13 6  o 812.0804 23.64155 128.9761       7.455949      125.8094       12.91288      130.5599       9.132062  794.9304 41.97670 815.6336 28.83007 -20.70319      50.92363 
1 1 1 -13 13 7  o 893.5405 20.06087 155.8925       6.961328      156.9491       10.04955      154.9178       9.652081  893.9028 28.94865 888.4344 27.97484 5.468384       40.25688 
1 1 1 -13 13 8  o 487.4698 29.91770 46.92243       5.636366      49.01133       8.401041      45.21247       7.600933  493.4549 44.31101 474.7903 41.64342 18.66452       60.80822 
1 1 1 -13 13 9  o 127.6156 56.03347 -0.8800163     5.343236      9.420671       7.972370      -9.280441      7.199543  217.9243 76.31490 116.2602 55.70677 101.6641       94.48390 
1 1 1 -13 13 10 o 556.7924 29.56736 61.27505       6.370511      68.13046       9.980876      56.56227       8.275421  580.8763 44.58442 530.8232 40.44765 50.05310       60.19786 
1 1 1 -13 13 11 o 390.3647 45.48371 31.09933       6.766037      30.96704       13.79189      31.14125       7.764599  362.1938 96.36482 387.3784 53.00299 -25.18460      109.9795 
1 1 1 -13 13 12 o 618.0329 27.43177 75.30167       6.584055      68.58291       10.06631      80.32500       8.704053  580.9756 44.96554 634.2019 35.48227 -53.22632      57.27906 
1 1 1 -13 13 13 o 294.0127 56.40983 18.43590       6.206659      16.25915       9.701165      19.94434       8.075763  266.7665 83.94314 299.4092 70.60140 -32.64273      109.6860 
1 1 1 -13 13 14 o 131.6348 59.31552 -2.163247      6.396834      -7.295961      9.891370      1.526653       8.386683  147.0958 68.91837 167.8986 71.95974 -20.80283      99.63908 
1 1 1 -13 13 15 o 379.5435 46.75278 29.90079       6.745545      23.65600       10.20836      34.74086       8.987179  316.7659 82.25349 402.0720 59.33964 -85.30609      101.4240 
1 1 1 -13 13 16 o 328.8094 97.69038 27.85786       13.38536      27.85786       13.38536      0.000000       0.000000  328.8094 97.69038 ?        ?        0.000000       97.69038 
1 1 1 -13 13 17 o 162.2592 68.73535 2.509178       7.495844      10.32096       13.26893      -1.152294      9.084244  227.0146 93.43101 157.5764 70.87499 69.43816       117.2716 
1 1 1 -13 13 18 o 174.6265 71.52849 4.884358       7.731026      20.23503       13.09083      -3.336802      9.580100  269.9609 97.45348 151.1342 69.78685 118.8268       119.8640 
1 1 1 -13 13 19 o 129.4989 61.76908 -7.197325      8.639173      -18.66571      10.72703      13.97169       14.57400  121.7055 60.31138 230.5054 96.64358 -108.7998      113.9186 
1 1 1 -13 13 20 o 431.0254 46.53096 40.65530       7.665289      41.85889       11.79285      39.77477       10.08672  399.0680 78.88895 404.2555 66.56642 -5.187500      103.2209 
1 1 1 -13 13 21 o 137.5883 62.83413 -0.3901305     7.476932      15.78681       10.86900      -14.92257      10.30174  223.2187 86.98812 120.2845 59.51702 102.9342       105.4002 
1 1 1 -13 13 22 o 126.5933 59.51440 -2.504677      7.483541      -15.32430      10.66270      9.940208       10.50570  118.9914 59.16384 185.9685 80.13554 -66.97703      99.60956 
1 1 1 -13 13 23 o 281.2727 88.74683 29.36843       10.83660      39.93074       16.01797      20.45424       14.71529  272.1035 105.7227 205.8448 91.56178 66.25876       139.8601 
1 1 1 -13 13 24 o 292.7852 74.59131 27.96634       8.505268      38.88186       10.24184      3.711738       15.26697  340.3096 79.01270 153.5611 75.28732 186.7485       109.1384 
1 1 1 -13 13 25 o 107.8970 52.23436 -3.096611      6.727029      -3.444914      9.305124      -2.715271      9.736438  119.3323 58.56032 122.3344 60.00700 -3.002090      83.84600 
1 1 1 -13 13 26 f 85.92936 43.28395 -11.76437      6.640631      -5.173082      9.747547      -17.47297      9.071406  112.3401 55.97200 92.93134 47.22631 19.40881       73.23380 
1 1 1 -13 14 1  o 270.0125 57.28891 15.18908       5.821314      15.18908       5.821314      0.000000       0.000000  270.0125 57.28891 ?        ?        0.000000       57.28891 
1 1 1 -13 14 2  o 117.8048 52.36375 -1.528142      4.804645      2.760760       5.635618      -12.94037      9.192924  155.3989 61.99279 128.8590 62.05400 26.53993       87.71434 
1 1 1 -13 14 3  o 189.2200 61.30658 7.125006       5.145211      4.320386       6.105240      13.99927       9.558258  170.9000 65.57541 258.6754 83.53323 -87.77533      106.1976 
1 1 1 -13 14 4  o 502.1365 26.60015 49.53359       5.168718      49.77863       7.566408      49.31920       7.077412  499.9971 39.28303 498.4177 36.82469 1.579407       53.84435 
1 1 1 -13 14 5  o 514.9252 30.11875 52.28093       5.996708      64.69260       10.14048      45.60622       7.436347  567.3572 46.42958 477.8400 40.45256 89.51715       61.58016 
1 1 1 -13 14 6  o 487.1868 33.30274 47.01905       6.263145      50.18848       10.56064      45.29946       7.778812  494.8308 55.93693 475.1719 42.60616 19.65887       70.31518 
1 1 1 -13 14 7  f 561.8083 30.29821 62.30913       6.586041      58.50338       8.291067      68.81702       10.84202  541.1394 39.73013 583.3572 48.29147 -42.21783      62.53438 
1 1 1 -13 14 8  o 461.4701 32.42759 42.24750       5.774567      56.24259       8.753587      31.46472       7.683579  528.7706 43.00006 391.2030 51.85247 137.5675       67.36233 
1 1 1 -13 14 9  o 277.6052 52.75038 16.13245       5.479061      9.769176       8.278327      21.09279       7.309011  220.7750 77.73561 314.6805 62.01344 -93.90544      99.44090 
1 1 1 -13 14 10 o 875.2568 21.30638 150.0049       7.242243      158.9803       10.63578      142.2454       9.889091  897.1325 30.52705 848.8494 29.99838 48.28314       42.79957 
1 1 1 -13 14 11 o 533.2927 31.29115 56.47743       6.452218      58.47878       9.496462      54.76136       8.793641  535.8908 46.07888 519.5326 43.99740 16.35822       63.71056 
1 1 1 -13 14 12 o 241.9899 69.62321 12.90987       6.894714      6.704475       13.95086      14.91536       7.930974  225.9786 94.64028 258.2171 74.78276 -32.23849      120.6202 
1 1 1 -13 14 13 o 315.3950 64.12609 21.71243       7.586904      12.54551       15.87829      24.42450       8.636598  255.3311 103.2825 332.2016 69.19127 -76.87054      124.3170 
1 1 1 -13 14 14 o 296.2980 59.16040 19.04313       6.569135      17.82408       10.26195      19.88952       8.550735  274.6394 86.32141 294.8676 74.61043 -20.22815      114.0969 
1 1 1 -13 14 15 f 304.0819 65.60104 20.67642       7.519426      26.30927       12.64641      17.59593       9.352181  322.9903 94.68974 271.9942 81.85004 50.99609       125.1622 
1 1 1 -13 14 16 o 266.8973 70.89455 16.59896       7.472558      33.50546       13.24483      8.704718       9.050547  361.6096 93.59077 206.9484 79.73116 154.6612       122.9483 
1 1 1 -13 14 17 o 186.3913 84.45566 0.5002512      13.17802      0.5002512      13.17802      0.000000       0.000000  186.3913 84.45566 ?        ?        0.000000       84.45566 
1 1 1 -13 14 18 o 151.2697 68.56960 -0.9157395     8.696880      -0.9958286     11.18347      -0.7932009     13.83331  166.9731 76.47614 181.1265 83.71433 -14.15344      113.3873 
1 1 1 -13 14 19 o 340.2033 70.95188 28.81722       9.070642      28.80022       11.23939      28.84896       15.36105  318.9924 87.90719 289.1862 105.3857 29.80621       137.2364 
1 1 1 -13 14 20 o 160.5573 68.43179 4.254320       7.508801      3.990299       11.24330      4.466887       10.08842  174.3367 78.59016 172.0312 76.19997 2.305557       109.4662 
1 1 1 -13 14 21 o 323.0975 62.47174 26.33446       7.555167      31.10003       11.32714      22.51519       10.14034  309.8236 89.26821 262.9444 86.11477 46.87921       124.0345 
1 1 1 -13 14 22 o 129.7044 61.97902 -3.488971      8.780347      12.85488       16.20424      -10.28217      10.44692  188.7663 88.36835 124.1876 61.16061 64.57869       107.4690 
1 1 1 -13 14 23 o 174.9945 77.58910 11.02932       10.48475      23.66198       14.81528      -1.645712      14.84010  206.0649 91.75220 148.8672 73.23356 57.19771       117.3951 
1 1 1 -13 14 24 o 128.2819 60.49022 1.134104       7.836441      -0.3064649     9.233350      4.844117       14.81768  129.0990 62.17482 149.1086 73.31876 -20.00964      96.13193 
1 1 1 -13 14 25 o 150.8363 64.06442 8.350692       6.539256      12.92038       9.373561      4.018080       9.127170  162.1682 72.53677 133.1786 63.51468 28.98962       96.41420 
1 1 1 -13 14 26 o 149.8966 64.31634 9.618503       6.713159      23.53538       9.671318      -3.321709      9.325788  195.7043 80.06387 112.1699 55.69733 83.53442       97.53162 
1 1 1 -13 15 1  o 699.0797 27.14666 95.75700       7.370062      95.75700       7.370062      0.000000       0.000000  699.0797 27.14666 ?        ?        0.000000       27.14666 
1 1 1 -13 15 2  o 337.5175 42.38739 22.95335       5.433438      26.32627       6.479637      14.96388       9.972555  360.2502 47.47078 265.7400 85.27316 94.51016       97.59604 
1 1 1 -13 15 3  f 849.0175 20.81937 140.7725       6.864553      146.8482       8.197581      126.5131       12.55842  866.2316 24.36822 797.5102 40.68342 68.72137       47.42310 
1 1 1 -13 15 4  o 230.5733 59.27206 11.22328       5.336703      11.09811       6.298967      11.54168       10.04615  229.2457 66.71902 241.5002 85.56963 -12.25452      108.5062 
1 1 1 -13 15 5  o 536.1772 31.61618 56.82280       6.554202      71.53642       11.83872      50.31996       7.870396  593.4541 51.88925 501.4993 40.76365 91.95480       65.98613 
1 1 1 -13 15 6  f 120.7537 53.86744 -1.666604      5.132376      6.624987       7.712842      -8.255844      6.875641  197.0034 74.14553 115.7442 55.17972 81.25925       92.42490 
1 1 1 -13 15 7  o 299.4843 48.42247 18.48106       5.439624      30.51856       8.386952      9.740668       7.146633  382.3900 58.32290 217.6040 72.34386 164.7860       92.92575 
1 1 1 -13 15 8  o 475.1073 36.91168 45.10955       6.757108      44.65032       8.565758      45.86615       10.99460  468.2655 47.77172 467.4772 62.09730 0.7882996      78.34674 
1 1 1 -13 15 9  o 108.9408 52.15348 -7.981527      6.279312      -13.55023      8.185551      -0.1835210E-01 9.788454  115.4493 56.28330 174.4758 76.24326 -59.02652      94.76731 
1 1 1 -13 15 10 f 328.5731 66.92800 23.43269       8.250153      0.000000       0.000000      23.43269       8.250153  ?        ?        328.5731 66.92800 0.000000       66.92800 
1 1 1 -13 15 11 o 511.7837 32.68235 52.18192       6.461820      54.65481       9.667839      50.18516       8.687375  515.9710 48.82833 495.9678 45.61439 20.00320       66.81975 
1 1 1 -13 15 12 o 399.9856 43.34323 32.69750       6.625052      32.29739       9.900854      33.02189       8.914983  383.7324 68.97351 393.2713 60.29458 -9.538910      91.61212 
1 1 1 -13 15 13 o 155.1939 64.94827 2.052164       6.563546      -4.785503      10.25713      6.793418       8.541194  157.5377 72.55366 197.4853 77.07004 -39.94762      105.8481 
1 1 1 -13 15 14 o 434.5400 56.55244 40.33782       9.317395      0.000000       0.000000      40.33782       9.317395  ?        ?        434.5400 56.55244 0.000000       56.55244 
1 1 1 -13 15 15 o 461.7791 83.70977 51.06980       14.45920      51.06980       14.45920      0.000000       0.000000  461.7791 83.70977 ?        ?        0.000000       83.70977 
1 1 1 -13 15 16 f 481.9631 44.73878 48.68676       8.278358      55.83363       14.61679      45.31172       10.04462  479.4283 81.41760 453.5779 58.37853 25.85040       100.1842 
1 1 1 -13 15 17 o 188.7606 71.83729 7.657898       7.289536      19.96371       11.37770      -0.9105447     9.494023  268.6698 91.28835 157.4367 71.47329 111.2332       115.9396 
1 1 1 -13 15 18 o 301.7853 75.19460 23.32146       8.780654      16.78225       11.10318      34.23884       14.34643  242.4517 89.40801 329.9950 101.7958 -87.54326      135.4849 
1 1 1 -13 15 19 o 138.9518 64.77919 -2.700421      8.561741      -3.027003      10.81226      -2.151368      14.01933  151.9970 71.48264 169.2444 80.13879 -17.24741      107.3871 
1 1 1 -13 15 20 o 138.5596 62.49286 0.6470011      7.119377      -0.5209280     10.61227      1.602799       9.600261  153.7251 71.81848 155.8682 71.18886 -2.143143      101.1224 
1 1 1 -13 15 21 o 132.5659 61.18953 -0.3528764     7.354661      -7.399906      10.44749      6.570266       10.35525  131.3337 63.93024 170.4547 76.24213 -39.12105      99.49843 
1 1 1 -13 15 22 o 157.7766 73.27584 4.894312       10.78956      -4.366878      15.62315      13.33915       14.91870  149.7750 73.95737 182.5537 85.24171 -32.77875      112.8532 
1 1 1 -13 15 23 o 151.2510 66.81044 6.478499       7.703155      5.415406       9.072683      9.224201       14.58064  148.4244 68.31184 161.1577 77.74480 -12.73331      103.4928 
1 1 1 -13 15 24 o 123.2999 57.54811 1.700475       6.787743      7.506123       9.317058      -4.866165      9.908891  147.3651 68.31856 118.6039 58.62797 28.76122       90.02591 
1 1 1 -13 15 25 o 105.3444 51.00309 -2.073903      6.417130      -13.07330      8.887891      9.904142       9.274858  97.58668 49.26989 147.0983 68.18383 -49.51165      84.12227 
1 1 1 -13 16 1  o 844.3416 27.59323 139.8199       9.047919      139.8199       9.047919      0.000000       0.000000  844.3416 27.59323 ?        ?        0.000000       27.59323 
1 1 1 -13 16 2  o 181.5783 62.32038 6.306355       5.303688      9.600955       6.409339      -0.8496615     9.445991  215.7940 68.26923 170.4432 74.67831 45.35075       101.1807 
1 1 1 -13 16 3  o 1092.552 19.15266 232.9907       8.126419      234.2009       9.713934      230.1690       14.83316  1094.183 22.86006 1079.185 35.39238 14.99744       42.13315 
1 1 1 -13 16 4  o 854.4819 23.76833 142.9632       7.887321      148.5586       9.908292      133.2845       13.03143  869.1498 29.35460 817.3268 41.18754 51.82300       50.57772 
1 1 1 -13 16 5  o 512.9639 42.04060 52.81376       8.301399      39.71193       11.47906      67.17825       12.01947  431.3231 71.00028 572.8058 54.69666 -141.4828      89.62569 
1 1 1 -13 16 6  o 444.8596 33.15483 39.31900       5.686802      33.31380       7.960236      45.57855       8.127064  402.4992 52.15128 474.9793 44.58025 -72.48010      68.60870 
1 1 1 -13 16 7  o 508.0500 29.41705 51.02424       5.779245      56.41325       8.308094      45.97183       8.044456  530.1267 40.66460 476.9417 43.92498 53.18506       59.85828 
1 1 1 -13 16 8  o 172.2013 63.32702 5.241148       5.564769      3.802157       8.243615      6.445799       7.542574  181.3953 74.03067 193.3839 73.19839 -11.98860      104.1083 
1 1 1 -13 16 9  o 131.6007 57.39011 -0.4272243     5.520864      2.391006       8.106476      -2.865126      7.539663  172.0000 72.09394 141.7967 64.09878 30.20329       96.46859 
1 1 1 -13 16 10 o 239.1454 70.05512 12.55869       6.924528      12.91129       9.174056      12.09184       10.55631  243.2752 81.97597 240.6277 87.41277 2.647491       119.8376 
1 1 1 -13 16 11 o 463.5766 49.66158 44.43861       8.801521      0.000000       0.000000      44.43861       8.801521  ?        ?        463.5766 49.66158 0.000000       49.66158 
1 1 1 -13 16 12 o 424.9207 79.49856 41.24955       12.63659      41.24955       12.63659      0.000000       0.000000  424.9207 79.49856 ?        ?        0.000000       79.49856 
1 1 1 -13 16 13 o 491.6316 41.49841 49.44037       7.849128      46.39409       13.74143      50.91562       9.562664  445.2630 82.50536 492.9874 50.66868 -47.72437      96.82175 
1 1 1 -13 16 14 o 364.9539 54.95668 28.72254       7.547511      28.00243       13.00555      29.08822       9.267784  327.9733 95.98901 357.3616 69.27993 -29.38828      118.3790 
1 1 1 -13 16 15 o 150.7061 66.57633 0.1733969      7.651121      -10.84861      13.69604      5.173513       9.224753  160.6977 76.95554 185.3567 77.23488 -24.65904      109.0293 
1 1 1 -13 16 16 o 593.3654 40.13324 73.22091       9.193762      39.13977       20.97860      81.32246       10.22830  327.7647 122.4933 622.9365 42.53390 -295.1718      129.6678 
1 1 1 -13 16 17 o 565.0488 47.87119 69.19971       10.40607      0.000000       0.000000      69.19971       10.40607  ?        ?        565.0488 47.87119 0.000000       47.87119 
1 1 1 -13 16 18 o 568.4203 42.25250 69.33344       9.260492      87.15603       11.98863      42.96818       14.58143  626.4624 49.68487 369.9555 99.37752 256.5069       111.1057 
1 1 1 -13 16 19 o 122.6219 57.60356 -3.373402      6.988187      0.5221889      10.29104      -6.706810      9.519561  156.6443 72.33076 131.8162 63.39453 24.82814       96.18007 
1 1 1 -13 16 20 o 299.0101 63.68898 23.17099       7.169165      19.30641       10.67915      26.34156       9.672837  233.8810 87.39827 291.8053 81.97079 -57.92430      119.8235 
1 1 1 -13 16 21 o 162.7789 74.51979 5.802207       10.60128      10.51845       15.64233      1.795684       14.41741  179.4931 84.88988 160.0412 77.23211 19.45193       114.7654 
1 1 1 -13 16 22 o 199.6944 82.87250 17.61254       10.55930      16.90633       14.65646      18.37470       15.22604  182.6745 85.02647 185.1319 86.33463 -2.457367      121.1741 
1 1 1 -13 16 23 o 120.1814 57.80660 -1.408002      7.921534      -3.321463      9.215153      4.008324       15.50405  121.0555 59.16859 146.5806 72.61481 -25.52503      93.66874 
1 1 1 -13 16 24 o 111.7502 53.48211 -0.7673545     6.592087      -14.32906      8.836032      16.25560       9.899600  97.03199 49.00602 172.4890 75.98814 -75.45701      90.42007 
1 1 1 -13 17 1  o 329.0869 70.40042 23.19866       8.725241      23.19866       8.725241      0.000000       0.000000  329.0869 70.40042 ?        ?        0.000000       70.40042 
1 1 1 -13 17 2  o 145.0617 62.54517 -0.2456418E-02 6.407343      -6.657347      8.417783      9.164124       9.879409  138.1861 64.35863 225.3008 84.08759 -87.11473      105.8903 
1 1 1 -13 17 3  o 683.3158 24.82435 91.50050       6.587602      96.58697       7.906736      79.95579       11.91190  700.8711 29.04900 628.7142 49.17826 72.15692       57.11695 
1 1 1 -13 17 4  o 302.6529 54.03891 19.07824       6.118517      15.46057       7.481081      26.38689       10.63332  267.0526 70.93456 345.4867 80.70898 -78.43408      107.4507 
1 1 1 -13 17 5  o 173.8742 69.10061 3.999833       6.977647      4.594383       9.253780      3.216311       10.62309  193.7867 78.68596 196.1569 82.39014 -2.370148      113.9281 
1 1 1 -13 17 6  o 368.9085 39.71379 27.42854       5.600029      27.52502       7.921971      27.33218       7.917306  362.2966 58.28031 360.9013 58.49047 1.395294       82.56954 
1 1 1 -13 17 7  o 221.4300 63.24862 10.50728       5.709351      19.44109       8.574506      3.391596       7.652424  296.2954 74.57318 174.5112 71.28597 121.7842       103.1642 
1 1 1 -13 17 8  o 428.0836 41.63510 37.09225       6.834172      24.57296       12.01608      43.07836       8.308935  324.3029 91.45374 459.0179 47.28783 -134.7150      102.9559 
1 1 1 -13 17 9  o 381.9132 47.04589 30.00973       6.830208      46.06790       12.20769      22.69218       8.240782  460.0295 70.58525 321.6885 68.08636 138.3411       98.07156 
1 1 1 -13 17 10 o 217.6631 70.33148 10.24319       6.775019      9.171368       11.95364      10.75044       8.223377  227.0489 90.37716 224.3342 77.56608 2.714691       119.0988 
1 1 1 -13 17 11 o 504.4936 68.39844 55.82786       13.05525      55.82786       13.05525      0.000000       0.000000  504.4936 68.39844 ?        ?        0.000000       68.39844 
1 1 1 -13 17 12 o 205.2933 77.20975 8.454674       8.360579      11.09361       12.14714      6.079258       11.52469  232.3997 91.54720 206.0050 86.12450 26.39468       125.6914 
1 1 1 -13 17 13 o 136.5716 62.17886 -2.553322      7.251205      5.158767       12.65990      -6.318667      8.845993  204.3235 88.00697 138.0148 64.82664 66.30864       109.3056 
1 1 1 -13 17 14 o 307.1867 65.37820 21.69882       7.560007      26.07733       13.01417      19.46874       9.287810  308.3008 97.25356 279.2456 80.94298 29.05521       126.5307 
1 1 1 -13 17 15 o 108.8535 52.67234 -8.796463      6.819978      -7.026055      10.67743      -10.01648      8.863651  147.1174 69.74133 125.1690 60.44152 21.94839       92.28775 
1 1 1 -13 17 16 o 151.4136 65.28326 2.180998       6.980493      3.433454       11.00526      1.337925       9.029251  179.2092 79.47314 160.7614 71.60100 18.44777       106.9705 
1 1 1 -13 17 17 f 490.0569 61.02701 56.58467       11.36277      37.51224       18.45035      68.23851       14.42235  305.3611 114.7268 519.1091 73.60134 -213.7480      136.3062 
1 1 1 -13 17 18 o 155.7998 71.99330 0.1119513      10.22277      8.652388       16.10041      -5.656728      13.23229  197.1348 90.83087 155.1840 74.66013 41.95079       117.5771 
1 1 1 -13 17 19 o 224.7337 71.50912 14.36643       7.024317      9.672676       9.848785      19.22599       10.02123  186.5355 78.89080 239.8439 85.41195 -53.30844      116.2711 
1 1 1 -13 17 20 o 122.0321 57.14260 -1.714872      6.783320      -9.170945      9.141788      7.419578       10.11853  118.1458 57.99141 169.6928 75.67182 -51.54700      95.33745 
1 1 1 -13 17 21 o 187.1175 79.03517 13.60651       9.864467      -4.920817      13.45333      35.15001       14.50713  140.0802 69.06841 252.3555 99.84281 -112.2753      121.4044 
1 1 1 -13 17 22 o 147.9254 66.82507 6.145327       8.178998      6.295216       9.794169      5.799922       14.86778  149.6540 69.60667 151.9744 74.46548 -2.320343      101.9323 
1 1 1 -13 17 23 o 107.2744 51.94284 -2.900698      6.660044      -5.694185      9.131033      0.2748456      9.735442  113.2670 56.04268 127.3542 61.92896 -14.08718      83.52232 
1 1 1 -13 18 1  o 519.2476 46.30801 54.43213       9.240100      54.43213       9.240100      0.000000       0.000000  519.2476 46.30801 ?        ?        0.000000       46.30801 
1 1 1 -13 18 2  o 671.9454 29.61663 88.87568       7.728542      100.6353       10.06830      72.00715       12.05860  711.6299 36.55462 594.1035 52.81532 117.5264       64.23160 
1 1 1 -13 18 3  o 740.5816 28.23487 107.8802       8.120575      106.6746       10.51602      109.6609       12.78091  732.1583 37.10561 738.3182 44.78658 -6.159973      58.16068 
1 1 1 -13 18 4  o 247.5441 80.61398 13.17287       8.890902      -0.3052590     15.25715      20.10323       10.94048  211.6696 93.73549 298.0982 88.26288 -86.42859      128.7504 
1 1 1 -13 18 5  o 549.2913 47.89291 61.39495       10.11428      54.82266       16.98596      65.00533       12.58946  489.9626 92.66320 558.9810 58.87940 -69.01843      109.7873 
1 1 1 -13 18 6  o 830.9695 45.22398 139.6501       14.53931      0.000000       0.000000      139.6501       14.53931  ?        ?        830.9695 45.22398 0.000000       45.22398 
1 1 1 -13 18 7  o 86.49333 43.33791 -16.88579      6.221701      3.929876       11.09437      -26.43554      7.514561  199.7553 84.06509 85.89694 43.58287 113.8584       94.69112 
1 1 1 -13 18 8  o 350.1970 51.88380 25.65051       6.842733      26.88324       12.20470      25.08536       8.263738  336.3663 91.15605 339.7007 65.00829 -3.334320      111.9621 
1 1 1 -13 18 9  o 466.4801 39.90316 44.13715       7.159270      50.96275       12.62046      40.89845       8.693410  482.1613 69.39865 442.7381 51.52463 39.42325       86.43472 
1 1 1 -13 18 10 o 203.4713 70.32803 8.765504       6.759977      26.35243       12.36832      1.273988       8.072361  326.4195 93.04183 162.9714 70.23521 163.4480       116.5752 
1 1 1 -13 18 11 o 393.1763 48.92636 32.50052       7.309065      15.38934       12.79264      40.79343       8.905816  254.6378 95.55781 437.9393 53.47456 -183.3014      109.5026 
1 1 1 -13 18 12 o 249.5057 69.84306 14.52279       7.035196      23.68991       12.85212      10.60071       8.406520  298.4783 96.90895 216.9862 78.12676 81.49211       124.4795 
1 1 1 -13 18 13 o 217.3372 75.41185 11.09389       7.776241      7.972956       10.04472      15.76219       12.28499  202.4043 82.05138 247.7078 93.50002 -45.30359      124.3973 
1 1 1 -13 18 14 o 564.5474 39.63126 66.24921       8.633868      70.24090       10.90997      59.56012       14.12305  570.8727 49.70637 495.1044 75.87030 75.76825       90.70295 
1 1 1 -13 18 15 o 143.0585 63.13266 0.7248639      6.862672      -2.001028      10.07342      3.085757       9.374770  155.0011 71.56844 169.8779 74.41429 -14.87688      103.2450 
1 1 1 -13 18 16 o 163.3659 67.50188 4.768596       6.961912      4.670856       10.44979      4.846602       9.335443  177.6374 78.17020 174.0817 75.27546 3.555649       108.5218 
1 1 1 -13 18 17 o 171.0595 71.76735 5.997331       8.045531      6.405030       10.10110      5.289842       13.30635  178.9395 77.83771 183.3067 83.75571 -4.367203      114.3404 
1 1 1 -13 18 18 o 116.2786 55.32458 -4.432316      6.840374      -10.45641      9.715422      1.489524       9.632611  122.7192 60.14454 153.6629 70.59887 -30.94377      92.74462 
1 1 1 -13 18 19 o 135.7444 62.33859 0.5942820      7.498974      14.87153       12.43047      -7.574815      9.402696  198.7858 86.40887 123.6677 60.29715 75.11806       105.3672 
1 1 1 -13 18 20 o 151.0270 73.81493 -0.4852567     14.33776      0.000000       0.000000      -0.4852567     14.33776  ?        ?        151.0270 73.81493 0.000000       73.81493 
1 1 1 -13 18 21 o 172.5944 74.62654 11.63147       9.173754      7.311492       11.70205      18.51964       14.77656  155.7210 73.57845 180.4350 84.44194 -24.71400      112.0010 
1 1 1 -13 18 22 o 126.3567 59.67404 1.484376       7.679855      3.826778       9.157096      -4.070224      14.10112  136.9869 64.83657 131.8088 65.92525 5.178131       92.46577 
1 1 1 -13 18 23 o 112.2134 54.62504 -2.214185      7.629602      -4.015608      13.07726      -1.284586      9.394130  124.8856 62.61159 120.5725 59.10245 4.313042       86.10059 
1 1 1 -13 19 1  o 676.6328 30.71880 90.35020       8.072078      90.35020       8.072078      0.000000       0.000000  676.6328 30.71880 ?        ?        0.000000       30.71880 
1 1 1 -13 19 2  o 542.5895 29.82259 58.24040       6.260009      60.08679       7.504234      54.01546       11.35156  549.1108 35.37821 509.4178 58.43628 39.69302       68.31117 
1 1 1 -13 19 3  o 344.9112 46.14168 24.38138       6.025671      28.80176       7.243558      14.44980       10.85753  373.1419 51.34640 258.0713 89.13349 115.0706       102.8651 
1 1 1 -13 19 4  o 951.5901 40.80456 181.5435       15.07949      0.000000       0.000000      181.5435       15.07949  ?        ?        951.5901 40.80456 0.000000       40.80456 
1 1 1 -13 19 5  o 118.8080 56.66490 -8.372153      7.267181      -23.67111      9.598717      12.17455       11.12381  109.6847 54.78906 242.5792 89.48438 -132.8945      104.9252 
1 1 1 -13 19 6  o 286.0479 68.07266 18.10476       7.452629      24.67772       9.515211      7.673355       11.98696  330.8643 75.69362 220.4928 89.54652 110.3715       117.2523 
1 1 1 -13 19 7  o 337.8721 67.02190 25.15549       8.483702      35.46994       11.97694      14.76898       12.01870  392.8218 81.19310 256.4461 93.25408 136.3758       123.6473 
1 1 1 -13 19 8  o 409.2955 40.47453 34.18733       6.349187      46.16467       9.550684      24.70206       8.499223  468.2652 53.47794 332.8322 68.05076 135.4330       86.54939 
1 1 1 -13 19 9  o 202.8899 66.69102 8.967331       6.079738      8.423520       9.153500      9.396626       8.132813  207.8182 80.15044 210.8530 76.70573 -3.034790      110.9408 
1 1 1 -13 19 10 f 506.2475 34.63110 51.84074       6.767703      53.68361       10.10051      50.33934       9.116852  502.5635 52.52786 489.5484 48.59576 13.01511       71.55924 
1 1 1 -13 19 11 o 379.7272 44.97198 30.28543       6.503109      32.03397       9.775495      28.89727       8.710016  371.9629 70.24707 356.8052 65.26289 15.15765       95.88481 
1 1 1 -13 19 12 o 332.6208 54.45891 24.34620       6.791194      29.37490       10.28829      20.46321       9.040621  345.4048 78.48196 286.1866 78.83047 59.21826       111.2370 
1 1 1 -13 19 13 o 300.3298 59.22491 20.62459       6.662190      20.90473       10.05765      20.40557       8.892995  279.6188 85.04692 282.5855 78.32115 -2.966705      115.6165 
1 1 1 -13 19 14 o 215.1424 69.33070 11.45759       6.586926      4.250604       9.562108      17.96576       9.086702  175.4488 76.02483 258.0996 81.24532 -82.65085      111.2680 
1 1 1 -13 19 15 o 225.8485 76.39179 13.72559       7.967056      22.29859       10.10455      -0.3617289     12.95282  277.8404 85.38541 170.9689 79.69624 106.8715       116.7997 
1 1 1 -13 19 16 f 120.7866 56.91475 -3.876374      6.914596      12.25283       9.686394      -20.63549      9.873729  207.2566 81.71605 108.6171 54.44837 98.63959       98.19439 
1 1 1 -13 19 17 o 91.34506 46.05861 -19.26095      7.625180      -13.17012      9.453088      -30.60528      12.90104  115.7564 57.22855 114.0600 57.78977 1.696457       81.33120 
1 1 1 -13 19 18 o 265.1617 66.88672 19.41128       6.887076      22.03643       9.297680      16.21981       10.25164  257.1938 82.31692 212.2405 83.94392 44.95332       117.5698 
1 1 1 -13 19 19 o 126.2561 58.99049 -0.5076609     7.162271      8.676159       8.263886      -28.23047      14.35791  169.0228 71.90893 117.4143 59.64267 51.60849       93.42453 
1 1 1 -13 19 20 o 147.5527 66.86891 5.291270       8.265211      0.4207910      10.16025      14.82018       14.21151  137.1543 65.83950 174.8174 82.13056 -37.66307      105.2629 
1 1 1 -13 19 21 o 126.0564 63.51955 -10.89638      14.37257      0.000000       0.000000      -10.89638      14.37257  ?        ?        126.0564 63.51955 0.000000       63.51955 
1 1 1 -13 20 1  o 312.8734 59.62781 20.94460       6.980612      20.94460       6.980612      0.000000       0.000000  312.8734 59.62781 ?        ?        0.000000       59.62781 
1 1 1 -13 20 2  o 327.8876 46.78802 22.22105       5.788854      30.08293       6.974295      4.808069       10.37944  381.7317 48.11387 198.8040 82.30526 182.9277       95.33678 
1 1 1 -13 20 3  o 554.5663 29.97018 61.07753       6.430659      61.70908       7.681197      59.59761       11.75828  554.8032 35.84183 532.1393 57.82799 22.66388       68.03465 
1 1 1 -13 20 4  o 148.9051 64.87093 0.4803558E-01  7.038069      -2.640043      9.255547      3.733333       10.83721  157.2078 71.04640 195.1370 82.65421 -37.92920      108.9922 
1 1 1 -13 20 5  o 284.0978 58.47194 17.49159       6.236165      8.066443       7.456721      39.42322       11.37468  201.0851 73.40307 420.4352 72.26953 -219.3500      103.0092 
1 1 1 -13 20 6  o 373.6685 45.32891 28.92444       6.443295      33.47829       7.754059      18.76516       11.58167  399.0643 51.21508 277.9805 92.07973 121.0838       105.3644 
1 1 1 -13 20 7  o 522.0267 32.81240 54.72798       6.618255      57.41399       7.965607      48.74052       11.89284  531.2299 38.88086 468.8825 67.23647 62.34738       77.66895 
1 1 1 -13 20 8  o 447.4639 35.15387 40.57785       6.059668      38.70567       8.983732      42.14070       8.208035  423.9030 55.93734 448.2704 47.88998 -24.36746      73.63719 
1 1 1 -13 20 9  o 186.9162 66.08377 7.412542       5.988537      19.23708       9.294156      -0.9815315     7.830768  279.7761 80.93424 147.8812 66.21179 131.8949       104.5675 
1 1 1 -13 20 10 o 398.9662 42.83423 33.29302       6.532864      45.94321       9.893577      23.51324       8.699003  457.6102 56.89957 313.9889 72.76215 143.6213       92.36824 
1 1 1 -13 20 11 o 148.0716 62.15449 2.424813       6.039563      5.737038       8.964054      -0.3286837     8.173101  184.3079 76.41091 150.8558 67.58651 33.45209       102.0126 
1 1 1 -13 20 12 o 324.0253 53.35406 23.37993       6.480159      42.52524       9.794137      8.473220       8.642231  431.9157 60.01166 196.0432 77.22073 235.8725       97.79796 
1 1 1 -13 20 13 o 202.6426 68.41766 10.06618       6.390473      19.53906       9.695616      2.789926       8.497440  265.0550 83.97855 162.7244 71.07473 102.3305       110.0182 
1 1 1 -13 20 14 o 307.0965 57.80102 22.16302       6.640515      20.89375       9.555003      23.34879       9.235364  270.3983 83.01991 291.8175 79.38438 -21.41925      114.8659 
1 1 1 -13 20 15 o 148.9601 63.32479 3.373655       6.399683      8.371737       9.004592      -1.727710      9.097154  185.1044 76.64935 143.5243 66.86506 41.58009       101.7156 
1 1 1 -13 20 16 o 136.9677 62.41058 0.3221647      7.324432      4.715789       8.875134      -9.060781      12.96979  162.7415 71.80821 143.0992 69.99610 19.64230       100.2790 
1 1 1 -13 20 17 o 166.5565 72.16016 6.849854       8.611897      6.849854       8.611897      0.000000       0.000000  166.5565 72.16016 ?        ?        0.000000       72.16016 
1 1 1 -13 20 18 o 144.0599 64.56895 3.588444       7.467917      -0.6380359     8.691177      15.51299       14.59856  133.9189 63.31775 187.3951 86.39623 -53.47627      107.1142 
1 1 1 -13 20 19 o 120.3690 56.91412 -1.100833      7.023700      -6.150970      8.086733      14.40915       14.17187  112.9393 55.24928 175.2583 82.23454 -62.31905      99.07069 
1 1 1 -13 20 20 o 142.1237 70.25662 0.9363337      14.23370      0.000000       0.000000      0.9363337      14.23370  ?        ?        142.1237 70.25662 0.000000       70.25662 
1 1 1 -13 21 1  o 157.5577 62.40530 3.549857       5.673276      6.050666       6.628839      -3.297283      10.96862  182.3851 68.71952 167.9151 76.45868 14.46999       102.8023 
1 1 1 -13 21 2  o 208.8735 64.34203 9.525292       5.733869      8.094297       6.709047      13.40258       11.04347  198.2004 69.95995 245.0981 89.35046 -46.89771      113.4808 
1 1 1 -13 21 3  o 267.0118 70.20779 16.21071       7.376849      17.62308       9.538196      14.10843       11.63693  272.8272 82.78597 249.1015 91.58123 23.72574       123.4530 
1 1 1 -13 21 4  o 493.8314 40.66786 49.82574       7.729998      54.29213       10.17171      43.72017       11.89266  507.6246 52.34805 440.3087 72.04157 67.31592       89.05227 
1 1 1 -13 21 5  o 190.2713 67.04804 7.557237       6.159670      3.010068       7.252208      19.33139       11.66983  164.5625 68.51822 278.0072 92.44589 -113.4447      115.0695 
1 1 1 -13 21 6  o 201.0274 67.88727 8.877357       6.291792      7.793894       7.489194      11.47657       11.59977  195.7482 73.18188 229.7553 89.77329 -34.00710      115.8224 
1 1 1 -13 21 7  f 411.8294 41.18343 35.10448       6.498393      33.37747       7.976599      38.51291       11.20591  393.3593 53.61200 406.1834 73.75553 -12.82410      91.18182 
1 1 1 -13 21 8  o 382.0320 44.33109 30.68256       6.454867      31.46408       7.850899      29.05209       11.33975  379.6181 54.84318 337.7459 86.17317 41.87213       102.1449 
1 1 1 -13 21 9  o 143.6537 60.54347 2.013847       5.768046      7.269564       8.406422      -2.661847      7.928997  191.2936 75.90201 139.9961 64.22095 51.29750       99.42558 
1 1 1 -13 21 10 o 329.1425 50.07497 23.67066       6.198948      32.61813       9.237213      16.33952       8.361352  373.0733 66.17911 253.1131 77.65282 119.9602       102.0276 
1 1 1 -13 21 11 o 182.7694 67.13337 7.521439       6.251174      19.49417       9.077883      -3.275980      8.620808  270.8084 80.44884 140.8261 65.43517 129.9823       103.7004 
1 1 1 -13 21 12 o 392.3682 44.75446 33.35750       6.697569      25.49349       9.365750      41.58804       9.581521  310.6989 77.79494 422.1093 60.15108 -111.4103      98.33720 
1 1 1 -13 21 13 o 407.8557 43.59671 36.21780       6.798421      33.69672       9.717668      38.63452       9.514394  362.7334 71.52563 399.0133 63.52977 -36.27994      95.66581 
1 1 1 -13 21 14 o 122.6505 56.83402 -2.032274      6.436764      5.880830       8.937975      -10.55785      9.277429  171.3969 73.88557 121.0240 59.19852 50.37298       94.67598 
1 1 1 -13 21 15 o 261.4115 73.42651 19.56174       7.761774      18.32996       9.106858      22.83233       14.83935  239.2102 81.66993 231.6873 97.34872 7.522858       127.0699 
1 1 1 -13 21 16 o 152.4902 68.45828 3.868726       8.430788      3.868726       8.430788      0.000000       0.000000  152.4902 68.45828 ?        ?        0.000000       68.45828 
1 1 1 -13 21 17 o 168.0744 69.61026 8.380667       7.428626      14.36130       8.574640      -9.614900      14.87391  200.4992 77.50536 139.7184 69.53565 60.78084       104.1263 
1 1 1 -13 21 18 o 154.2376 70.75214 6.288151       9.622876      13.39883       12.43067      -4.345365      15.20119  175.9592 80.60513 142.5849 70.85257 33.37437       107.3186 
1 1 1 -13 21 19 o 152.0861 72.35063 6.893302       11.68991      6.893302       11.68991      0.000000       0.000000  152.0861 72.35063 ?        ?        0.000000       72.35063 
1 1 1 -13 22 1  o 265.0016 60.53688 15.59303       6.093646      25.77807       7.725951      -1.172617      9.912446  342.9601 60.20311 165.2305 74.20051 177.7297       95.55170 
1 1 1 -13 22 2  o 719.7661 26.30897 102.7164       7.353993      106.7621       9.240724      95.72820       12.14477  729.7785 32.60521 679.0168 46.33211 50.76172       56.65478 
1 1 1 -13 22 3  o 229.7542 71.40907 12.19353       7.044756      25.64772       9.466115      -4.508153      10.54686  329.9512 75.50780 157.5309 72.90997 172.4203       104.9633 
1 1 1 -13 22 4  o 652.0585 32.91661 85.72165       8.308525      77.22758       10.97353      97.13232       12.71875  607.4605 46.87838 679.9023 48.48706 -72.44183      67.44314 
1 1 1 -13 22 5  o 177.8105 66.56986 6.269213       6.201316      2.768304       7.376390      14.70755       11.45202  161.9408 68.36983 243.9922 90.63762 -82.05145      113.5324 
1 1 1 -13 22 6  o 227.4660 66.50374 12.09521       6.245677      13.00865       7.576758      10.15855       11.03236  232.5600 74.29636 216.5142 86.61308 16.04579       114.1130 
1 1 1 -13 22 7  o 601.7505 33.32732 73.63131       7.757952      90.34283       9.761570      44.97810       12.78198  662.1947 38.11921 426.9402 80.03133 235.2545       88.64586 
1 1 1 -13 22 8  o 136.1493 60.35851 -0.7837909E-01 6.343137      -1.032750      7.483390      2.357249       11.95488  141.6655 63.96575 182.5707 81.77201 -40.90521      103.8185 
1 1 1 -13 22 9  o 256.0713 74.08498 16.64980       7.787252      11.50327       9.958266      24.75066       12.49373  214.8548 83.39312 288.7146 95.63678 -73.85980      126.8890 
1 1 1 -13 22 10 o 169.8829 73.02245 4.176442       8.681340      0.000000       0.000000      4.176442       8.681340  ?        ?        169.8829 73.02245 0.000000       73.02245 
1 1 1 -13 22 11 o 214.7867 67.84134 11.73870       6.331211      16.33048       8.805361      6.823944       9.109766  241.3319 80.30497 181.8021 76.32520 59.52980       110.7900 
1 1 1 -13 22 12 o 169.0234 69.02267 6.086149       7.171394      8.745969       8.683721      0.3812929      12.71751  187.6926 76.21950 167.8650 78.48894 19.82759       109.4072 
1 1 1 -13 22 13 o 186.5503 85.21004 7.816750       13.75838      0.000000       0.000000      7.816750       13.75838  ?        ?        186.5503 85.21004 0.000000       85.21004 
1 1 1 -13 22 14 o 224.9457 74.87834 15.27724       7.655279      22.91130       9.129735      -2.799660      14.04890  270.4770 80.75306 156.5945 75.73106 113.8825       110.7079 
1 1 1 -13 22 15 o 169.0339 73.25259 7.677857       8.879255      7.677857       8.879255      0.000000       0.000000  169.0339 73.25259 ?        ?        0.000000       73.25259 
1 1 1 -13 22 16 o 105.2724 52.38469 -12.27625      8.428710      -12.27625      8.428710      0.000000       0.000000  105.2724 52.38469 ?        ?        0.000000       52.38469 
1 1 1 -13 22 17 o 168.4939 73.86787 9.900213       9.254164      18.50443       12.30789      -1.290684      14.03655  194.0578 85.12878 144.9418 71.28724 49.11597       111.0350 
1 1 1 -13 23 1  o 130.4772 57.61790 -0.3929172     5.725226      3.325040       7.224248      -6.671037      9.387614  164.0065 68.34470 140.5396 66.25092 23.46687       95.18499 
1 1 1 -13 23 2  o 318.4201 52.60486 22.05369       6.277942      18.88531       7.842754      27.70507       10.47434  281.7475 71.54475 334.3388 81.42657 -52.59137      108.3925 
1 1 1 -13 23 3  o 130.3684 61.18577 -5.352578      7.853374      5.552041       11.85221      -13.88752      10.48562  197.8065 85.17679 130.9615 63.81415 66.84499       106.4299 
1 1 1 -13 23 4  o 108.8412 52.22453 -7.276886      6.376712      -0.1204488     7.830008      -21.37116      10.98842  149.5296 66.63184 120.9247 60.11462 28.60494       89.74168 
1 1 1 -13 23 5  o 240.8952 68.66680 13.98198       6.736579      12.56163       8.120127      17.11784       12.06546  225.4932 77.11800 250.5630 93.04242 -25.06975      120.8473 
1 1 1 -13 23 6  o 135.4396 61.12323 -1.071109      6.822906      -0.8509818     8.278152      -1.537412      12.04844  148.2125 67.06671 169.7439 78.33880 -21.53140      103.1257 
1 1 1 -13 23 7  f 239.8806 70.88836 14.39638       7.062808      18.22650       8.526690      6.024383       12.60633  264.1947 77.83686 194.9303 85.81733 69.26439       115.8585 
1 1 1 -13 23 8  o 179.8936 68.58545 7.224009       6.651984      5.006786       7.906534      12.59564       12.30650  170.4329 71.30121 217.9781 89.87668 -47.54524      114.7244 
1 1 1 -13 23 9  o 160.4506 66.76532 4.408855       6.879891      7.014721       8.107809      -2.293241      13.00268  180.3382 73.48816 165.9957 78.16553 14.34244       107.2864 
1 1 1 -13 23 10 o 255.0504 68.98268 16.92875       6.997500      13.91556       8.306491      24.29371       12.98643  222.4394 77.89757 265.1912 96.85918 -42.75180      124.2970 
1 1 1 -13 23 11 o 106.5458 52.05696 -9.146564      7.112956      -6.223781      8.351394      -16.86787      13.57394  124.3259 59.68410 135.8371 67.40602 -11.51115      90.03201 
1 1 1 -13 23 12 o 220.0757 72.82195 13.99991       7.244519      12.81046       8.545246      17.03939       13.66007  205.3718 77.86970 213.9757 91.77633 -8.603958      120.3602 
1 1 1 -13 23 13 o 252.3583 72.59148 18.66597       7.495826      24.36545       8.896345      4.716788       13.91773  281.8275 78.41611 170.4363 80.44286 111.3912       112.3394 
1 1 1 -13 23 14 o 215.4296 74.06312 14.83033       7.492218      21.72927       8.952032      -1.301777      13.68914  253.5671 80.73188 152.4945 73.98760 101.0726       109.5071 
1 1 1 -13 23 15 o 223.1669 91.32977 23.90865       12.58985      23.90865       12.58985      0.000000       0.000000  223.1669 91.32977 ?        ?        0.000000       91.32977 
1 1 1 -13 23 16 f 89.07448 44.40079 -10.74845      6.164119      -11.35312      8.436750      -10.05606      9.028016  105.2870 52.39486 111.2314 55.15796 -5.944344      76.07642 
1 1 1 -13 24 1  f 177.1712 62.55001 6.852251       5.363376      4.563531       6.414156      12.17214       9.779005  163.8832 65.87077 222.0829 83.50703 -58.19972      106.3597 
1 1 1 -13 24 2  o 149.4745 64.59068 1.715222       6.863881      -6.019053      8.956195      12.72361       10.68503  136.1478 64.34220 224.5932 86.60310 -88.44543      107.8889 
1 1 1 -13 24 3  o 165.2236 67.75613 4.495120       6.947204      -1.672444      8.965349      13.76430       10.99084  149.7421 68.54337 228.9308 87.95065 -79.18874      111.5056 
1 1 1 -13 24 4  o 190.6999 65.91781 8.513628       5.938778      6.860518       6.913866      13.16584       11.59845  179.6476 69.55367 223.8504 89.04940 -44.20282      112.9934 
1 1 1 -13 24 5  o 190.9061 68.96854 8.630424       6.558377      2.903314       7.823922      22.16430       12.02729  159.5780 68.95830 270.8647 93.79741 -111.2867      116.4182 
1 1 1 -13 24 6  o 266.9379 64.58083 17.43418       6.622146      24.71295       7.979267      1.326177       11.87012  317.3489 66.85422 172.3763 78.89138 144.9726       103.4086 
1 1 1 -13 24 7  o 212.4742 68.44305 11.56236       6.419832      8.657794       7.714597      18.10357       11.57717  188.8881 73.37600 241.1727 90.82652 -52.28467      116.7626 
1 1 1 -13 24 8  o 234.5379 91.58875 17.94805       12.06829      0.000000       0.000000      17.94805       12.06829  ?        ?        234.5379 91.58875 0.000000       91.58875 
1 1 1 -13 24 9  o 108.1830 52.13126 -6.481718      6.513167      -14.13480      7.821082      10.83503       11.76473  102.3160 50.83886 197.5064 84.95464 -95.19038      99.00446 
1 1 1 -13 24 10 o 254.0418 69.00950 17.53442       6.985003      17.95928       8.255148      16.46354       13.10600  245.7235 77.45077 214.7744 90.92937 30.94910       119.4436 
1 1 1 -13 24 11 o 166.9066 68.29604 6.866654       7.039001      5.559926       8.330094      10.12954       13.16309  162.6652 70.72187 186.7104 84.52132 -24.04521      110.2063 
1 1 1 -13 24 12 o 261.6529 64.19609 18.51204       6.474154      21.80461       8.624876      14.26226       9.798717  262.3787 78.52335 202.4961 81.40682 59.88260       113.1061 
1 1 1 -13 24 13 o 453.9046 39.18384 45.98544       6.839453      53.66563       9.665454      38.28297       9.679457  463.6251 54.73759 366.0327 70.65213 97.59235       89.37520 
1 1 1 -13 24 14 o 173.7321 72.89227 9.769773       8.300404      1.202521       11.60614      18.73944       11.87559  148.0649 70.88885 204.2739 86.52383 -56.20900      111.8553 
1 1 1 -13 25 1  o 193.6969 62.44328 8.928487       5.342838      3.309697       6.147761      26.27010       10.80041  151.3919 63.06425 306.0432 86.84441 -154.6514      107.3268 
1 1 1 -13 25 2  o 230.3452 70.19086 13.49361       6.846144      16.06578       8.713202      9.343662       11.06749  242.9260 79.83817 201.0142 84.24567 41.91177       116.0667 
1 1 1 -13 25 3  o 96.06785 46.74201 -7.803392      5.567149      -13.18877      6.460266      7.734822       10.97344  92.83817 46.14238 192.2142 82.34497 -99.37599      94.39181 
1 1 1 -13 25 4  o 214.9874 65.44665 11.60963       5.954087      5.033053       6.755160      34.50977       12.60535  163.2539 66.86504 337.5195 93.13002 -174.2656      114.6479 
1 1 1 -13 25 5  o 244.0575 62.48795 14.75890       5.948160      12.97163       6.806574      20.53437       12.23565  221.8690 70.37028 249.5261 93.49065 -27.65704      117.0149 
1 1 1 -13 25 6  o 190.4882 65.36066 9.199176       5.833594      9.388506       6.711210      8.613950       11.79921  190.8954 69.64416 191.1773 83.62071 -0.2818909     108.8243 
1 1 1 -13 25 7  o 158.8123 64.09324 5.314744       6.099582      -1.020754      7.035297      24.49310       12.24046  131.3035 60.32924 263.6383 94.34225 -132.3348      111.9825 
1 1 1 -13 25 8  o 201.9351 67.57861 11.04783       6.234149      14.81854       7.188864      -0.3876055     12.51917  228.8001 72.29294 160.2357 75.83168 68.56445       104.7698 
1 1 1 -13 25 9  o 137.8975 60.69260 2.105490       6.301667      7.413002       7.311819      -13.22111      12.42518  171.4334 69.81538 132.3751 65.47533 39.05824       95.71419 
1 1 1 -13 25 10 o 234.6093 68.05053 15.50438       6.562761      15.86955       7.518803      14.33609       13.44842  228.7977 74.10854 197.8306 87.78609 30.96706       114.8846 
1 1 1 -13 25 11 o 84.27148 42.46783 -15.91625      6.432025      -20.73381      7.489841      -2.382594      12.55355  86.59837 43.89289 148.3864 71.71946 -61.78806      84.08488 
1 1 1 -13 26 1  o 136.1475 57.71677 2.161542       5.291485      -0.3095604     6.092726      9.746964       10.67471  129.1690 58.07583 198.3625 82.90498 -69.19356      101.2227 
1 1 1 -13 26 2  o 167.5545 66.87110 5.982708       6.560087      13.03936       8.327188      -5.560895      10.65049  216.9121 77.79339 143.7464 68.57006 73.16577       103.6999 
1 1 1 -13 26 3  o 217.4021 62.93213 11.90467       5.617738      14.42574       6.505635      4.513361       11.13931  235.5466 67.58978 175.1864 78.66587 60.36014       103.7145 
1 1 1 -13 26 4  o 147.8985 60.77475 3.912518       5.603492      -0.7442798     6.396492      19.27818       11.61913  128.0889 58.34877 240.1057 90.85855 -112.0168      107.9808 
1 1 1 -13 26 5  o 214.2526 63.66071 11.86995       5.684017      13.49297       6.517954      6.716828       11.61408  224.0001 68.53387 180.7939 80.81387 43.20619       105.9612 
1 1 1 -13 26 6  o 138.9213 59.62450 2.616520       5.772450      9.014836       6.615799      -17.78999      11.81500  184.5674 68.82553 123.6958 61.62867 60.87164       92.38531 
1 1 1 -13 26 7  f 227.1926 65.15834 13.82114       6.047430      10.14380       6.985058      24.82681       12.08403  190.7023 70.79768 257.9908 93.55431 -67.28853      117.3231 
1 1 1 -12 0  1  o 609.1703 24.56325 72.68304       5.789554      72.68304       5.789554      72.68304       5.789554  609.1703 24.56325 609.1703 24.56325 -0.000000      0.000000 
1 1 1 -12 0  2  o 98.49077 65.30273 -1.450192      6.593914      -1.450192      6.593914      -1.450192      6.593914  98.49077 65.30273 98.49077 65.30273 0.000000       0.000000 
1 1 1 -12 0  3  o 180.5343 86.86044 9.705464       7.048597      9.705464       7.048597      9.705464       7.048597  180.5343 86.86044 180.5343 86.86044 0.000000       0.000000 
1 1 1 -12 0  4  o 103.9813 69.17112 -1.851137      7.498641      -1.851137      7.498641      -1.851137      7.498641  103.9813 69.17112 103.9813 69.17112 0.000000       0.000000 
1 1 1 -12 0  5  o 283.3226 85.04944 19.80065       8.154652      19.80065       8.154652      19.80065       8.154652  283.3226 85.04944 283.3226 85.04944 -0.000000      0.000000 
1 1 1 -12 0  6  o 197.3317 76.32408 10.56447       5.555888      10.56447       5.555888      10.56447       5.555888  197.3317 76.32408 197.3317 76.32408 -0.000000      0.000000 
1 1 1 -12 0  7  o 380.7074 41.45053 29.39841       5.944193      29.39841       5.944193      29.39841       5.944193  380.7074 41.45053 380.7074 41.45053 -0.000000      0.000000 
1 1 1 -12 0  8  o 317.1206 55.19736 21.49371       6.180908      21.49371       6.180908      21.49371       6.180908  317.1206 55.19736 317.1206 55.19736 -0.000000      0.000000 
1 1 1 -12 0  9  o 181.1020 82.90651 9.543955       6.360878      9.543955       6.360878      9.543955       6.360878  181.1020 82.90651 181.1020 82.90651 -0.000000      0.000000 
1 1 1 -12 0  10 o 936.0659 25.98381 171.1147       9.429305      171.1147       9.429305      171.1147       9.429305  936.0659 25.98381 936.0659 25.98381 -0.000000      0.000000 
1 1 1 -12 0  11 o 462.4674 42.06065 42.88641       7.410465      42.88641       7.410465      42.88641       7.410465  462.4674 42.06065 462.4674 42.06065 -0.000000      0.000000 
1 1 1 -12 0  12 o 70.86784 50.92260 -11.30608      6.768840      -11.30608      6.768840      -11.30608      6.768840  70.86784 50.92260 70.86784 50.92260 0.000000       0.000000 
1 1 1 -12 0  13 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -12 0  14 o 956.6801 27.95435 178.7188       10.36584      178.7188       10.36584      178.7188       10.36584  956.6801 27.95435 956.6801 27.95435 0.000000       0.000000 
1 1 1 -12 0  15 o 1218.488 27.12959 289.5215       12.82348      289.5215       12.82348      289.5215       12.82348  1218.488 27.12959 1218.488 27.12959 0.000000       0.000000 
1 1 1 -12 0  16 o 1052.665 30.16213 216.4271       12.30759      216.4271       12.30759      216.4271       12.30759  1052.665 30.16213 1052.665 30.16213 -0.000000      0.000000 
1 1 1 -12 0  17 o 181.3298 95.56274 9.613969       8.955399      9.613969       8.955399      9.613969       8.955399  181.3298 95.56274 181.3298 95.56274 -0.000000      0.000000 
1 1 1 -12 0  18 o 265.6744 99.77980 18.98520       9.619488      18.98520       9.619488      18.98520       9.619488  265.6744 99.77980 265.6744 99.77980 0.000000       0.000000 
1 1 1 -12 0  19 o 945.1048 31.85375 174.8801       11.66136      174.8801       11.66136      174.8801       11.66136  945.1048 31.85375 945.1048 31.85375 -0.000000      0.000000 
1 1 1 -12 0  20 o 130.5414 82.91075 1.526385       9.155820      1.526385       9.155820      1.526385       9.155820  130.5414 82.91075 130.5414 82.91075 -0.000000      0.000000 
1 1 1 -12 0  21 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -12 0  22 o 158.8572 103.8029 -0.5733814E-01 15.74907      -0.5733814E-01 15.74907      -0.5733814E-01 15.74907  158.8572 103.8029 158.8572 103.8029 -0.000000      0.000000 
1 1 1 -12 0  23 f 450.5156 110.8886 48.47647       16.79869      48.47647       16.79869      48.47647       16.79869  450.5156 110.8886 450.5156 110.8886 0.000000       0.000000 
1 1 1 -12 0  24 o 139.3547 89.01488 1.873477       10.74007      1.873477       10.74007      1.873477       10.74007  139.3547 89.01488 139.3547 89.01488 0.000000       0.000000 
1 1 1 -12 0  25 f 232.4547 108.2708 16.89928       10.86787      16.89928       10.86787      16.89928       10.86787  232.4547 108.2708 232.4547 108.2708 -0.000000      0.000000 
1 1 1 -12 0  26 f 411.8403 114.9460 43.85203       15.90635      43.85203       15.90635      43.85203       15.90635  411.8403 114.9460 411.8403 114.9460 0.000000       0.000000 
1 1 1 -12 0  27 o 131.6699 90.03118 -5.214672      14.50118      -5.214672      14.50118      -5.214672      14.50118  131.6699 90.03118 131.6699 90.03118 -0.000000      0.000000 
1 1 1 -12 0  28 o 115.8805 78.97917 -3.665584      10.96039      -3.665584      10.96039      -3.665584      10.96039  115.8805 78.97917 115.8805 78.97917 0.000000       0.000000 
1 1 1 -12 0  29 f 238.1052 107.7866 19.41222       10.73878      19.41222       10.73878      19.41222       10.73878  238.1052 107.7866 238.1052 107.7866 -0.000000      0.000000 
1 1 1 -12 0  30 o 92.78956 65.80139 -9.568172      9.947109      -9.568172      9.947109      -9.568172      9.947109  92.78956 65.80139 92.78956 65.80139 0.000000       0.000000 
1 1 1 -12 0  31 f 91.38377 64.61008 -7.948706      9.349521      -7.948706      9.349521      -7.948706      9.349521  91.38377 64.61008 91.38377 64.61008 0.000000       0.000000 
1 1 1 -12 1  1  o 246.6353 40.49972 12.41676       3.744452      10.97203       4.483319      15.74883       6.808691  228.5631 51.71641 270.4684 65.51443 -41.90532      83.46693 
1 1 1 -12 1  2  o 212.7795 49.25130 9.492784       3.989353      9.599664       4.765365      9.242408       7.293620  212.8496 56.65059 213.6647 73.08790 -0.8151703     92.47232 
1 1 1 -12 1  3  o 136.2952 52.76466 2.612221       3.978680      4.764334       4.737551      -2.538237      7.328994  162.6691 58.64082 141.5316 63.65923 21.13754       86.55197 
1 1 1 -12 1  4  o 606.9516 27.66469 72.51627       6.520905      67.61800       8.827988      78.39819       9.673854  580.8555 39.36748 625.2963 40.04737 -44.44080      56.15683 
1 1 1 -12 1  5  o 380.1221 32.68999 28.80338       4.778814      31.85765       8.578944      27.42928       5.754240  389.5380 58.51836 368.1849 40.93641 21.35315       71.41560 
1 1 1 -12 1  6  o 421.7460 29.73948 35.26873       4.839727      29.18505       8.649592      38.04146       5.839380  370.5971 62.30982 436.4801 34.73627 -65.88297      71.33808 
1 1 1 -12 1  7  o 401.3016 27.12247 31.83285       4.202146      27.94430       6.043637      35.47213       5.846716  370.9732 42.73058 420.9464 36.11463 -49.97321      55.94791 
1 1 1 -12 1  8  o 753.9554 18.49460 111.0698       5.415250      118.9115       7.771871      103.6701       7.549605  777.8608 25.72739 725.9393 26.77910 51.92157       37.13514 
1 1 1 -12 1  9  f 317.9164 36.69728 20.34228       4.447570      19.01903       6.373313      21.59839       6.209514  300.2457 56.73796 322.6145 51.27752 -22.36880      76.47601 
1 1 1 -12 1  10 o 259.0084 47.85803 13.92516       4.636570      19.31350       6.591063      8.646481       6.523656  302.2177 58.26973 205.9968 69.12899 96.22092       90.41116 
1 1 1 -12 1  11 o 664.8080 22.18773 86.52902       5.728450      84.16396       7.683634      89.48862       8.595317  653.3555 30.28232 672.7886 32.89692 -19.43317      44.71271 
1 1 1 -12 1  12 o 362.5586 36.11204 26.30393       5.016961      28.30836       7.220471      24.43295       6.975955  370.8491 51.52725 343.0813 54.15414 27.76782       74.75111 
1 1 1 -12 1  13 o 765.4739 21.79877 114.6296       6.480229      118.0438       9.348951      111.4723       8.990416  773.8160 31.10980 752.0873 30.78106 21.72870       43.76406 
1 1 1 -12 1  14 o 801.7056 21.87411 125.7124       6.810410      137.0266       9.702539      114.7242       9.561754  834.3748 29.94306 762.6261 32.28479 71.74872       44.03288 
1 1 1 -12 1  15 o 462.3683 35.17317 42.50798       6.268425      47.16923       8.915747      37.95159       8.814898  482.4128 48.23603 429.9320 53.98497 52.48077       72.39538 
1 1 1 -12 1  16 o 572.2516 31.12601 64.71022       6.891315      67.74049       9.686358      61.60442       9.806333  580.9351 43.24408 552.6205 46.11444 28.31464       63.21861 
1 1 1 -12 1  17 o 521.0020 34.31129 53.93903       6.903464      47.30405       9.614910      60.99905       9.918092  480.4758 52.37677 548.8878 46.98095 -68.41202      70.36005 
1 1 1 -12 1  18 o 699.7433 27.81467 96.42882       7.558588      94.66331       10.76627      98.14482       10.61426  686.8311 40.54311 700.1235 39.19543 -13.29248      56.39171 
1 1 1 -12 1  19 o 480.0360 54.04913 48.01179       9.900755      0.000000       0.000000      48.01179       9.900755  ?        ?        480.0360 54.04913 0.000000       54.04913 
1 1 1 -12 1  20 o 433.3151 61.90881 40.42271       10.12184      0.000000       0.000000      40.42271       10.12184  ?        ?        433.3151 61.90881 0.000000       61.90881 
1 1 1 -12 1  21 o 294.8451 62.95898 19.24599       6.989869      15.46325       9.935101      22.95362       9.835980  256.1508 85.30428 311.5578 80.66054 -55.40698      117.4008 
1 1 1 -12 1  22 o 185.0146 80.84787 2.139152       11.00628      -10.75885      14.81459      18.02825       16.44290  171.0319 81.38815 269.2296 106.3664 -98.19763      133.9322 
1 1 1 -12 1  23 o 874.3018 39.63060 156.4870       13.45613      127.3493       17.68624      196.5360       20.73498  761.9185 60.26401 954.1752 56.20431 -192.2567      82.40555 
1 1 1 -12 1  24 o 187.6924 81.39648 4.631744       10.97896      0.000000       0.000000      4.631744       10.97896  ?        ?        187.6924 81.39648 0.000000       81.39648 
1 1 1 -12 1  25 o 121.3900 58.08257 -6.875007      7.765182      -1.840376      11.18470      -11.55990      10.78923  160.2440 74.48281 133.6588 65.04099 26.58514       98.88387 
1 1 1 -12 1  26 o 176.4954 77.98285 5.764980       10.50197      2.481563       14.77622      9.116654       14.92902  178.4920 83.82150 196.2073 89.28678 -17.71533      122.4670 
1 1 1 -12 1  27 o 150.7910 71.09153 -0.1059232     10.81511      -8.609581      15.65391      7.659988       14.95947  151.4031 74.62251 180.5150 84.63318 -29.11197      112.8330 
1 1 1 -12 1  28 o 159.0540 68.71157 6.776282       7.763428      15.73490       11.24511      -1.382211      10.73120  194.9291 83.42902 139.7896 67.24901 55.13951       107.1580 
1 1 1 -12 1  29 o 159.3096 68.20023 8.764840       7.517739      -2.868749      10.65588      20.29338       10.60766  128.2927 62.89874 201.0695 83.22108 -72.77679      104.3168 
1 1 1 -12 1  30 o 175.7668 70.26855 13.61232       7.256438      22.47216       10.44545      5.348180       10.08818  191.5194 81.13557 135.3247 65.12675 56.19470       104.0407 
1 1 1 -12 1  31 o 136.3037 61.28679 7.807576       6.786082      4.946202       9.645155      10.61248       9.549499  125.4109 61.13007 139.3880 66.04176 -13.97708      89.99111 
1 1 1 -12 2  1  o 202.5561 48.48481 8.581885       3.763231      8.781002       4.434955      8.069827       7.112067  204.2128 54.78586 204.1719 72.03459 0.4090881E-01  90.50123 
1 1 1 -12 2  2  o 211.0322 49.24556 9.335838       3.962241      13.81991       4.725546      -1.279816      7.270919  257.8195 48.98734 146.8633 64.88879 110.9562       81.30385 
1 1 1 -12 2  3  o 723.7090 19.94813 102.4002       5.606530      105.1548       6.726027      96.12872       10.14880  732.3657 23.64844 694.1392 37.79020 38.22656       44.57969 
1 1 1 -12 2  4  o 294.1712 33.00721 17.32851       3.705779      20.23950       5.316291      14.57726       5.168364  314.5059 44.79193 263.5709 52.33837 50.93506       68.88847 
1 1 1 -12 2  5  o 633.2380 21.51359 78.51553       5.290636      75.83849       9.298508      79.79705       6.433530  615.3479 39.11339 637.1671 25.99968 -21.81921      46.96638 
1 1 1 -12 2  6  o 307.4951 69.12829 20.61186       8.054439      20.61186       8.054439      0.000000       0.000000  307.4951 69.12829 ?        ?        0.000000       69.12829 
1 1 1 -12 2  7  o 101.6653 46.33370 -2.288822      4.039417      -8.003747      5.912832      2.712587       5.531419  104.3325 50.12160 152.1974 61.17159 -47.86491      79.08311 
1 1 1 -12 2  8  o 497.0740 23.69892 48.46390       4.574857      52.05532       6.631708      45.20293       6.319246  511.5602 33.56728 476.2695 34.39661 35.29068       48.06131 
1 1 1 -12 2  9  o 657.9260 20.83128 84.69532       5.322565      75.81553       7.436025      94.02460       7.621903  619.6667 30.89973 690.9671 28.40391 -71.30042      41.97113 
1 1 1 -12 2  10 o 617.5690 22.74713 74.71304       5.455569      77.59224       7.668611      71.76258       7.762932  626.0356 31.64470 601.3486 33.37186 24.68695       45.98987 
1 1 1 -12 2  11 o 479.9477 27.68831 45.44015       5.138904      41.03044       7.394166      49.56014       7.147143  451.0907 42.71716 498.2417 37.20565 -47.15100      56.64818 
1 1 1 -12 2  12 o 641.9351 23.32784 80.71358       5.815588      75.99781       8.050513      85.86020       8.410241  619.1720 33.60578 659.2938 32.84743 -40.12183      46.99258 
1 1 1 -12 2  13 o 406.2455 36.48899 32.95469       5.695366      31.20036       8.077538      34.68913       8.031588  388.5032 55.07968 411.5249 51.37384 -23.02176      75.31960 
1 1 1 -12 2  14 o 1030.361 19.54367 207.3323       7.820302      229.3546       11.58801      188.9143       10.59741  1080.628 27.61244 980.6558 27.82628 99.97241       39.20139 
1 1 1 -12 2  15 o 669.3057 25.57464 87.83109       6.647556      74.57091       9.472752      100.6973       9.330980  611.2131 40.13053 714.1466 33.64433 -102.9335      52.36793 
1 1 1 -12 2  16 o 399.7143 44.17567 32.29800       6.742808      42.87678       9.649874      22.20519       9.425622  456.3829 55.59456 318.2399 77.08167 138.1430       95.03861 
1 1 1 -12 2  17 o 401.9983 44.05650 32.72458       6.765330      32.61295       9.646898      32.83262       9.490268  391.9480 65.70219 394.0025 64.23642 -2.054474      91.88631 
1 1 1 -12 2  18 o 708.8152 27.48356 98.93038       7.565437      99.46499       10.84523      98.42364       10.55881  704.3652 39.81025 701.1354 38.93111 3.229736       55.68201 
1 1 1 -12 2  19 o 856.0894 24.03076 144.0851       7.989408      147.4525       11.28711      140.7038       11.31039  860.8879 33.76044 840.4149 34.65419 20.47296       48.38057 
1 1 1 -12 2  20 o 341.0274 53.36902 24.60910       6.836395      28.61398       9.648465      20.57141       9.687901  357.1306 72.05213 296.5246 81.57309 60.60602       108.8379 
1 1 1 -12 2  21 f 135.6635 61.61150 -2.611445      7.063179      -4.824922      9.770417      -0.1883398     10.22261  152.2306 70.35751 172.2693 76.48568 -20.03873      103.9242 
1 1 1 -12 2  22 o 476.5273 64.45166 50.16787       11.62147      49.66716       15.56512      50.79862       17.46974  446.8168 92.73712 438.7538 104.0956 8.062988       139.4133 
1 1 1 -12 2  23 o 926.8751 31.72854 172.6792       11.42087      205.2296       19.20458      154.8683       14.20593  984.3837 50.40475 866.5179 42.21473 117.8658       65.74741 
1 1 1 -12 2  24 o 559.3743 37.67978 64.63627       8.137708      71.60307       11.23772      56.95517       11.79975  575.1344 50.83655 500.4570 62.04285 74.67740       80.21016 
1 1 1 -12 2  25 o 433.2476 68.47747 45.80751       11.13867      0.000000       0.000000      45.80751       11.13867  ?        ?        433.2476 68.47747 0.000000       68.47747 
1 1 1 -12 2  26 o 155.6255 72.28950 -0.1413098     10.50846      -25.47445      15.67090      20.55783       14.16530  135.8011 68.14692 236.3689 96.82063 -100.5678      118.3986 
1 1 1 -12 2  27 o 132.5872 64.59600 -7.477361      10.73190      -10.45213      15.30190      -4.597626      15.05549  147.0576 72.72376 155.3546 75.86821 -8.297073      105.0939 
1 1 1 -12 2  28 o 158.7582 68.39156 6.830196       7.647827      10.66879       10.92373      3.139840       10.71074  174.8766 78.25723 150.7327 70.96754 24.14391       105.6437 
1 1 1 -12 2  29 o 151.4942 66.11565 7.284389       7.339680      0.2981505      10.47236      14.02918       10.28980  133.8029 64.87154 174.5123 77.14460 -40.70940      100.7949 
1 1 1 -12 2  30 o 171.7572 69.22012 12.86653       7.103596      17.76771       10.09951      8.067861       9.993334  173.4082 76.55370 141.7050 67.26094 31.70317       101.9044 
1 1 1 -12 2  31 o 107.3321 52.04941 -0.3293985     6.751841      16.65672       9.461910      -17.95218      9.637603  158.8834 71.81609 92.07445 46.96579 66.80893       85.80988 
1 1 1 -12 3  1  o 480.8206 20.28794 45.18257       3.788340      42.89344       5.109151      47.97807       5.646035  466.2268 28.35246 492.8233 29.63797 -26.59647      41.01550 
1 1 1 -12 3  2  o 426.4589 22.77099 35.71340       3.757624      38.10637       5.096074      32.86214       5.562700  438.7645 30.08902 405.7094 35.66786 33.05502       46.66418 
1 1 1 -12 3  3  o 403.1318 24.64318 31.99621       3.839556      26.79902       5.279054      37.83323       5.594578  365.3179 37.75439 436.1375 33.28182 -70.81955      50.32965 
1 1 1 -12 3  4  o 167.0489 49.47046 5.752968       3.436695      6.458942       4.973075      5.107629       4.754715  180.2496 60.35759 166.0517 58.86495 14.19797       84.30967 
1 1 1 -12 3  5  o 650.2358 21.23935 82.75197       5.363397      78.97234       9.483824      84.52919       6.503240  628.2254 39.06574 656.0327 25.52562 -27.80725      46.66572 
1 1 1 -12 3  6  o 545.4144 24.32072 58.36882       5.151467      49.77700       9.301381      62.17031       6.187029  493.7184 49.16489 561.1252 28.48532 -67.40680      56.82077 
1 1 1 -12 3  7  o 434.1946 29.64489 37.34114       4.968884      47.02623       9.221005      33.37802       5.898544  479.2313 50.29559 407.9059 37.66070 71.32532       62.83291 
1 1 1 -12 3  8  o 85.00084 41.07315 -6.289783      4.110817      -6.398935      6.025127      -6.194720      5.622845  111.2213 52.62702 106.8241 50.63140 4.397163       73.02836 
1 1 1 -12 3  9  o 211.6501 51.71433 9.438042       4.214476      9.139247       6.235308      9.689360       5.718508  209.6515 67.44372 213.9091 63.92082 -4.257660      92.92216 
1 1 1 -12 3  10 o 727.4830 27.96418 104.1031       7.900472      0.000000       0.000000      104.1031       7.900472  ?        ?        727.4830 27.96418 0.000000       27.96418 
1 1 1 -12 3  11 o 707.5332 29.44326 98.57121       8.090226      0.000000       0.000000      98.57121       8.090226  ?        ?        707.5332 29.44326 0.000000       29.44326 
1 1 1 -12 3  12 o 438.1953 31.01869 38.02737       5.244494      32.06499       7.413675      43.99993       7.419998  396.2227 49.24186 468.1565 41.23256 -71.93375      64.22527 
1 1 1 -12 3  13 o 674.1489 23.41494 88.98631       6.130231      87.24932       8.554224      90.82014       8.789473  664.7816 33.13398 678.1680 33.37318 -13.38635      47.02797 
1 1 1 -12 3  14 o 261.5448 57.88216 14.43382       5.723679      13.22148       8.232018      15.56840       7.963660  248.7276 77.17350 267.9479 74.06022 -19.22028      106.9610 
1 1 1 -12 3  15 o 854.1735 22.72363 142.7522       7.537925      141.6016       10.83676      143.8307       10.49207  847.2095 32.93675 854.3781 31.62153 -7.168640      45.65907 
1 1 1 -12 3  16 o 390.6066 46.66281 30.99875       6.938335      41.51653       10.06016      21.45726       9.581880  447.2208 59.39251 312.0816 78.98931 135.1392       98.82703 
1 1 1 -12 3  17 o 516.7222 35.15167 53.13759       7.011996      79.40637       10.32528      30.65309       9.552646  628.7952 42.53304 378.7903 67.40830 250.0048       79.70532 
1 1 1 -12 3  18 o 350.7335 52.06533 25.56590       6.876497      29.78215       9.618773      21.15843       9.834484  370.4367 69.41230 305.7853 81.38126 64.65140       106.9625 
1 1 1 -12 3  19 o 482.3419 37.96351 46.86305       7.053828      49.41689       9.820936      44.14173       10.13785  487.5115 52.71204 457.1082 58.44644 30.40335       78.70543 
1 1 1 -12 3  20 o 371.3361 49.48614 28.80415       6.958745      20.54930       9.665408      37.68792       10.02684  296.1496 81.48181 416.4367 64.05155 -120.2871      103.6431 
1 1 1 -12 3  21 o 282.5730 67.59763 18.03483       7.318449      18.67513       9.918171      17.26951       10.84329  278.9196 84.37067 267.5882 89.11818 11.33139       122.7211 
1 1 1 -12 3  22 o 649.2972 49.33894 88.34948       12.34811      98.82883       16.83631      76.15082       18.16501  668.6363 65.68581 563.8229 85.65388 104.8134       107.9408 
1 1 1 -12 3  23 f 170.8811 73.76965 2.490907       8.935958      24.17452       15.56105      -8.177735      10.91510  290.3704 106.0311 148.2942 70.36121 142.0762       127.2529 
1 1 1 -12 3  24 o 273.1376 71.99157 18.34302       7.744354      23.80335       11.15207      13.25737       10.76265  294.5119 89.54972 228.1877 87.18234 66.32417       124.9797 
1 1 1 -12 3  25 o 130.0480 60.91166 -3.806087      7.716079      -12.17816      11.02616      4.228551       10.80167  133.4258 65.10780 177.7856 78.79340 -44.35988      102.2126 
1 1 1 -12 3  26 o 518.9824 51.78104 62.03805       10.29708      17.59439       16.57522      89.97012       13.14032  219.3570 97.39260 618.8642 55.25535 -399.5072      111.9753 
1 1 1 -12 3  27 o 122.4939 59.49904 -7.041231      8.919889      0.6295274      11.26538      -19.93232      14.60398  153.2655 72.34907 131.4360 65.93286 21.82951       97.88528 
1 1 1 -12 3  28 o 165.4658 69.61050 8.260236       7.602850      14.76695       11.03002      2.370455       10.49410  189.3830 81.85744 147.2807 69.61706 42.10236       107.4578 
1 1 1 -12 3  29 o 140.6074 63.18018 5.150258       7.197913      3.675024       10.36854      6.522546       10.00022  140.5538 67.21571 147.9010 69.29592 -7.347122      96.53951 
1 1 1 -12 3  30 o 132.0224 60.46352 5.210335       6.988688      8.807476       9.700203      1.327853       10.07759  143.1138 67.42798 125.3493 61.39558 17.76450       91.19183 
1 1 1 -12 3  31 o 114.7331 54.79637 2.236885       6.844538      -15.42133      9.417711      22.00591       9.964711  93.47915 47.56496 174.7119 76.62113 -81.23278      90.18439 
1 1 1 -12 4  1  o 386.0291 24.14460 29.30341       3.601471      28.54615       4.811975      30.26782       5.430419  378.9218 33.03016 389.3326 36.33566 -10.41077      49.10470 
1 1 1 -12 4  2  o 726.5511 16.80532 102.9608       4.741776      102.6070       6.539467      103.3530       6.885689  723.8242 23.26383 726.1367 24.41749 -2.312439      33.72565 
1 1 1 -12 4  3  o 474.2906 21.47648 44.00991       3.955813      40.10806       5.502563      48.18345       5.690919  449.7378 31.70793 493.6990 29.82191 -43.96121      43.52860 
1 1 1 -12 4  4  o 650.2249 18.33371 82.55826       4.629584      82.14935       6.673195      82.93769       6.428121  646.6254 26.57376 650.0311 25.46372 -3.405701      36.80443 
1 1 1 -12 4  5  o 975.6965 16.11902 185.6697       6.107751      185.3997       8.780146      185.9228       8.501903  972.6819 23.24357 974.3440 22.46859 -1.662048      32.32803 
1 1 1 -12 4  6  o 454.5011 28.58144 40.82578       5.019143      53.87754       9.352599      35.54638       5.948261  515.0643 47.28453 421.5365 36.70137 93.52783       59.85664 
1 1 1 -12 4  7  o 441.5063 29.11784 38.55869       4.964537      38.53938       9.029043      38.56706       5.943635  431.4878 55.14340 439.7428 35.09605 -8.255005      65.36457 
1 1 1 -12 4  8  o 259.3623 44.49159 13.83829       4.320047      13.22194       6.133290      14.44517       6.085924  248.0450 63.42269 259.8367 61.30223 -11.79164      88.20658 
1 1 1 -12 4  9  o 920.2877 17.84518 165.3214       6.377824      164.5164       9.135034      166.0870       8.908444  915.4716 25.69433 920.1223 24.93035 -4.650696      35.80113 
1 1 1 -12 4  10 o 390.9268 32.08647 30.35786       4.828344      28.00063       7.098909      32.38707       6.586468  369.1192 50.87366 400.3864 43.03442 -31.26724      66.63400 
1 1 1 -12 4  11 o 468.1329 28.18389 43.23373       5.099985      40.65031       7.228736      45.79402       7.196310  449.6130 41.88138 478.4540 39.07050 -28.84094      57.27612 
1 1 1 -12 4  12 o 281.0252 47.17412 16.24249       4.966020      20.54107       7.124813      12.18110       6.925454  311.8184 61.02101 238.6765 70.10035 73.14188       92.93881 
1 1 1 -12 4  13 o 488.1068 30.14428 47.05711       5.686134      43.37831       8.263904      50.36476       7.835966  463.1461 46.57667 501.6806 40.56671 -38.53448      61.76604 
1 1 1 -12 4  14 o 560.7655 29.18253 61.97607       6.333291      54.04350       8.990711      69.78949       8.922925  518.1676 45.12880 591.7927 39.04423 -73.62512      59.67462 
1 1 1 -12 4  15 o 273.4085 60.42084 15.82609       6.244624      18.61151       8.953012      13.18723       8.714290  291.6672 77.66022 249.1772 79.68639 42.49002       111.2701 
1 1 1 -12 4  16 o 245.8108 65.84349 12.95094       6.411774      5.863016       9.464213      18.96389       8.717035  202.7901 80.51312 294.3092 75.80456 -91.51906      110.5834 
1 1 1 -12 4  17 f 556.8163 32.45277 61.47321       6.987231      58.16149       10.19258      64.40932       9.597155  534.2184 49.69891 565.1715 44.07384 -30.95306      66.42654 
1 1 1 -12 4  18 o 222.4224 68.82182 10.62958       6.551803      15.86961       9.222880      5.291220       9.309017  266.0676 81.54336 196.0664 79.16165 70.00121       113.6481 
1 1 1 -12 4  19 o 140.3869 66.66342 -9.623092      9.836800      0.000000       0.000000      -9.623092      9.836800  ?        ?        140.3869 66.66342 0.000000       66.66342 
1 1 1 -12 4  20 o 315.7466 63.51204 21.89902       7.518111      28.17179       10.42183      15.09287       10.85588  349.2512 78.72157 255.6488 89.07945 93.60240       118.8791 
1 1 1 -12 4  21 o 352.5724 55.80490 26.69095       7.386583      37.02912       10.48890      16.51940       10.40403  407.1507 68.78625 262.6235 87.28633 144.5272       111.1326 
1 1 1 -12 4  22 o 332.3481 88.75652 27.65636       11.67182      22.27205       14.91780      36.15502       18.74195  288.3109 104.0388 348.9652 117.1712 -60.65436      156.6945 
1 1 1 -12 4  23 o 598.6251 41.27095 74.16995       9.535995      80.21962       16.22532      70.97758       11.78648  586.8530 72.75270 573.7472 53.51520 13.10583       90.31518 
1 1 1 -12 4  24 o 197.9581 73.98434 9.025533       7.653138      11.79945       10.85056      6.279447       10.79599  218.9067 86.43071 191.9679 81.94286 26.93874       119.1004 
1 1 1 -12 4  25 o 150.0129 66.68060 1.333009       7.791249      -9.214804      10.99595      11.96774       11.04116  138.8487 67.11277 210.9800 85.84160 -72.13135      108.9629 
1 1 1 -12 4  26 o 146.5399 68.01472 -0.6093158     9.273546      -14.07605      15.55647      6.814300       11.55015  148.3054 73.33810 180.4104 80.62048 -32.10493      108.9869 
1 1 1 -12 4  27 o 182.9340 75.67499 10.10459       8.764504      6.139094       10.97065      17.10105       14.57211  167.7824 76.42438 202.8874 90.61788 -35.10495      118.5423 
1 1 1 -12 4  28 o 172.3803 70.41561 9.657459       7.466712      23.79085       10.85730      -3.025177      10.28498  232.9275 87.90450 132.3783 64.20557 100.5492       108.8557 
1 1 1 -12 4  29 o 191.2004 70.74859 13.88872       6.963987      3.774594       10.37593      22.17951       9.394219  139.5415 66.86574 218.7619 81.92791 -79.22034      105.7507 
1 1 1 -12 4  30 o 161.5752 67.02758 11.33577       6.903732      13.02155       9.961009      9.777467       9.577013  154.1360 71.16869 144.9494 67.88140 9.186615       98.35074 
1 1 1 -12 4  31 f 119.1591 56.25130 3.758430       6.811168      3.831134       9.232865      3.671620       10.08884  121.4844 59.34595 121.7653 59.99391 -0.2808990     84.38728 
1 1 1 -12 5  1  o 535.2969 21.79149 56.02359       4.530120      59.27776       5.546474      49.50278       7.851406  549.8326 25.97518 497.3088 41.01909 52.52377       48.55178 
1 1 1 -12 5  2  o 576.0656 18.95155 64.78725       4.239793      64.60720       5.943287      64.97384       6.050084  573.7493 26.67329 575.2811 27.08029 -1.531738      38.01061 
1 1 1 -12 5  3  o 280.2363 34.15240 15.74199       3.639961      14.28639       5.011418      17.36742       5.295702  261.9104 51.10444 290.2350 48.70920 -28.32462      70.59922 
1 1 1 -12 5  4  o 416.6285 25.46535 34.17688       4.100496      38.60878       5.930959      30.11864       5.675432  440.3249 34.97152 387.6085 38.19974 52.71646       51.79022 
1 1 1 -12 5  5  o 381.7587 27.94847 28.80613       4.114772      21.62959       5.917106      35.52643       5.725934  324.4753 48.44050 422.1075 35.25236 -97.63214      59.91002 
1 1 1 -12 5  6  o 512.3826 25.11030 51.50422       4.996595      60.71392       9.033306      47.44435       5.997631  549.5446 42.66120 489.3120 31.73328 60.23260       53.16934 
1 1 1 -12 5  7  o 145.6383 55.64444 3.178967       4.384415      9.630673       8.015373      0.4243418      5.237423  219.4908 76.53972 134.0858 57.15071 85.40497       95.52242 
1 1 1 -12 5  8  o 714.5772 19.34567 99.74842       5.368598      102.4074       7.746226      97.29069       7.447283  721.7928 27.63437 703.6469 27.25305 18.14594       38.81220 
1 1 1 -12 5  9  o 656.4103 21.42706 84.27066       5.462179      90.92809       7.980063      78.40211       7.492357  679.4314 30.24355 630.7985 30.58439 48.63293       43.01252 
1 1 1 -12 5  10 o 132.2638 54.37530 1.402558       4.488134      -4.278257      6.563806      6.390774       6.150678  126.2554 58.10692 186.2550 66.85193 -59.99959      88.57536 
1 1 1 -12 5  11 o 583.4343 23.68197 66.65624       5.365840      59.39143       7.881347      72.93322       7.325943  546.1216 37.38554 607.6691 31.14802 -61.54755      48.66085 
1 1 1 -12 5  12 o 558.4859 25.34430 61.14019       5.496933      66.04449       7.859912      56.44498       7.690528  576.9087 35.25101 532.4373 37.43085 44.47137       51.41695 
1 1 1 -12 5  13 o 605.3819 26.00525 71.85735       6.113902      73.38091       9.005826      70.55488       8.326769  607.1885 38.38961 596.1684 36.13557 11.02008       52.72136 
1 1 1 -12 5  14 o 978.5987 20.20147 187.0380       7.677425      187.0467       11.21137      187.0303       10.53519  975.3884 29.59738 976.0582 27.79320 -0.6698608     40.60131 
1 1 1 -12 5  15 o 505.6001 33.69811 50.67527       6.578785      49.93848       9.189697      51.44983       9.422276  496.6294 48.25691 503.9422 48.75386 -7.312836      68.59788 
1 1 1 -12 5  16 o 737.5541 26.21554 106.7640       7.508976      111.2923       10.88714      102.6555       10.37029  748.9109 37.43309 718.4245 37.29739 30.48645       52.84251 
1 1 1 -12 5  17 o 531.1583 33.81508 56.08618       6.939001      63.05892       10.27767      50.24535       9.406546  556.9866 47.98232 496.0624 49.48818 60.92419       68.93027 
1 1 1 -12 5  18 o 505.8877 35.83213 51.21399       6.994162      51.19528       9.967336      51.23214       9.816859  497.6183 52.36252 498.2995 51.47027 -0.6812134     73.42358 
1 1 1 -12 5  19 o 502.3748 53.43227 52.68461       10.26459      52.68461       10.26459      0.000000       0.000000  502.3748 53.43227 ?        ?        0.000000       53.43227 
1 1 1 -12 5  20 o 221.3333 71.88976 10.82516       7.072375      16.58372       10.20186      5.497059       9.813159  265.2023 86.35237 196.1542 80.49447 69.04813       118.0512 
1 1 1 -12 5  21 o 398.7327 111.5287 43.45459       17.94648      0.000000       0.000000      43.45459       17.94648  ?        ?        398.7327 111.5287 0.000000       111.5287 
1 1 1 -12 5  22 o 172.2450 78.38903 -1.964550      11.51024      3.875619       15.50672      -9.130594      17.17699  211.7475 94.09871 186.3787 88.38319 25.36879       129.0975 
1 1 1 -12 5  23 o 641.1874 38.38181 84.50963       9.513438      99.04250       16.11835      76.74036       11.78515  664.1636 63.25529 598.2148 51.22224 65.94879       81.39379 
1 1 1 -12 5  24 o 172.2713 70.48578 5.267625       7.496893      3.418661       10.10571      7.530554       11.17990  175.8112 77.13084 197.4480 83.80968 -21.63675      113.9001 
1 1 1 -12 5  25 o 168.6008 73.43008 4.254369       9.011942      -0.4881994E-01 16.03086      6.242631       10.89679  181.2531 85.78758 183.6469 80.34232 -2.393814      117.5347 
1 1 1 -12 5  26 o 199.8148 78.82723 11.75695       9.018467      10.81283       15.79861      12.21330       10.98391  195.9229 90.16225 200.1502 83.90747 -4.227234      123.1653 
1 1 1 -12 5  27 o 247.0636 80.52474 20.39832       8.870541      18.24376       11.00590      24.39269       14.98549  216.6864 86.57038 223.4948 95.99973 -6.808365      129.2686 
1 1 1 -12 5  28 o 254.3637 74.48867 21.53704       7.829863      13.46442       11.29243      29.01158       10.86607  179.2616 79.93974 261.3353 89.21020 -82.07372      119.7866 
1 1 1 -12 5  29 o 104.7025 51.19502 -4.765532      6.918321      -8.380854      9.838714      -1.229552      9.730155  112.6182 56.12999 125.3388 61.16164 -12.72056      83.01398 
1 1 1 -12 5  30 o 152.1695 65.66167 10.09040       7.073063      0.9726312      10.25563      18.36142       9.767829  123.0409 60.59628 173.0042 75.86661 -49.96334      97.09609 
1 1 1 -12 6  1  o 459.7166 24.49349 41.49070       4.357125      40.78532       5.303784      42.95493       7.641523  454.4875 30.22168 462.6335 43.02496 -8.145966      52.57848 
1 1 1 -12 6  2  o 963.5289 15.81097 180.9184       5.916315      179.9339       8.219495      181.9769       8.522600  959.2808 22.06335 964.4989 22.75319 -5.218140      31.69384 
1 1 1 -12 6  3  o 1502.256 16.22887 439.9218       9.468044      441.6497       13.35889      438.1777       13.42099  1502.318 22.89711 1496.300 23.09606 6.017334       32.52239 
1 1 1 -12 6  4  o 130.0284 50.65526 2.233327       3.684754      2.941611       5.184261      1.510223       5.238217  151.4763 59.76326 141.5391 58.52327 9.937256       83.64581 
1 1 1 -12 6  5  o 494.9016 22.68470 47.93304       4.359933      60.10302       6.379734      37.26831       5.972177  551.8262 29.88090 432.4672 35.88329 119.3589       46.69559 
1 1 1 -12 6  6  o 342.1760 34.23337 23.36127       4.488079      26.26499       7.698739      21.86643       5.523798  354.8951 57.85205 327.9057 44.52890 26.98941       73.00468 
1 1 1 -12 6  7  o 243.0991 52.91188 12.39121       4.853514      5.873294       8.486032      15.55985       5.916795  196.7736 76.81286 271.5272 57.87948 -74.75357      96.17822 
1 1 1 -12 6  8  o 142.3995 54.61814 2.951592       4.234369      1.111609       6.238835      4.523088       5.765715  149.4810 62.98080 168.7634 63.96969 -19.28236      89.77028 
1 1 1 -12 6  9  o 216.0263 52.80358 9.798441       4.392623      12.96864       6.579266      7.248825       5.900267  246.0397 67.03342 192.4949 65.73750 53.54485       93.88770 
1 1 1 -12 6  10 o 437.5996 29.16197 37.80955       4.927510      35.74925       7.132411      39.69083       6.815490  420.9185 44.29738 445.2874 39.83271 -24.36884      59.57267 
1 1 1 -12 6  11 o 750.8117 20.98066 110.1597       6.117558      104.0673       8.858498      115.7143       8.458429  726.9088 31.37994 767.4921 28.37840 -40.58331      42.30880 
1 1 1 -12 6  12 o 296.8026 46.11242 17.99536       5.142620      17.03607       7.811271      18.72924       6.832191  280.9675 71.43060 297.9722 61.09257 -17.00470      93.99273 
1 1 1 -12 6  13 o 582.3228 26.40913 66.48482       5.972358      64.11374       8.626973      68.66706       8.276315  567.2354 39.40676 588.1993 36.41035 -20.96393      53.65265 
1 1 1 -12 6  14 o 636.7210 26.07906 79.47662       6.448653      80.49033       9.386690      78.57055       8.874403  636.2621 38.16450 629.2391 36.47221 7.022949       52.78969 
1 1 1 -12 6  15 o 378.7891 43.87915 28.99678       6.335282      27.93210       9.184134      29.96330       8.750474  362.3815 67.75048 378.2907 61.68957 -15.90927      91.62822 
1 1 1 -12 6  16 o 444.0794 38.23415 39.45602       6.529581      45.93687       9.737580      34.16113       8.801635  472.8502 53.99553 405.4822 57.50494 67.36804       78.88178 
1 1 1 -12 6  17 o 450.7980 38.59663 40.80187       6.691930      38.34631       9.529284      43.19110       9.399683  427.8387 58.91504 456.9771 54.00953 -29.13843      79.92503 
1 1 1 -12 6  18 f 347.7386 72.91188 26.81693       9.531828      26.81693       9.531828      0.000000       0.000000  347.7386 72.91188 ?        ?        0.000000       72.91188 
1 1 1 -12 6  19 o 137.5561 61.37737 -1.502086      6.667411      1.860095       9.542711      -4.708842      9.319534  178.0088 76.53864 150.2106 69.17137 27.79822       103.1642 
1 1 1 -12 6  20 f 150.9967 65.60486 0.4249206      7.158736      -8.499447      10.30301      8.754879       9.953977  146.1549 69.05283 214.2252 83.31198 -68.07030      108.2090 
1 1 1 -12 6  21 o 153.2070 69.29154 -2.153433      8.823539      -7.521442      10.57790      10.12512       15.99802  150.0739 70.61746 238.2630 100.6451 -88.18903      122.9482 
1 1 1 -12 6  22 o 618.5427 52.46257 81.44997       12.48342      82.55066       16.30450      79.89066       19.40631  601.5537 71.17143 566.4138 91.32891 35.13995       115.7858 
1 1 1 -12 6  23 o 308.4192 75.85600 23.34365       9.022783      51.22413       14.80012      6.852196       11.38268  446.6042 88.46106 200.2666 84.76129 246.3376       122.5146 
1 1 1 -12 6  24 o 247.8051 73.65406 15.72002       7.607700      18.90050       10.61705      12.36369       10.90662  257.8420 88.18125 218.4211 86.52197 39.42091       123.5394 
1 1 1 -12 6  25 o 182.6399 76.23370 7.462566       9.009107      0.8213747      15.62479      10.77008       11.02661  180.0416 85.05499 201.5593 84.25240 -21.51775      119.7197 
1 1 1 -12 6  26 o 112.7208 56.40453 -18.71903      10.37740      -32.30548      15.32286      -7.207353      14.10446  124.3706 63.01012 150.8645 73.62180 -26.49381      96.90430 
1 1 1 -12 6  27 o 121.5750 58.89378 -5.641102      8.585932      -13.03105      10.48216      9.425571       14.96715  118.2766 58.78410 176.6593 83.39238 -58.38273      102.0287 
1 1 1 -12 6  28 o 98.49857 48.98149 -10.43912      7.319013      8.817533       10.46420      -28.88200      10.24071  161.5374 73.98264 93.79868 47.89425 67.73870       88.13223 
1 1 1 -12 6  29 o 170.1429 69.97225 11.97217       7.435360      16.75833       10.57376      7.290626       10.45757  174.7396 77.67554 144.9114 68.78944 29.82816       103.7568 
1 1 1 -12 6  30 o 155.6644 66.41556 11.06601       7.086223      12.66803       9.919003      9.396071       10.12710  149.5932 69.73511 139.9590 66.79122 9.634201       96.56113 
1 1 1 -12 7  1  f 400.5748 27.89623 31.61505       4.312590      31.15932       5.225817      32.58808       7.635983  396.2018 34.30172 400.4548 50.20362 -4.252960      60.80306 
1 1 1 -12 7  2  o 652.8255 20.42997 83.21480       5.179560      79.45221       6.216393      91.75784       9.367021  636.9932 25.12903 680.8299 35.55038 -43.83673      43.53501 
1 1 1 -12 7  3  o 405.6521 26.37732 32.38987       4.132815      27.93572       5.917286      36.63192       5.774689  372.7570 41.58481 429.4097 34.93086 -56.65268      54.30894 
1 1 1 -12 7  4  o 495.2975 31.59120 48.49155       6.044911      0.000000       0.000000      48.49155       6.044911  ?        ?        495.2975 31.59120 0.000000       31.59120 
1 1 1 -12 7  5  o 884.4685 16.98148 152.5296       5.832919      151.6498       8.248816      153.4095       8.249170  880.0684 24.13499 885.2017 23.99607 -5.133362      34.03394 
1 1 1 -12 7  6  f 866.1704 20.19379 146.5348       6.792805      153.4695       12.24982      143.4556       8.162776  880.9476 35.80565 855.8283 24.55971 25.11932       43.41916 
1 1 1 -12 7  7  o 797.3898 20.59302 124.2161       6.377034      134.2161       11.61040      119.8960       7.631164  823.6269 36.29850 782.2459 25.11999 41.38098       44.14289 
1 1 1 -12 7  8  o 799.2148 18.50615 124.6367       5.743910      128.0004       8.459020      121.7589       7.824292  807.7200 26.96691 788.1931 25.56139 19.52698       37.15641 
1 1 1 -12 7  9  o 607.0617 21.96247 72.04762       5.177762      73.74596       7.611111      70.58451       7.064342  610.9908 32.18996 598.2369 30.50815 12.75391       44.35020 
1 1 1 -12 7  10 o 201.4271 56.14225 8.476648       4.556040      6.170553       6.918656      10.24235       6.053997  189.6714 70.45138 220.8849 65.71557 -31.21347      96.34279 
1 1 1 -12 7  11 o 827.0160 19.95219 133.5365       6.408147      139.1808       9.582789      128.9708       8.618666  841.6582 29.31758 810.8080 27.37121 30.85022       40.10865 
1 1 1 -12 7  12 o 523.7157 27.65448 53.95789       5.604626      46.28715       8.096560      61.01516       7.766045  480.1334 43.90818 554.4942 36.26383 -74.36078      56.94728 
1 1 1 -12 7  13 o 1141.719 18.73572 254.3230       8.307258      270.9025       12.28460      240.3530       11.27650  1175.379 26.91256 1107.398 26.22059 67.98096       37.57400 
1 1 1 -12 7  14 o 368.7484 43.06422 27.42674       6.050848      16.98999       8.825566      36.68396       8.311899  279.4407 78.22848 424.0506 51.53156 -144.6099      93.67602 
1 1 1 -12 7  15 o 485.5188 34.74002 46.82613       6.507064      40.02785       9.490315      52.85770       8.939154  440.3940 56.81440 512.0466 45.42464 -71.65268      72.74114 
1 1 1 -12 7  16 o 218.6656 66.64188 10.11712       6.171000      0.2496843      8.688041      20.16408       8.766717  167.3502 72.49124 302.8271 74.94852 -135.4769      104.2701 
1 1 1 -12 7  17 o 436.0941 38.45583 38.24015       6.446158      44.90539       9.256014      31.96285       8.982621  466.5612 51.96729 388.1045 61.65947 78.45676       80.63802 
1 1 1 -12 7  18 o 145.9905 62.84502 0.4858334      6.448015      11.77153       9.123347      -10.77773      9.114400  234.2224 81.65965 130.7966 62.67372 103.4258       102.9383 
1 1 1 -12 7  19 o 346.7082 54.68889 25.50376       7.119533      26.48623       10.21201      24.57463       9.930953  338.9735 79.03053 326.0995 79.20448 12.87399       111.8891 
1 1 1 -12 7  20 f 174.7140 69.33936 4.738069       7.017070      10.26435       10.10634      -0.4059026     9.750496  223.1930 84.67058 168.3279 74.71895 54.86508       112.9249 
1 1 1 -12 7  21 o 786.4756 34.83332 124.4446       10.63918      107.2045       12.61783      166.8512       19.78934  720.1522 45.34778 882.3887 58.07339 -162.2365      73.68134 
1 1 1 -12 7  22 o 163.7114 75.12736 -2.867002      10.86435      -7.010844      14.63721      2.216608       16.21223  175.7338 82.80645 207.2084 93.80081 -31.47456      125.1219 
1 1 1 -12 7  23 o 170.5105 70.48911 4.541660       7.597193      -3.856247      10.89365      12.49362       10.60046  157.3430 73.25851 224.8067 86.37260 -67.46364      113.2565 
1 1 1 -12 7  24 o 149.5618 66.40550 1.055518       7.706136      13.23053       10.84222      -11.37389      10.95490  220.6280 86.62391 135.2547 65.75282 85.37323       108.7526 
1 1 1 -12 7  25 o 170.4490 73.46890 5.436236       8.835501      15.27872       15.58466      0.7742784      10.72579  216.1352 95.27259 160.2495 73.94190 55.88570       120.5996 
1 1 1 -12 7  26 o 172.4597 74.02013 7.332759       8.896555      4.811840       11.25270      11.53559       14.52942  167.5503 76.73022 191.7182 87.56844 -24.16788      116.4292 
1 1 1 -12 7  27 o 148.6219 68.01170 3.529725       8.818336      -4.843601      10.86569      19.68690       15.09353  133.7764 65.13633 199.3335 90.34682 -65.55707      111.3790 
1 1 1 -12 7  28 o 164.7538 68.96080 9.380591       7.401374      11.20127       10.28635      7.426057       10.65777  167.0576 75.25279 154.4794 72.10411 12.57819       104.2209 
1 1 1 -12 7  29 o 239.7152 72.00985 21.47831       7.243351      27.61425       10.54005      15.98714       9.970913  221.6400 85.85934 171.6198 75.89918 50.02028       114.5972 
1 1 1 -12 7  30 f 150.6608 65.97810 10.74184       7.365156      9.944141       10.36137      11.55655       10.47131  139.2588 66.75365 143.0765 68.17867 -3.817734      95.41688 
1 1 1 -12 8  1  o 467.6983 31.55267 43.16266       5.697490      49.98324       8.394352      37.33678       7.758139  499.9719 43.67110 430.5037 47.17633 69.46817       64.28663 
1 1 1 -12 8  2  o 515.7645 24.23981 52.02771       4.855217      51.46934       5.928707      53.16473       8.460210  511.1651 29.99698 515.8731 42.61035 -4.707977      52.11008 
1 1 1 -12 8  3  o 367.2865 28.40039 26.61591       4.019474      33.22021       5.594070      19.56715       5.779239  408.8695 35.58504 309.0636 49.84557 99.80585       61.24440 
1 1 1 -12 8  4  o 608.0592 20.14831 72.17386       4.757869      75.49737       6.749096      68.89034       6.708375  620.3815 28.01295 592.3637 29.16090 28.01776       40.43616 
1 1 1 -12 8  5  o 227.6958 47.21025 10.72097       4.037629      0.1232143      5.474459      23.36209       5.978977  135.6761 58.14377 339.1308 46.63123 -203.4547      74.53301 
1 1 1 -12 8  6  o 564.7419 25.09262 62.45279       5.503311      67.34449       9.743897      60.16143       6.668814  580.0604 43.57290 552.1730 31.22690 27.88733       53.60706 
1 1 1 -12 8  7  o 619.0654 23.32472 74.96113       5.607650      96.22238       10.16839      65.66896       6.722277  696.3439 37.74204 577.2823 30.08890 119.0616       48.26804 
1 1 1 -12 8  8  o 198.7229 55.27161 8.225843       4.420722      10.90490       6.640471      6.093472       5.924329  228.0580 69.04722 183.2772 65.62857 44.78087       95.26084 
1 1 1 -12 8  9  o 661.5326 21.70521 85.51204       5.576263      90.80889       8.204272      80.96413       7.602157  679.4805 31.09103 641.7455 30.50324 37.73492       43.55571 
1 1 1 -12 8  10 o 144.1210 56.10181 2.778977       4.517037      10.79064       6.748335      -3.724220      6.079932  227.2997 69.76643 123.2431 56.42543 104.0566       89.72839 
1 1 1 -12 8  11 o 378.1815 34.86650 28.44104       5.063120      31.87728       7.390847      25.40239       6.950125  396.2387 49.07984 351.9785 52.44658 44.26025       71.82948 
1 1 1 -12 8  12 o 212.0531 61.39521 9.387019       5.346249      5.752300       7.932982      12.41146       7.236412  193.6777 74.63851 242.1318 71.80382 -48.45416      103.5698 
1 1 1 -12 8  13 o 491.0767 41.24006 48.21363       7.792137      0.000000       0.000000      48.21363       7.792137  ?        ?        491.0767 41.24006 0.000000       41.24006 
1 1 1 -12 8  14 o 338.2575 45.50243 23.24151       5.825744      23.13844       8.636870      23.32755       7.891221  328.5979 69.83318 332.4715 63.43149 -3.873596      94.34101 
1 1 1 -12 8  15 o 104.9698 50.21116 -7.447908      5.793616      -7.592178      8.849940      -7.339707      7.664203  139.1760 65.20188 127.5753 60.05475 11.60066       88.64456 
1 1 1 -12 8  16 o 344.8814 66.71263 25.57729       8.612121      0.000000       0.000000      25.57729       8.612121  ?        ?        344.8814 66.71263 0.000000       66.71263 
1 1 1 -12 8  17 f 182.4194 67.53994 6.008832       6.348526      4.396106       8.958294      7.635953       8.998181  188.5655 77.08962 207.6259 79.62350 -19.06038      110.8274 
1 1 1 -12 8  18 o 129.3252 62.27715 -11.79973      9.257932      -11.79973      9.257932      0.000000       0.000000  129.3252 62.27715 ?        ?        0.000000       62.27715 
1 1 1 -12 8  19 o 297.5650 62.98769 19.45287       7.052038      28.18930       10.02161      10.88360       9.925264  351.7295 75.61578 227.7718 84.42577 123.9577       113.3378 
1 1 1 -12 8  20 o 309.3858 63.52853 21.19533       7.377454      25.45930       10.75747      17.40923       10.13677  325.7189 84.36778 269.5281 85.91806 56.19083       120.4153 
1 1 1 -12 8  21 o 178.6671 78.62891 1.349828       10.57443      2.917861       13.33713      -1.304336      17.35196  199.7552 88.08955 205.8777 94.64979 -6.122543      129.2995 
1 1 1 -12 8  22 o 241.7896 79.11964 14.31907       8.560515      33.02318       14.81983      4.952961       10.48707  340.9370 103.1335 190.0659 80.93721 150.8710       131.1005 
1 1 1 -12 8  23 o 148.5670 66.08683 0.3554230      7.666799      3.149596       10.98581      -2.297555      10.70464  179.8627 79.60030 159.5076 73.69396 20.35504       108.4758 
1 1 1 -12 8  24 o 136.9040 62.58146 -1.219031      7.439244      0.3708256      10.45601      -2.848840      10.58657  161.7357 74.02944 152.4843 71.39719 9.251358       102.8490 
1 1 1 -12 8  25 o 149.4623 69.25723 -0.3108182     9.557856      -5.351340      17.04622      2.000509       11.54306  167.5293 81.57382 165.3215 76.43111 2.207794       111.7855 
1 1 1 -12 8  26 o 131.5014 62.41365 -2.803367      8.602094      -7.969047      10.84843      5.945050       14.11783  131.6752 64.32524 173.4747 81.61467 -41.79955      103.9168 
1 1 1 -12 8  27 o 138.4568 64.77077 1.288980       8.679101      8.388215       10.65587      -12.70245      14.95940  165.9499 75.48529 134.5895 67.40198 31.36040       101.1981 
1 1 1 -12 8  28 o 118.5811 56.55199 -0.9681507     7.235133      4.632410       10.13658      -6.784730      10.33022  143.1786 67.89672 119.3251 59.14138 23.85350       90.04259 
1 1 1 -12 8  29 o 107.7964 52.57568 -2.836521      7.165087      -0.1235694E-01 10.06183      -5.741988      10.20563  123.7452 60.76001 114.2297 56.97032 9.515511       83.29104 
1 1 1 -12 8  30 o 168.5348 68.64852 13.93063       7.071213      21.26756       9.866446      6.181898       10.13956  176.4970 76.85185 129.2724 62.93870 47.22461       99.33523 
1 1 1 -12 9  1  o 451.5947 26.89429 40.05172       4.695322      38.40553       5.952335      42.76328       7.639340  440.4305 35.09141 462.7534 43.00050 -22.32291      55.50180 
1 1 1 -12 9  2  o 519.5701 29.22897 53.09046       5.873781      55.54526       8.304967      50.63351       8.308597  528.3785 40.78867 503.6949 42.88307 24.68359       59.18339 
1 1 1 -12 9  3  o 396.9427 31.35492 31.13441       4.794146      30.98095       7.601712      31.23576       6.177594  390.3887 51.38906 395.2409 40.83527 -4.852173      65.63805 
1 1 1 -12 9  4  o 1095.725 16.23896 233.8738       6.910154      243.7650       9.940802      224.6254       9.612340  1116.899 22.91815 1072.105 23.08680 44.79358       32.53063 
1 1 1 -12 9  5  o 673.5665 19.21379 88.49586       5.025990      89.08128       7.232333      87.94907       6.989530  674.1699 27.62365 670.0413 26.86077 4.128540       38.53008 
1 1 1 -12 9  6  o 160.8370 54.43489 4.904526       4.045403      2.264287       5.777223      7.444542       5.666511  153.0317 62.15989 194.2737 64.41014 -41.24202      89.51267 
1 1 1 -12 9  7  o 967.3785 20.43500 182.6710       7.677132      189.4604       14.13023      179.8275       9.144555  979.3011 37.15395 958.7050 24.56120 20.59613       44.53839 
1 1 1 -12 9  8  o 290.5662 42.28357 17.08626       4.631438      23.17019       6.989478      12.32388       6.183933  335.0190 55.67560 241.4131 64.66201 93.60593       85.32848 
1 1 1 -12 9  9  o 857.7745 18.25644 143.4687       6.081591      148.3653       8.940695      139.2521       8.296703  870.2988 26.45300 843.4518 25.32895 26.84692       36.62400 
1 1 1 -12 9  10 o 554.0972 24.84809 60.07795       5.346961      57.68213       7.821955      62.17953       7.325889  539.0381 37.60077 560.9102 33.78865 -21.87201      50.55186 
1 1 1 -12 9  11 o 911.1205 19.73588 161.9868       6.983294      153.1989       10.22111      169.6801       9.563408  883.3015 29.79620 930.6923 26.45931 -47.39075      39.84858 
1 1 1 -12 9  12 o 491.0165 29.85353 47.52479       5.665700      48.98223       8.359883      46.28671       7.705127  494.2718 44.01235 481.1758 41.64385 13.09601       60.59123 
1 1 1 -12 9  13 o 184.1442 63.55915 6.461275       5.520411      -1.882060      8.489391      12.57411       7.266550  157.3007 69.77689 243.2762 71.90687 -85.97549      100.1969 
1 1 1 -12 9  14 o 377.0769 41.20773 28.60852       5.936206      28.28112       8.900698      28.87083       7.966844  365.8787 65.02341 373.2142 56.75512 -7.335541      86.30867 
1 1 1 -12 9  15 o 283.8165 55.12993 16.91231       5.857490      12.28217       8.456502      21.18252       8.121156  240.4841 78.63484 313.0340 68.68971 -72.54988      104.4113 
1 1 1 -12 9  16 o 495.1942 34.42052 48.89430       6.578301      55.98642       9.755113      42.97958       8.908648  523.5450 48.53069 456.9801 51.07143 66.56497       70.45224 
1 1 1 -12 9  17 f 494.1888 35.61461 48.92623       6.789351      52.16697       9.959868      46.11319       9.279390  502.0256 51.83166 471.9459 51.46319 30.07974       73.04095 
1 1 1 -12 9  18 o 182.3083 68.41516 6.021537       6.557431      0.8757463      9.285288      11.14152       9.261971  171.7854 74.67681 228.9211 82.04969 -57.13570      110.9449 
1 1 1 -12 9  19 o 471.9495 40.40978 45.34550       7.335025      52.59539       10.64066      38.78113       10.12511  498.4692 55.93201 422.2126 63.73478 76.25659       84.79688 
1 1 1 -12 9  20 o 115.4385 57.40009 -21.55940      10.04151      0.000000       0.000000      -21.55940      10.04151  ?        ?        115.4385 57.40009 0.000000       57.40009 
1 1 1 -12 9  21 o 644.1074 48.84164 87.22523       12.12640      106.0936       15.91535      61.11118       18.72347  698.4579 59.23251 479.2030 103.6260 219.2549       119.3601 
1 1 1 -12 9  22 o 501.3479 46.17892 53.22866       8.889995      59.34616       14.63643      49.65245       11.19076  493.5182 79.03378 467.9911 63.18914 25.52707       101.1890 
1 1 1 -12 9  23 o 234.6579 74.32225 14.10429       7.594601      10.62300       10.68073      17.66446       10.80106  209.5094 84.72192 249.6689 88.69832 -40.15945      122.6589 
1 1 1 -12 9  24 o 184.1190 73.25041 8.031493       7.848626      7.497486       11.64284      8.476296       10.62599  189.4806 82.96683 191.4661 81.50101 -1.985519      116.3009 
1 1 1 -12 9  25 o 186.3627 77.79113 9.407394       9.381581      -7.658705      16.36269      17.76499       11.45060  159.1515 78.01086 225.7328 88.89558 -66.58130      118.2714 
1 1 1 -12 9  26 o 146.7134 67.05920 2.471739       8.539371      -4.426932      10.61299      15.13853       14.38097  136.1581 65.84155 194.1561 88.07482 -57.99800      109.9649 
1 1 1 -12 9  27 o 126.3659 60.70694 -2.167844      8.674401      4.039277       10.39208      -16.42902      15.75198  148.9093 70.04642 130.5041 65.85382 18.40521       96.14170 
1 1 1 -12 9  28 o 139.9606 63.37962 5.411365       7.408758      -9.049187      10.24813      21.24347       10.72313  113.6005 56.72514 196.9339 82.74998 -83.33343      100.3260 
1 1 1 -12 9  29 o 140.3545 63.33460 7.455455       7.323280      -3.166455      10.52453      17.42579       10.19662  117.6003 58.52197 168.4955 75.49008 -50.89516      95.51740 
1 1 1 -12 10 1  o 153.7842 58.14021 3.552600       4.754922      3.552600       4.754922      0.000000       0.000000  153.7842 58.14021 ?        ?        0.000000       58.14021 
1 1 1 -12 10 2  o 411.4416 30.06801 33.35715       4.771146      40.16896       6.110011      22.71336       7.637633  450.5652 35.19802 330.6297 61.75341 119.9355       71.08012 
1 1 1 -12 10 3  o 699.2817 27.28921 95.72495       7.410903      0.000000       0.000000      95.72495       7.410903  ?        ?        699.2817 27.28921 0.000000       27.28921 
1 1 1 -12 10 4  o 491.8281 26.73211 47.48285       5.086750      40.83945       8.196588      51.64412       6.487105  450.6253 47.55529 511.6235 32.82236 -60.99823      57.78247 
1 1 1 -12 10 5  o 1094.880 16.40637 233.4872       6.976008      238.0995       10.06929      229.2302       9.673724  1103.868 23.48842 1083.254 22.99511 20.61414       32.87066 
1 1 1 -12 10 6  o 662.3776 28.53233 85.99601       7.339573      0.000000       0.000000      85.99601       7.339573  ?        ?        662.3776 28.53233 0.000000       28.53233 
1 1 1 -12 10 7  o 584.3294 26.01085 66.82449       5.902558      59.84735       10.53051      70.02081       7.127478  545.0478 50.31731 596.4136 30.87812 -51.36578      59.03635 
1 1 1 -12 10 8  o 320.0853 36.62202 20.45768       4.470421      15.36881       6.630227      24.69952       6.053343  269.7665 64.21288 349.6542 45.66985 -79.88763      78.79739 
1 1 1 -12 10 9  o 760.2336 20.04622 112.7591       5.918446      125.7159       9.101269      103.2653       7.790628  800.5827 29.27304 725.9819 27.63241 74.60077       40.25494 
1 1 1 -12 10 10 o 516.9819 25.78928 52.31350       5.177767      56.59959       8.167508      49.43355       6.695015  533.4601 39.70829 499.7941 34.70832 33.66608       52.73913 
1 1 1 -12 10 11 o 486.4520 38.76322 47.08789       7.262195      0.000000       0.000000      47.08789       7.262195  ?        ?        486.4520 38.76322 0.000000       38.76322 
1 1 1 -12 10 12 o 500.1002 29.31038 49.27288       5.667685      60.11940       8.654429      41.12777       7.499659  549.0261 40.88280 452.8226 43.16946 96.20343       59.45591 
1 1 1 -12 10 13 o 390.1386 38.50093 30.44666       5.757274      38.76345       8.872375      24.39766       7.566652  435.1755 53.63358 341.9296 59.12133 93.24597       79.82413 
1 1 1 -12 10 14 o 376.8724 40.85122 28.60523       5.883263      33.60207       8.549597      24.11091       8.108312  402.8373 56.17866 336.8929 64.32027 65.94443       85.39987 
1 1 1 -12 10 15 o 504.8975 32.20694 50.60493       6.282178      50.63324       9.196176      50.58015       8.602221  498.4704 48.10243 499.7500 44.79864 -1.279633      65.73250 
1 1 1 -12 10 16 o 261.3409 60.66669 14.73593       6.038782      23.49306       8.772585      6.849169       8.325222  326.5222 71.18864 199.3512 76.55550 127.1710       104.5398 
1 1 1 -12 10 17 o 432.0724 41.40313 37.92906       6.862257      47.43112       10.36327      30.50937       9.157580  474.5203 57.40320 375.0873 65.23535 99.43298       86.89522 
1 1 1 -12 10 18 o 398.8731 48.02003 32.99953       7.289037      26.37943       10.49497      39.16861       10.13116  336.9900 81.16028 425.7349 63.19417 -88.74493      102.8615 
1 1 1 -12 10 19 o 405.8217 47.93591 34.30424       7.408942      31.38468       10.86501      36.84180       10.12929  368.2728 78.37469 409.1288 65.99734 -40.85602      102.4609 
1 1 1 -12 10 20 o 194.9261 78.00295 6.572146       8.951200      -4.470212      10.73671      31.74101       16.20959  159.7932 73.81830 338.1829 108.7371 -178.3897      131.4264 
1 1 1 -12 10 21 o 355.4037 79.39172 30.69496       10.68143      31.02890       13.77846      30.19199       16.90947  336.9109 98.85591 317.2726 111.1405 19.63831       148.7438 
1 1 1 -12 10 22 o 379.9179 61.16309 32.95434       8.717876      61.45005       14.38882      16.42685       10.95820  501.5591 76.27473 246.8821 89.15650 254.6770       117.3316 
1 1 1 -12 10 23 o 314.6845 66.32992 24.15735       7.850595      22.32405       10.87731      26.15067       11.34211  275.6364 89.12135 298.4861 90.20948 -22.84979      126.8084 
1 1 1 -12 10 24 o 180.2688 76.37698 7.279798       9.257611      -6.837865      16.64422      13.60369       11.13973  166.0744 80.80777 212.2434 86.27490 -46.16896      118.2085 
1 1 1 -12 10 25 o 247.9495 80.65392 19.51361       8.900660      33.71630       17.76723      14.75511       10.28418  254.8657 106.7744 209.2315 83.65125 45.63412       135.6404 
1 1 1 -12 10 26 f 154.9574 69.52472 5.173536       8.681876      -1.985921      10.52159      20.44839       15.36844  138.9886 66.79437 201.7042 91.31651 -62.71561      113.1379 
1 1 1 -12 10 27 o 136.8165 63.89831 2.591656       8.389960      -3.435358      10.01173      16.80757       15.37607  126.8017 61.91185 174.8519 83.12137 -48.05019      103.6448 
1 1 1 -12 10 28 o 92.31910 46.22224 -10.59030      7.015845      -10.35282      10.41486      -10.78760      9.492908  110.6125 55.51365 106.0444 53.19033 4.568077       76.88287 
1 1 1 -12 10 29 o 107.6796 52.35630 -1.578040      6.953569      -8.395001      10.06941      4.636299       9.614047  107.2141 53.91394 129.1478 62.50349 -21.93377      82.54333 
1 1 1 -12 11 1  o 177.6650 56.13997 6.250032       4.335178      17.16920       5.108122      -21.86458      8.196577  290.9524 46.79375 100.7375 50.36620 190.2149       68.74888 
1 1 1 -12 11 2  o 617.1205 23.26689 74.34005       5.576175      65.92127       6.915824      89.98229       9.426899  579.1770 30.85840 675.5436 36.06290 -96.36664      47.46339 
1 1 1 -12 11 3  o 252.2945 48.43017 13.04980       4.572633      13.14997       5.722094      12.87282       7.606183  250.9689 59.59690 248.3106 73.61079 2.658340       94.71188 
1 1 1 -12 11 4  o 416.0710 27.50945 34.02226       4.419971      36.23632       6.356772      31.94995       6.149924  427.0149 38.75447 400.4250 40.08610 26.58984       55.75666 
1 1 1 -12 11 5  o 606.4777 20.94770 71.75298       4.933773      75.41676       7.183263      68.48103       6.788293  620.2988 29.81899 590.3874 29.70196 29.91138       42.08774 
1 1 1 -12 11 6  o 441.0139 29.91491 38.30087       5.093212      24.03742       8.804150      45.47538       6.244119  337.6749 69.45510 479.8624 33.72046 -142.1876      77.20803 
1 1 1 -12 11 7  o 218.4228 57.66663 9.943091       4.963641      11.76782       8.545729      9.014068       6.097668  240.7467 79.06454 210.8743 66.57542 29.87236       103.3610 
1 1 1 -12 11 8  o 347.2462 36.29831 24.00513       4.822644      34.83321       7.374428      15.91375       6.374761  416.1656 46.41917 275.5527 61.16625 140.6129       76.78574 
1 1 1 -12 11 9  o 419.6965 31.95067 34.79911       5.168551      40.43289       7.862033      30.51106       6.859062  448.7745 45.75042 389.0775 46.30357 59.69705       65.09318 
1 1 1 -12 11 10 o 937.5516 27.70396 172.2540       10.08707      172.2540       10.08707      0.000000       0.000000  937.5516 27.70396 ?        ?        0.000000       27.70396 
1 1 1 -12 11 11 o 156.3730 59.43619 3.689433       4.986058      -3.588979      7.606739      9.172395       6.602186  141.4909 64.13335 213.0200 69.47215 -71.52908      94.54875 
1 1 1 -12 11 12 o 341.3477 41.45779 23.46995       5.382999      33.10173       8.447647      16.88530       6.984714  401.1215 55.73516 281.6558 65.15192 119.4656       85.73903 
1 1 1 -12 11 13 o 712.7289 23.41056 99.45906       6.479839      114.0126       10.12717      89.37046       8.431779  759.4978 34.33471 673.1254 32.25487 86.37238       47.10891 
1 1 1 -12 11 14 o 187.8245 64.29929 6.939491       5.645051      14.76682       8.784530      1.433466       7.367681  259.6158 79.58460 161.4906 68.26274 98.12512       104.8499 
1 1 1 -12 11 15 o 494.8457 32.84167 48.72372       6.275506      55.29577       9.225497      43.06369       8.561469  521.4417 46.02958 458.4012 48.84451 63.04041       67.11563 
1 1 1 -12 11 16 o 198.4038 67.77973 8.050671       6.272583      8.556696       9.552100      7.667035       8.317119  215.1537 82.14964 203.9946 76.94886 11.15910       112.5597 
1 1 1 -12 11 17 o 176.7875 67.74779 5.286801       6.511275      -6.296560      9.530876      15.42485       8.916467  147.1330 68.51092 259.9823 80.26049 -112.8493      105.5248 
1 1 1 -12 11 18 o 319.6060 59.90162 22.14124       7.161828      15.51648       10.30347      28.33400       9.961873  258.4657 86.87664 353.0483 74.97322 -94.58261      114.7542 
1 1 1 -12 11 19 o 567.0313 36.10837 64.94372       7.910004      78.00944       11.60347      53.60099       10.81135  611.7982 49.25459 501.1177 56.54221 110.6805       74.98691 
1 1 1 -12 11 20 o 264.9436 88.49049 17.54738       10.68916      2.615826       14.20338      37.05006       16.23253  201.7710 89.83907 364.0182 107.4384 -162.2471      140.0502 
1 1 1 -12 11 21 o 242.5552 88.49953 15.06325       10.83748      8.197345       13.56990      27.15490       18.00821  213.2994 91.47920 292.8727 112.5643 -79.57330      145.0489 
1 1 1 -12 11 22 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -12 11 23 o 229.8608 74.02853 14.14427       7.510694      15.19849       10.77960      13.14962       10.47059  226.8337 87.11168 215.8869 85.01014 10.94684       121.7176 
1 1 1 -12 11 24 o 217.0494 81.31112 14.45263       9.254667      11.08977       16.45200      16.00936       11.19363  198.7766 91.66915 219.9440 87.48592 -21.16743      126.7163 
1 1 1 -12 11 25 o 109.7944 53.46675 -7.419127      7.328337      -1.832853      10.68024      -12.38920      10.07398  144.0423 68.69863 118.6690 58.74215 25.37328       90.38883 
1 1 1 -12 11 26 o 155.1833 69.01707 6.141726       8.357978      -4.905250      10.11062      29.98239       14.85304  128.2238 62.52018 227.9878 96.67731 -99.76402      115.1316 
1 1 1 -12 11 27 o 124.4660 59.63445 -0.4744432     8.247379      3.365296       9.796242      -9.819831      15.28295  139.2562 66.24270 130.1331 65.56453 9.123123       93.20302 
1 1 1 -12 11 28 o 166.5443 67.78965 11.50685       6.889214      9.024756       10.79433      13.21275       8.948779  145.1317 69.17572 163.3564 72.09121 -18.22472      99.91208 
1 1 1 -12 12 1  o 570.8848 22.66651 63.56900       5.025290      73.65317       5.871064      35.93610       9.718742  614.2532 24.61169 419.3162 61.51020 194.9370       66.25134 
1 1 1 -12 12 2  o 134.8814 57.23151 0.3485167      5.210360      0.3485167      5.210360      0.000000       0.000000  134.8814 57.23151 ?        ?        0.000000       57.23151 
1 1 1 -12 12 3  o 882.7784 20.58587 151.9250       7.057467      153.3324       8.761642      149.3248       11.90930  885.9257 25.46597 871.8756 35.17255 14.05005       43.42377 
1 1 1 -12 12 4  o 599.3878 21.21948 70.06638       4.939360      68.26419       6.827753      72.04508       7.154302  589.6238 29.91575 605.6382 30.51568 -16.01447      42.73358 
1 1 1 -12 12 5  o 153.6737 55.00468 4.084849       4.161106      4.792137       5.861307      3.366160       5.908361  173.4108 64.75913 162.8633 63.94527 10.54747       91.00957 
1 1 1 -12 12 6  o 275.3802 48.90540 15.50559       5.038601      20.08493       9.138184      13.50524       6.039642  306.6367 76.88058 253.8976 61.82874 52.73914       98.65807 
1 1 1 -12 12 7  f 486.1575 29.93351 46.50277       5.624013      45.45052       10.12596      46.97216       6.763046  472.9026 56.23893 487.2010 35.99918 -14.29849      66.77393 
1 1 1 -12 12 8  o 165.2898 58.22760 4.925048       4.645277      2.338577       7.165943      6.799700       6.100702  167.1554 68.71230 191.1670 66.76881 -24.01157      95.80946 
1 1 1 -12 12 9  o 1265.922 17.68424 312.3144       8.694036      310.9768       12.50476      313.5660       12.09588  1260.725 25.54035 1266.309 24.59630 -5.584229      35.45825 
1 1 1 -12 12 10 o 1383.630 17.69471 373.1820       9.508053      367.8110       13.63506      378.2657       13.26539  1370.737 25.61386 1390.532 24.56468 -19.79480      35.48933 
1 1 1 -12 12 11 o 834.7957 20.29520 136.0672       6.579630      146.8975       10.10071      128.0844       8.671872  864.5406 30.08422 808.0420 27.63446 56.49860       40.85001 
1 1 1 -12 12 12 o 509.5373 29.63839 51.23807       5.839535      44.46255       8.937433      56.28522       7.713736  467.5465 49.99711 531.5817 37.60788 -64.03522      62.56248 
1 1 1 -12 12 13 o 111.9706 51.92577 -4.148181      5.388425      -0.7341155     8.310998      -6.624053      7.077522  159.5198 69.96635 123.1903 57.90263 36.32954       90.81853 
1 1 1 -12 12 14 o 456.5514 35.08460 41.61373       6.173034      54.60486       9.438805      31.90406       8.160107  517.7964 47.46692 391.3621 55.22422 126.4343       72.82048 
1 1 1 -12 12 15 o 581.7234 30.51524 67.11954       6.869792      79.84094       10.56254      57.79309       9.043974  627.9467 43.58278 533.5917 44.03722 94.35498       61.95753 
1 1 1 -12 12 16 o 445.8824 38.78769 40.15179       6.649576      27.51252       9.310648      53.31053       9.500054  352.9584 70.39347 508.9082 48.66148 -155.9497      85.57558 
1 1 1 -12 12 17 o 296.8858 59.52335 19.07825       6.623936      23.50196       9.934824      15.53790       8.887716  318.5144 80.32894 260.2333 80.09675 58.28116       113.4382 
1 1 1 -12 12 18 o 589.5522 33.55777 69.70298       7.651445      74.19134       11.54708      66.18958       10.21628  596.7968 50.29024 566.0096 46.89982 30.78717       68.76555 
1 1 1 -12 12 19 o 194.0634 71.48641 7.664751       7.095359      -8.879098      10.58242      21.17606       9.563474  145.9706 69.26508 296.5979 80.82281 -150.6273      106.4424 
1 1 1 -12 12 20 o 317.3863 85.79648 25.59067       10.82777      27.65273       13.95953      22.47637       17.15541  314.6617 100.8805 279.6822 109.2045 34.97949       148.6691 
1 1 1 -12 12 21 o 530.0084 45.32898 59.70781       9.240355      88.43681       15.41908      43.60819       11.54266  618.7999 65.14068 425.7198 72.40858 193.0801       97.39769 
1 1 1 -12 12 22 o 123.2438 58.50393 -5.642508      7.564165      -6.044830      10.58642      -5.222871      10.81183  144.9943 68.94019 148.5681 70.35656 -3.573807      98.50277 
1 1 1 -12 12 23 o 147.1057 66.11086 1.125016       7.884926      -6.122539      11.22365      8.187820       11.07968  144.4882 69.31734 188.5641 81.77174 -44.07590      107.1985 
1 1 1 -12 12 24 o 146.4424 67.63488 0.5338752      9.005512      6.994725       16.95098      -2.006751      10.62969  184.3940 87.54576 146.6335 69.53317 37.76044       111.7995 
1 1 1 -12 12 25 o 215.9253 73.76754 14.92231       7.429807      15.14667       10.38824      14.68735       10.63062  200.3286 82.58458 197.2720 82.61574 3.056549       116.8143 
1 1 1 -12 12 26 o 210.2085 77.62481 17.05774       8.375047      9.979250       10.16259      32.04094       14.78552  166.1231 74.81837 225.3950 96.04551 -59.27188      121.7478 
1 1 1 -12 12 27 o 149.1129 69.51088 8.078053       9.855129      8.078053       9.855129      0.000000       0.000000  149.1129 69.51088 ?        ?        0.000000       69.51088 
1 1 1 -12 12 28 o 139.2284 61.44799 6.858727       6.502751      9.852565       9.728204      4.440550       8.743039  145.5748 68.25096 130.3560 62.16721 15.21878       92.31985 
1 1 1 -12 13 1  o 481.6752 26.36958 45.45345       4.913979      47.48027       5.840606      40.54229       9.091632  491.5584 30.74991 448.6012 53.22419 42.95721       61.46846 
1 1 1 -12 13 2  o 718.5088 24.18623 100.7667       6.748825      100.7667       6.748825      0.000000       0.000000  718.5088 24.18623 ?        ?        0.000000       24.18623 
1 1 1 -12 13 3  o 528.2195 38.57325 55.20120       7.858061      55.20120       7.858061      0.000000       0.000000  528.2195 38.57325 ?        ?        0.000000       38.57325 
1 1 1 -12 13 4  o 665.1637 20.44898 86.25568       5.282363      84.71827       7.396297      87.85629       7.546754  657.8954 28.94873 669.9585 29.00577 -12.06311      40.98003 
1 1 1 -12 13 5  o 649.8375 20.85962 82.35329       5.264282      82.60895       7.501954      82.10529       7.388972  649.4025 29.74626 647.4880 29.38491 1.914551       41.81283 
1 1 1 -12 13 6  o 1374.039 19.75850 368.0863       10.54341      376.2196       18.36628      364.0886       12.87649  1383.593 34.18100 1365.152 24.28781 18.44067       41.93136 
1 1 1 -12 13 7  o 945.5926 20.61308 174.4248       7.569637      155.7242       12.53865      185.1488       9.495180  889.1765 36.31072 973.1416 25.12460 -83.96515      44.15556 
1 1 1 -12 13 8  o 995.9896 18.20472 193.3573       7.041524      200.5516       10.30701      187.0606       9.642598  1012.286 26.21811 977.8839 25.39094 34.40228       36.49780 
1 1 1 -12 13 9  o 808.6387 23.10522 127.8067       7.255923      141.4881       13.84652      122.6276       8.519312  843.3254 42.41363 790.9466 27.73508 52.37878       50.67692 
1 1 1 -12 13 10 o 168.4642 60.55870 5.037653       5.048993      4.204275       7.665460      5.676268       6.710217  181.7451 72.36396 184.9353 69.24548 -3.190262      100.1573 
1 1 1 -12 13 11 o 243.7721 55.94714 12.51482       5.184311      8.888722       8.122483      15.00752       6.734487  215.3989 76.87564 264.7066 65.79559 -49.30775      101.1876 
1 1 1 -12 13 12 o 357.5650 40.04190 25.76281       5.464844      34.64112       8.799408      20.18842       6.972478  408.4159 57.03449 308.8898 60.28793 99.52612       82.99137 
1 1 1 -12 13 13 o 459.0586 33.72006 41.96126       5.969452      42.05417       8.924360      41.88603       8.030390  452.1670 51.75395 453.7897 46.21225 -1.622772      69.38331 
1 1 1 -12 13 14 o 710.7920 25.45810 99.34650       7.027429      116.3030       10.65602      86.29612       9.348434  764.3497 35.89839 657.0643 36.78333 107.2854       51.39755 
1 1 1 -12 13 15 o 647.6509 28.34379 82.83461       7.128972      75.72906       10.38388      89.16973       9.804797  610.6596 44.08204 666.5286 38.03610 -55.86896      58.22346 
1 1 1 -12 13 16 o 723.5168 26.40050 103.2685       7.418034      97.47887       10.82587      108.3928       10.18482  694.6935 40.30063 736.5298 35.60697 -41.83630      53.77729 
1 1 1 -12 13 17 o 590.2316 32.72087 69.66708       7.470887      64.37473       10.67397      74.74950       10.46013  556.7564 49.89592 603.8514 44.92609 -47.09503      67.14132 
1 1 1 -12 13 18 o 258.3077 69.31428 15.24835       7.098039      14.85954       10.61946      15.56234       9.542904  250.9617 88.06702 256.0208 83.52452 -5.059021      121.3760 
1 1 1 -12 13 19 o 151.3180 69.91336 -4.048851      9.636050      -17.57764      13.17465      11.51390       14.13035  145.2058 70.92503 233.7318 96.33169 -88.52597      119.6251 
1 1 1 -12 13 20 o 279.0273 86.99708 20.60983       10.44680      11.23616       13.84022      33.02245       15.92648  224.8881 94.22826 328.1333 107.9445 -103.2452      143.2864 
1 1 1 -12 13 21 o 137.2184 63.75345 -3.281598      8.180593      -0.1976990     13.73333      -4.977661      10.18467  179.3039 83.06143 146.7232 69.11718 32.58070       108.0573 
1 1 1 -12 13 22 f 291.5119 69.28130 21.64845       7.727785      23.13864       11.07542      20.23468       10.78773  274.2047 90.00719 256.9261 88.84035 17.27869       126.4670 
1 1 1 -12 13 23 o 127.2447 61.04076 -5.892834      8.700152      -27.66150      15.43427      4.245539       10.53305  130.9947 65.98454 168.3516 75.96346 -37.35692      100.6201 
1 1 1 -12 13 24 o 158.9074 70.42250 4.981809       8.627223      -0.8739833     15.12549      7.805499       10.50328  160.7670 77.94868 173.7634 77.32064 -12.99641      109.7929 
1 1 1 -12 13 25 o 284.4747 76.95501 26.32225       8.707427      25.73186       10.38107      27.72341       15.99243  254.1414 87.19117 214.6967 95.47803 39.44464       129.2995 
1 1 1 -12 13 26 o 126.5191 60.12604 0.2512683      8.033137      -6.377349      9.532675      16.49058       14.92063  117.4413 57.94992 170.8950 81.42083 -53.45367      99.93771 
1 1 1 -12 13 27 o 116.5188 57.63637 -4.274693      9.634149      -4.274693      9.634149      0.000000       0.000000  116.5188 57.63637 ?        ?        0.000000       57.63637 
1 1 1 -12 14 1  o 700.2383 20.53938 95.56758       5.585490      96.29667       6.671156      93.85821       10.21477  702.3578 24.45765 689.7551 38.28382 12.60272       45.42937 
1 1 1 -12 14 2  o 265.8870 55.85881 14.61566       5.584503      14.61566       5.584503      0.000000       0.000000  265.8870 55.85881 ?        ?        0.000000       55.85881 
1 1 1 -12 14 3  f 631.8928 22.92604 77.92012       5.626009      85.18655       6.669786      59.99930       10.47443  660.2281 26.01297 547.3524 49.82133 112.8757       56.20356 
1 1 1 -12 14 4  o 850.2056 18.29402 140.8264       6.040338      155.2569       8.820271      128.0816       8.289105  891.3198 25.48123 809.3806 26.37102 81.93921       36.67048 
1 1 1 -12 14 5  o 748.9298 22.57344 109.4893       6.565485      108.3199       7.972827      111.9530       11.57237  743.9524 27.59556 752.1622 39.75834 -8.209839      48.39670 
1 1 1 -12 14 6  o 171.7111 60.69055 5.309633       5.050602      1.329391       8.229441      7.714704       6.397047  171.2081 72.24507 200.5045 68.44912 -29.29636      99.52202 
1 1 1 -12 14 7  o 181.3970 62.44612 6.200182       5.327059      10.76503       9.985938      4.384417       6.298042  238.0639 85.20991 173.0612 66.55589 65.00278       108.1222 
1 1 1 -12 14 8  o 766.3369 20.35775 114.6294       6.058672      115.9785       8.805695      113.4166       8.349045  768.6442 29.49920 760.4433 28.27105 8.200928       40.85897 
1 1 1 -12 14 9  f 896.0209 19.97479 156.7436       6.950697      160.7421       10.12930      153.1855       9.555331  904.7311 28.82915 883.5402 27.84784 21.19092       40.08269 
1 1 1 -12 14 10 o 606.2809 26.36273 72.11124       6.207151      56.57685       9.258533      84.79398       8.365687  529.9641 45.42400 654.7556 33.00606 -124.7915      56.14927 
1 1 1 -12 14 11 o 545.3125 32.89433 58.95274       6.933568      44.79688       13.27722      64.26070       8.130226  453.7867 78.16107 567.8704 37.06931 -114.0837      86.50600 
1 1 1 -12 14 12 o 689.4338 24.89605 93.30186       6.665781      78.53398       9.772608      106.1501       9.115351  625.8403 40.42468 732.7893 32.03069 -106.9490      51.57635 
1 1 1 -12 14 13 o 349.8098 43.84581 24.96710       5.825598      20.47486       8.986615      28.22320       7.650914  302.7612 76.42323 367.3181 55.35278 -64.55692      94.36334 
1 1 1 -12 14 14 o 266.0986 60.28224 15.27804       6.085236      25.23740       9.195720      7.519003       8.116594  337.7624 72.28785 202.4092 76.08464 135.3532       104.9495 
1 1 1 -12 14 15 o 507.8811 34.66710 51.63528       6.796809      57.36350       10.34900      47.29043       9.013140  526.3853 51.27623 478.7614 49.17485 47.62393       71.04519 
1 1 1 -12 14 16 o 768.3589 26.55746 116.6038       7.924624      116.8279       11.89655      116.4250       10.62513  759.7316 40.46699 762.4804 35.88209 -2.748779      54.08421 
1 1 1 -12 14 17 o 296.9490 63.53487 19.56060       7.105452      10.81842       10.81367      26.20293       9.425919  227.8721 87.31103 338.1377 73.84800 -110.2656      114.3536 
1 1 1 -12 14 18 o 288.8013 67.90832 19.14530       7.488365      24.23515       12.99913      16.61730       9.161169  303.0348 97.36902 261.7090 81.44713 41.32587       126.9424 
1 1 1 -12 14 19 o 464.7826 56.62086 47.45071       10.00887      50.34105       14.05910      44.48041       14.25224  450.7117 83.39280 413.9434 91.12536 36.76828       123.5240 
1 1 1 -12 14 20 o 465.5432 58.36506 48.97265       10.32022      31.97069       13.92328      69.70313       15.37435  326.3231 100.2204 530.9760 76.78810 -204.6530      126.2559 
1 1 1 -12 14 21 o 157.5835 72.21053 -0.2962576     9.987314      0.000000       0.000000      -0.2962576     9.987314  ?        ?        157.5835 72.21053 0.000000       72.21053 
1 1 1 -12 14 22 o 148.8346 65.16938 2.499821       7.183523      5.535272       10.43597      -0.2335203     9.903035  175.6982 77.67865 152.9464 70.73929 22.75188       105.0620 
1 1 1 -12 14 23 o 373.9439 63.83784 35.90043       8.937923      30.43294       16.30688      38.24835       10.68608  253.0004 103.7864 364.8285 77.79756 -111.8280      129.7076 
1 1 1 -12 14 24 o 177.2711 69.96429 9.428848       7.107388      7.821734       9.808265      11.20579       10.31349  168.2301 74.79512 182.0366 78.91738 -13.80647      108.7302 
1 1 1 -12 14 25 o 173.0594 72.89954 10.82348       8.355780      7.084079       9.976110      19.61299       15.29477  156.1571 71.78240 184.9060 86.32977 -28.74893      112.2744 
1 1 1 -12 14 26 o 112.6937 54.89294 -3.493064      7.738872      1.695012       9.175424      -16.28059      14.40510  131.1111 62.83994 119.2965 60.50963 11.81461       87.23688 
1 1 1 -12 14 27 o 78.55089 39.96333 -17.24503      6.630550      -9.962475      9.811543      -23.36660      8.995535  106.5068 53.51188 87.11237 44.51316 19.39443       69.60562 
1 1 1 -12 15 1  o 964.9327 18.31153 181.3872       6.861982      189.8264       8.365007      164.0246       11.99846  986.4480 21.83555 914.0177 33.80206 72.43030       40.24140 
1 1 1 -12 15 2  o 389.9297 39.67386 30.28340       5.924159      30.28340       5.924159      0.000000       0.000000  389.9297 39.67386 ?        ?        0.000000       39.67386 
1 1 1 -12 15 3  o 665.8191 22.42735 86.53329       5.799122      95.07312       7.029229      68.33376       10.26155  697.2827 25.95797 585.2844 45.50358 111.9983       52.38695 
1 1 1 -12 15 4  o 504.7432 27.84951 50.03633       5.437914      57.32042       6.538956      33.70232       9.791907  539.5520 31.34169 403.1342 64.73536 136.4178       71.92335 
1 1 1 -12 15 5  o 322.7264 39.46660 20.87458       4.843364      17.90973       6.780633      23.96310       6.920614  292.3564 61.66188 341.8926 53.90874 -49.53625      81.90445 
1 1 1 -12 15 6  f 1029.579 21.29198 206.9736       8.513412      213.6142       14.34892      203.3660       10.57605  1040.879 35.49694 1018.953 26.72644 21.92603       44.43349 
1 1 1 -12 15 7  o 353.9338 43.88078 25.28288       5.902140      20.83654       7.440358      32.82973       9.693391  314.5871 63.09645 395.9652 65.31386 -81.37805      90.81333 
1 1 1 -12 15 8  o 624.3241 24.00638 76.29568       5.820560      73.06567       8.412045      79.26257       8.062129  606.9941 35.84429 633.3203 32.89244 -26.32617      48.64901 
1 1 1 -12 15 9  o 302.1341 43.66778 18.57260       4.975097      29.62591       7.476912      9.790455       6.664637  379.8708 52.05151 217.4212 69.70428 162.4495       86.99452 
1 1 1 -12 15 10 o 917.1339 20.45855 164.4344       7.286778      165.3071       10.61271      163.6560       10.02270  916.1044 29.83002 912.1672 28.29321 3.937195       41.11370 
1 1 1 -12 15 11 o 390.2806 37.74266 30.56866       5.649122      40.40750       8.424125      22.52881       7.615122  444.3432 49.66748 325.1698 62.57437 119.1734       79.88998 
1 1 1 -12 15 12 o 189.0882 69.77185 6.493926       6.763637      10.54674       13.80835      5.214612       7.758044  244.9727 97.25427 186.2413 73.22628 58.73145       121.7394 
1 1 1 -12 15 13 o 168.3596 64.94744 4.447578       6.011446      7.092272       9.742663      2.821698       7.638962  208.2744 82.00532 170.3608 70.57562 37.91365       108.1933 
1 1 1 -12 15 14 o 503.6037 34.80729 50.75160       6.765718      61.94684       10.35155      42.40255       8.939378  548.9141 49.07698 451.9565 51.87066 96.95758       71.40809 
1 1 1 -12 15 15 o 180.3446 67.31081 5.937616       6.330571      0.5689092      9.694442      9.928948       8.358857  173.4367 75.83041 218.0774 77.96976 -44.64073      108.7637 
1 1 1 -12 15 16 o 481.3240 40.01067 47.17829       7.411178      49.53222       11.24114      45.36844       9.856753  478.4972 61.94685 461.9026 56.09996 16.59457       83.57402 
1 1 1 -12 15 17 o 277.0387 66.55013 17.48592       7.070467      22.37476       10.86987      13.90037       9.308926  299.4567 87.78632 242.4418 82.57201 57.01492       120.5179 
1 1 1 -12 15 18 o 97.04311 48.35620 -16.51708      7.284596      -14.97975      12.27622      -17.35259      9.050149  142.6346 69.40173 112.3996 55.64557 30.23506       88.95522 
1 1 1 -12 15 19 o 181.8415 77.03351 5.099866       9.415531      -3.554160      12.32306      17.23802       14.59438  166.2428 77.57398 247.6712 99.42699 -81.42842      126.1089 
1 1 1 -12 15 20 o 164.3904 68.89580 4.319704       7.401702      14.81840       11.29970      -3.570407      9.795819  229.6127 88.91304 147.1308 68.82317 82.48193       112.4373 
1 1 1 -12 15 21 o 134.4671 61.29485 -0.7808081     7.073544      12.76874       10.44117      -12.27483      9.616625  211.6082 84.39211 121.5488 59.62467 90.05943       103.3302 
1 1 1 -12 15 22 o 108.2144 52.75426 -8.461141      7.189399      -3.589839      10.54714      -12.68893      9.825829  143.6974 68.46088 119.4783 58.93249 24.21901       90.33233 
1 1 1 -12 15 23 o 117.4031 57.21027 -7.495687      8.430573      -21.38134      14.59119      -0.5371536     10.32920  128.6357 64.71498 145.2406 68.77716 -16.60493      94.43689 
1 1 1 -12 15 24 o 161.6378 69.56371 7.685811       7.896486      10.41635       9.238235      0.2800996      15.21418  173.6308 74.98173 152.2030 74.72924 21.42781       105.8618 
1 1 1 -12 15 25 o 112.2118 54.53910 -4.032147      7.526308      -2.376611      8.849472      -8.360140      14.30841  122.7224 59.53017 130.3340 65.36378 -7.611626      88.40965 
1 1 1 -12 15 26 o 155.0921 69.98810 10.35299       8.943949      22.62720       12.41956      -2.870586      12.89091  182.8269 82.49138 127.8151 63.79086 55.01180       104.2790 
1 1 1 -12 16 1  f 305.0064 43.52170 18.78163       5.008971      20.66296       5.893652      13.88785       9.505479  318.6163 49.21680 258.8080 83.27367 59.80832       96.73055 
1 1 1 -12 16 2  o 500.0245 32.11392 49.30584       6.203113      49.30584       6.203113      0.000000       0.000000  500.0245 32.11392 ?        ?        0.000000       32.11392 
1 1 1 -12 16 3  o 177.2955 60.21901 5.984723       4.950959      8.760380       5.927378      -0.4206724     9.004355  207.7227 65.64549 169.3683 73.58212 38.35439       98.60862 
1 1 1 -12 16 4  o 561.1161 31.33447 62.05428       6.800877      51.56511       8.682400      78.70750       10.94003  507.4247 44.50923 627.3873 45.20375 -119.9627      63.43855 
1 1 1 -12 16 5  o 255.7611 55.14806 13.66069       5.316469      12.55727       6.405657      16.10342       9.530863  243.4220 66.06945 273.5700 82.69670 -30.14806      105.8485 
1 1 1 -12 16 6  o 186.0947 63.31621 6.696171       5.473427      5.185611       9.594753      7.424888       6.664141  201.0789 80.65450 198.2062 69.75086 2.872726       106.6318 
1 1 1 -12 16 7  o 839.8730 19.93005 137.7491       6.500547      142.2333       9.261321      133.3946       9.126487  851.0859 28.02022 824.0534 28.51808 27.03247       39.98017 
1 1 1 -12 16 8  o 735.3810 25.70118 106.0647       7.339956      112.8286       9.255175      94.59944       12.04977  756.5770 31.49949 685.8889 45.49554 70.68811       55.33590 
1 1 1 -12 16 9  o 115.9490 53.26810 -3.537906      5.482596      -6.559658      7.981090      -0.8377481     7.544446  133.4085 62.31179 151.8732 66.63586 -18.46461      91.23101 
1 1 1 -12 16 10 o 105.0070 49.74232 -5.943696      5.412229      -7.414349      8.008715      -4.707483      7.342677  130.6041 61.45291 132.9159 61.27696 -2.311829      86.78321 
1 1 1 -12 16 11 o 132.6660 58.17361 -0.7337928     5.742328      3.143263       8.777160      -3.635090      7.592750  181.5914 75.47421 139.4760 63.54959 42.11540       98.66563 
1 1 1 -12 16 12 o 263.0048 60.33538 14.89036       6.031637      14.07879       8.848069      15.59489       8.243980  252.3833 80.25183 264.5571 76.13600 -12.17375      110.6212 
1 1 1 -12 16 13 o 143.6176 62.17883 0.1354289      6.385374      -4.031431      9.563906      3.486734       8.577046  155.6750 71.08248 180.4608 74.77364 -24.78581      103.1689 
1 1 1 -12 16 14 o 325.9258 112.4855 27.58233       17.29033      27.58233       17.29033      0.000000       0.000000  325.9258 112.4855 ?        ?        0.000000       112.4855 
1 1 1 -12 16 15 o 256.8698 65.45568 14.75784       6.548462      15.78495       10.18303      14.03355       8.551111  259.1781 86.36448 247.0332 78.93004 12.14488       116.9990 
1 1 1 -12 16 16 o 92.10159 46.16110 -18.51845      7.082098      -38.51540      12.34234      -8.702475      8.647335  111.4795 56.48701 129.6396 61.82570 -18.16013      83.74484 
1 1 1 -12 16 17 o 260.9709 71.74059 16.20484       7.496328      27.70854       13.09906      10.60256       9.141212  319.2778 97.04627 216.5089 80.86955 102.7689       126.3244 
1 1 1 -12 16 18 o 240.5947 81.89252 14.84071       9.156292      10.83608       12.34886      19.73082       13.64599  218.6932 90.08482 262.2491 98.63878 -43.55595      133.5847 
1 1 1 -12 16 19 o 205.8357 80.59592 10.32006       9.364371      4.619665       13.01983      16.42918       13.47852  190.3851 85.29968 237.7524 95.51324 -47.36728      128.0579 
1 1 1 -12 16 20 o 121.7626 57.15460 -3.801403      6.856591      3.596786       9.908781      -10.59840      9.497648  169.7345 75.33412 124.8520 60.81440 44.88246       96.81746 
1 1 1 -12 16 21 o 236.2405 71.97973 15.43257       7.199825      21.87712       10.43321      9.573189       9.948274  260.2695 87.42219 190.0615 79.77496 70.20802       118.3498 
1 1 1 -12 16 22 o 168.2722 71.50952 6.973702       8.155698      -17.05772      15.77507      15.74020       9.527842  140.1418 70.03807 215.4721 82.09901 -75.33022      107.9147 
1 1 1 -12 16 23 o 108.1747 52.32166 -5.322229      6.711561      -7.259754      9.723686      -3.559258      9.275341  123.1054 60.29895 129.0350 62.18742 -5.929588      86.62123 
1 1 1 -12 16 24 o 127.0246 61.40690 -2.124407      9.214517      2.097741       12.34959      -7.427144      13.83999  145.1128 70.37588 133.1073 66.37856 12.00545       96.74129 
1 1 1 -12 16 25 o 132.3488 62.99098 2.472644       8.882105      2.243155       11.94147      2.756833       13.28864  137.3753 67.18945 139.9669 68.94089 -2.591614      96.26665 
1 1 1 -12 17 1  o 655.2504 27.26964 84.10796       6.939285      84.10796       6.939285      0.000000       0.000000  655.2504 27.26964 ?        ?        0.000000       27.26964 
1 1 1 -12 17 2  o 177.4433 66.25819 5.151734       6.135493      5.151734       6.135493      0.000000       0.000000  177.4433 66.25819 ?        ?        0.000000       66.25819 
1 1 1 -12 17 3  o 416.3285 33.83309 34.36256       5.422913      36.05729       6.471225      30.36550       9.938192  424.9386 39.67205 378.6973 70.15887 46.24133       80.59863 
1 1 1 -12 17 4  o 576.7163 26.16982 65.17184       5.861259      73.79405       7.048218      45.84077       10.55354  612.9065 29.61127 472.0056 58.85207 140.9009       65.88167 
1 1 1 -12 17 5  o 208.5910 69.06509 8.760390       6.515943      5.916307       8.407081      13.03914       10.31175  197.3963 76.62151 252.0995 86.87612 -54.70320      115.8375 
1 1 1 -12 17 6  o 489.7299 32.54432 47.48845       6.154326      48.85250       11.28280      46.91071       7.342871  485.2954 61.22910 484.5746 39.35921 0.7207336      72.78839 
1 1 1 -12 17 7  o 571.6877 26.81447 64.16324       5.953277      68.12853       8.418017      60.19570       8.420393  585.0223 37.24561 548.8157 39.77732 36.20660       54.49285 
1 1 1 -12 17 8  o 300.4408 48.17064 18.58331       5.430522      18.12105       7.846082      19.00838       7.523884  288.7452 70.56691 297.1405 66.82181 -8.395294      97.18458 
1 1 1 -12 17 9  o 189.1036 64.08447 7.099115       5.606841      10.42016       8.021768      3.926955       7.839900  224.9456 76.65087 179.6373 72.60543 45.30832       105.5789 
1 1 1 -12 17 10 o 413.5496 43.70280 34.69910       6.912505      41.54366       8.898258      24.28220       10.97745  449.1043 51.97945 326.5385 85.54134 122.5658       100.0959 
1 1 1 -12 17 11 o 300.6544 54.18127 19.02761       6.093524      20.34950       9.478779      18.09652       7.955157  300.0254 79.91859 285.9797 71.74841 14.04568       107.4003 
1 1 1 -12 17 12 o 327.2545 50.34476 22.33299       6.193293      16.52166       9.114526      27.31770       8.441427  269.6575 80.72602 356.0934 63.36366 -86.43585      102.6238 
1 1 1 -12 17 13 o 214.3373 67.37740 9.975429       6.251787      23.35988       9.146355      -1.761562      8.564976  321.1133 74.74379 154.6391 69.24128 166.4742       101.8871 
1 1 1 -12 17 14 o 119.4366 55.80474 -4.965642      6.409817      3.831503       9.402477      -12.60366      8.761163  184.8963 77.57870 121.6725 59.06943 63.22385       97.50719 
1 1 1 -12 17 15 o 227.1765 72.20656 11.82688       7.163521      13.74945       12.71986      10.93387       8.669006  244.6011 94.44190 221.3482 79.37508 23.25294       123.3680 
1 1 1 -12 17 16 o 375.9676 66.94557 32.31520       9.416320      0.000000       0.000000      32.31520       9.416320  ?        ?        375.9676 66.94557 0.000000       66.94557 
1 1 1 -12 17 17 o 265.4239 70.44670 17.05131       7.382262      23.53770       12.55484      13.62354       9.126747  288.0978 95.89140 232.6416 81.64291 55.45628       125.9394 
1 1 1 -12 17 18 o 187.8102 76.95951 7.153387       8.954082      7.102967       11.95133      7.217901       13.51906  196.7985 85.13490 201.5757 88.80085 -4.777283      123.0185 
1 1 1 -12 17 19 o 167.3409 67.61160 5.579750       6.795932      0.6876122      9.823586      10.07001       9.411454  159.2970 72.46618 200.0391 80.00651 -40.74219      107.9462 
1 1 1 -12 17 20 o 410.4540 44.79430 37.28884       7.024354      31.87308       10.37746      41.86847       9.542812  335.4952 80.64542 414.8961 61.05085 -79.40088      101.1479 
1 1 1 -12 17 21 o 133.1876 60.62374 0.3284461      6.887825      1.584479       10.31972      -0.6806026     9.249613  154.9214 71.84956 143.1374 66.93030 11.78401       98.19381 
1 1 1 -12 17 22 o 114.1076 55.52946 -6.697838      7.866670      -24.34858      14.41237      0.7923338      9.388581  122.9643 62.16050 143.0457 67.06007 -20.08147      91.43840 
1 1 1 -12 17 23 o 154.9706 70.29906 6.518144       9.161825      3.831783       12.39673      9.751457       13.60031  151.5947 72.75929 165.8564 78.64938 -14.26166      107.1431 
1 1 1 -12 17 24 o 91.80589 46.20818 -14.05671      7.487794      -16.03706      8.954532      -9.452727      13.65334  98.44301 49.67242 126.3442 63.43011 -27.90120      80.56505 
1 1 1 -12 17 25 o 163.2070 68.29430 10.77673       7.256141      9.955513       8.705283      12.64606       13.13401  154.2544 69.38084 154.3328 74.28372 -0.7841492E-01 101.6453 
1 1 1 -12 18 1  o 179.2717 66.95996 5.283891       6.267023      5.283891       6.267023      0.000000       0.000000  179.2717 66.95996 ?        ?        0.000000       66.95996 
1 1 1 -12 18 2  o 469.1633 36.55494 43.73486       6.607798      43.73486       6.607798      0.000000       0.000000  469.1633 36.55494 ?        ?        0.000000       36.55494 
1 1 1 -12 18 3  f 694.9804 23.61556 94.49563       6.373805      96.13399       7.623060      90.68913       11.61949  699.9033 28.04551 672.9908 44.71245 26.91254       52.78024 
1 1 1 -12 18 4  o 340.6568 43.61909 23.48023       5.638081      34.44085       6.777331      -1.152792      10.16015  413.8114 42.79046 175.0140 77.04605 238.7975       88.13125 
1 1 1 -12 18 5  o 447.5896 40.90726 40.16319       7.032024      36.22505       9.087362      46.04105       11.10203  418.5827 57.41488 470.3165 62.31794 -51.73386      84.73485 
1 1 1 -12 18 6  o 175.8228 67.11706 4.871646       6.375166      3.366969       8.047864      7.406497       10.44564  178.7338 73.06847 217.0024 85.07942 -38.26860      112.1495 
1 1 1 -12 18 7  o 485.6239 44.26284 47.60037       8.256021      47.60037       8.256021      0.000000       0.000000  485.6239 44.26284 ?        ?        0.000000       44.26284 
1 1 1 -12 18 8  o 450.9979 34.24170 40.50993       5.952553      55.34642       8.792026      27.95346       8.088301  523.7285 43.62372 364.7711 59.11989 158.9573       73.47238 
1 1 1 -12 18 9  o 200.2282 64.59100 8.316628       5.715981      1.537702       8.512724      13.88239       7.713480  171.2492 72.92283 251.5382 74.01059 -80.28902      103.9005 
1 1 1 -12 18 10 o 442.4999 36.47062 39.26925       6.211525      51.97235       9.305788      29.06143       8.341892  503.8815 48.14085 370.0516 60.10899 133.8300       77.01059 
1 1 1 -12 18 11 f 260.6475 61.27421 14.76591       6.097850      7.788394       9.085155      20.48619       8.226032  207.9454 79.94547 303.3664 71.06779 -95.42096      106.9669 
1 1 1 -12 18 12 o 303.4266 62.54252 20.11846       7.124807      14.38475       9.091562      29.24441       11.46990  251.1842 81.50490 352.8689 84.76062 -101.6847      117.5900 
1 1 1 -12 18 13 o 214.0914 71.82928 10.05416       7.043243      6.285643       12.16490      11.95444       8.638400  210.4509 88.26845 230.7791 79.51611 -20.32817      118.8029 
1 1 1 -12 18 14 o 267.1917 69.41360 16.49678       7.267782      23.16227       12.00067      12.63610       9.133158  300.3080 93.17917 233.2580 81.68210 67.04997       123.9126 
1 1 1 -12 18 15 o 444.3766 44.33138 41.35295       7.548398      53.51926       12.91488      35.04041       9.302781  480.5943 71.36359 395.0204 62.73833 85.57388       95.02031 
1 1 1 -12 18 16 o 423.5344 47.04905 38.33155       7.607910      52.19743       13.00707      31.12099       9.379727  466.0292 74.36848 363.0927 69.04221 102.9366       101.4766 
1 1 1 -12 18 17 o 200.2210 78.65461 9.297575       8.943630      0.000000       0.000000      9.297575       8.943630  ?        ?        200.2210 78.65461 0.000000       78.65461 
1 1 1 -12 18 18 o 295.8998 84.58321 24.80015       10.20671      28.65073       17.00070      22.63002       12.76282  275.0305 108.3151 264.6118 96.11681 10.41870       144.8123 
1 1 1 -12 18 19 o 153.4595 64.63610 3.957279       6.567646      11.84794       9.612581      -2.951002      8.994322  204.6458 81.17592 139.2623 65.39827 65.38354       104.2423 
1 1 1 -12 18 20 o 155.6221 64.91222 4.985750       6.525598      -0.5062631     9.238341      10.45463       9.218866  144.4765 67.33318 190.1054 78.01643 -45.62886      103.0549 
1 1 1 -12 18 21 o 138.7807 65.80168 -1.270107      9.513969      0.000000       0.000000      -1.270107      9.513969  ?        ?        138.7807 65.80168 0.000000       65.80168 
1 1 1 -12 18 22 o 186.9390 77.65417 13.26833       9.284226      0.000000       0.000000      13.26833       9.284226  ?        ?        186.9390 77.65417 0.000000       77.65417 
1 1 1 -12 18 23 f 262.5623 73.27338 23.36073       7.755624      25.51927       9.277387      18.35167       14.13264  251.7651 82.36497 178.6879 83.27844 73.07724       117.1294 
1 1 1 -12 18 24 o 175.9158 70.47002 12.44346       7.314260      12.86439       8.885452      11.55873       12.88195  169.3145 73.32618 155.7924 74.61359 13.52213       104.6132 
1 1 1 -12 19 1  o 460.4397 47.49695 42.83376       8.371134      42.83376       8.371134      0.000000       0.000000  460.4397 47.49695 ?        ?        0.000000       47.49695 
1 1 1 -12 19 2  o 954.4694 23.00194 178.2136       8.526178      190.2868       11.04170      160.3832       13.41851  984.1745 28.88923 899.5433 38.41088 84.63116       48.06228 
1 1 1 -12 19 3  o 572.3290 31.23834 64.69394       6.916981      69.66486       9.189809      58.19722       10.50595  590.7355 40.29821 535.1653 51.17364 55.57019       65.13591 
1 1 1 -12 19 4  o 138.1723 58.88727 0.4504885      5.559652      -4.710525      6.818108      10.69167       9.604426  127.5376 58.88491 233.2590 83.55826 -105.7214      102.2224 
1 1 1 -12 19 5  o 144.6070 63.38000 -0.8092141     6.809124      -6.078279      9.331788      5.190476       9.957778  148.6246 68.71519 201.8017 81.73454 -53.17712      106.7816 
1 1 1 -12 19 6  f 180.6468 69.09588 5.242717       6.765017      14.44645       9.044715      -6.444198      10.19208  257.3830 81.06350 154.9873 71.71172 102.3958       108.2306 
1 1 1 -12 19 7  o 246.9905 62.94382 13.14964       6.055130      12.48085       7.430265      14.47194       10.44776  239.9964 73.12222 258.1938 87.47941 -18.19740      114.0154 
1 1 1 -12 19 8  o 485.6392 32.93020 46.95042       6.173929      56.11221       9.114348      39.18196       8.392731  525.6874 45.08085 436.1793 50.47897 89.50815       67.67873 
1 1 1 -12 19 9  o 249.8429 90.19799 13.38897       11.21446      13.38897       11.21446      0.000000       0.000000  249.8429 90.19799 ?        ?        0.000000       90.19799 
1 1 1 -12 19 10 o 211.3540 69.49407 9.552368       6.601362      20.89400       11.62637      4.156347       8.019421  296.0126 91.69283 179.4890 73.10800 116.5236       117.2704 
1 1 1 -12 19 11 o 322.2825 54.08711 22.12248       6.529700      20.03496       10.98257      23.26387       8.120935  288.3678 89.08387 323.6469 66.82484 -35.27908      111.3620 
1 1 1 -12 19 12 o 573.5392 33.37143 66.10895       7.400900      67.65921       12.71431      65.31448       9.101821  560.5740 59.30300 564.7079 41.79963 -4.133911      72.55380 
1 1 1 -12 19 13 o 213.1410 76.97652 10.05738       8.168832      11.72737       11.25130      8.195807       11.87920  229.6039 88.77479 213.6151 88.21252 15.98877       125.1496 
1 1 1 -12 19 14 o 142.0251 65.26919 -3.084827      8.240547      9.644198       11.50337      -16.50258      11.81048  215.6733 87.67075 136.2676 66.68410 79.40570       110.1496 
1 1 1 -12 19 15 o 242.6856 72.00600 14.43225       7.275795      14.76343       12.25958      14.25218       9.039940  237.7088 92.45467 236.6135 81.35365 1.095276       123.1515 
1 1 1 -12 19 16 o 182.9454 69.12442 7.402933       6.718805      -4.899842      10.01002      17.49002       9.063924  145.9329 68.67704 255.6482 81.21793 -109.7153      106.3621 
1 1 1 -12 19 17 o 287.5038 71.76147 21.20778       7.987195      22.88646       10.24799      18.61009       12.74816  281.7527 85.88171 243.2510 94.37124 38.50171       127.5994 
1 1 1 -12 19 18 o 356.6440 59.37023 30.52954       7.933938      20.16186       9.958884      48.54174       13.12663  256.4442 85.40653 413.3670 84.61831 -156.9228      120.2270 
1 1 1 -12 19 19 f 147.9493 65.10126 2.913819       7.246652      -4.108375      12.66257      6.333782       8.836821  151.3624 72.87526 169.8317 73.33787 -18.46931      103.3888 
1 1 1 -12 19 20 o 149.0742 66.78077 3.455079       7.976995      -5.162916      13.65047      7.924284       9.830136  147.2820 71.99285 171.8251 75.70707 -24.54317      104.4726 
1 1 1 -12 19 21 o 138.0465 62.88439 2.455468       7.429439      -2.936919      10.86373      7.193168       10.18291  136.0778 65.99699 161.9887 73.72504 -25.91095      98.94940 
1 1 1 -12 19 22 o 298.2636 105.5191 50.63670       15.27078      0.000000       0.000000      50.63670       15.27078  ?        ?        298.2636 105.5191 0.000000       105.5191 
1 1 1 -12 19 23 o 128.1185 59.80986 2.088021       7.337957      0.8768020      8.914878      4.632705       12.92174  129.3355 61.97633 144.5336 70.51803 -15.19803      93.88215 
1 1 1 -12 20 1  o 660.5499 35.98432 86.65944       9.196155      86.65944       9.196155      0.000000       0.000000  660.5499 35.98432 ?        ?        0.000000       35.98432 
1 1 1 -12 20 2  o 782.4761 25.91856 120.1612       7.876076      126.6376       10.05933      109.9015       12.66109  800.9274 32.34060 739.6519 44.28098 61.27545       54.83356 
1 1 1 -12 20 3  o 483.9480 37.89439 46.82142       7.065110      47.68277       8.899735      45.35351       11.61823  484.3126 47.94760 462.9597 66.53193 21.35281       82.00896 
1 1 1 -12 20 4  o 542.9052 47.39864 59.85826       9.893293      45.49240       15.85284      69.02232       12.66151  444.7015 94.69579 577.6901 57.18801 -132.9886      110.6244 
1 1 1 -12 20 5  o 521.9230 50.94305 55.85043       10.19405      23.70190       16.21512      76.86040       13.10849  316.0868 108.9409 609.7669 55.98058 -293.6801      122.4824 
1 1 1 -12 20 6  o 579.2090 36.00308 67.02429       8.058386      63.30790       10.12818      73.43548       13.30271  557.2643 47.24449 593.2083 58.50568 -35.94397      75.19945 
1 1 1 -12 20 7  o 398.2819 49.67574 32.80365       7.516525      33.69724       9.543930      31.34403       12.19772  396.0544 64.25203 367.8317 86.79021 28.22272       107.9855 
1 1 1 -12 20 8  o 400.6806 56.11664 33.89926       8.492547      29.43091       11.51853      39.22139       12.57090  355.5470 84.63958 414.9077 80.92297 -59.36066      117.0999 
1 1 1 -12 20 9  o 237.8708 68.40075 12.64155       6.656357      0.6053608E-01  11.18304      19.54440       8.283545  181.3068 80.27198 293.1619 73.02901 -111.8551      108.5211 
1 1 1 -12 20 10 o 297.9915 61.53945 19.56056       6.885893      8.932431       11.55602      25.41173       8.574349  220.1461 88.43981 336.7067 67.91576 -116.5606      111.5085 
1 1 1 -12 20 11 o 143.0414 62.66172 0.4415273E-01  6.648123      5.273523       11.16205      -2.830759      8.276212  198.8233 84.03124 145.3217 66.26540 53.50157       107.0157 
1 1 1 -12 20 12 o 287.5861 64.85590 18.89299       7.070721      12.72265       11.30444      22.85835       9.062252  233.6595 89.33152 308.8327 76.06057 -75.17320      117.3257 
1 1 1 -12 20 13 o 403.5400 47.24904 34.65209       7.264528      46.49722       11.98771      27.77764       9.132414  444.9454 71.82069 342.8307 70.93188 102.1147       100.9433 
1 1 1 -12 20 14 o 451.6519 57.94335 45.74171       9.928954      45.74171       9.928954      0.000000       0.000000  451.6519 57.94335 ?        ?        0.000000       57.94335 
1 1 1 -12 20 15 o 159.1677 68.14913 3.070488       7.508384      9.672133       9.718293      -6.705693      11.82629  202.8900 81.24586 152.5022 72.61098 50.38777       108.9644 
1 1 1 -12 20 16 o 136.5951 61.00013 0.2379126      6.600649      -4.958872      9.528920      5.031645       9.151942  139.7155 66.13141 173.8835 74.86161 -34.16798      99.88805 
1 1 1 -12 20 17 o 154.4456 67.19478 3.228302       7.530279      7.937082       9.444920      -4.987091      12.47551  184.0773 77.52103 153.2301 73.39714 30.84723       106.7551 
1 1 1 -12 20 18 o 172.2971 70.86221 7.266889       7.626235      -4.164934      12.67266      13.75741       9.548824  151.2923 72.85732 208.7382 81.48168 -57.44595      109.3044 
1 1 1 -12 20 19 o 230.5092 68.58488 15.31168       6.593992      18.58650       9.130533      11.74170       9.533114  232.8303 81.66261 189.7721 78.74772 43.05823       113.4460 
1 1 1 -12 20 20 o 95.11832 47.24778 -10.75804      6.734846      -11.20563      9.646126      -10.33234      9.407381  114.7776 56.93314 114.9318 56.86959 -0.1542053     80.47070 
1 1 1 -12 20 21 o 152.4858 68.03391 6.454120       8.190386      -7.420439      9.847430      37.59351       14.75259  119.4684 58.94058 248.3497 99.87090 -128.8813      115.9663 
1 1 1 -12 20 22 o 115.9671 55.27456 -1.306770      6.891831      -2.251942      8.020698      1.360001       13.47255  118.9728 57.46058 141.5082 69.64506 -22.53545      90.28927 
1 1 1 -12 21 1  o 158.9862 65.40821 2.432178       6.500015      2.432178       6.500015      0.000000       0.000000  158.9862 65.40821 ?        ?        0.000000       65.40821 
1 1 1 -12 21 2  o 423.7683 35.88411 35.96391       5.850058      30.24086       7.037842      48.75853       10.52300  383.5580 48.32005 483.5072 57.14641 -99.94922      74.83675 
1 1 1 -12 21 3  o 322.5484 49.28782 21.58427       5.977964      22.89505       7.229370      18.75013       10.63034  328.1969 58.88383 285.8176 87.53586 42.37930       105.4980 
1 1 1 -12 21 4  f 742.5309 46.36764 112.2378       13.30391      0.000000       0.000000      112.2378       13.30391  ?        ?        742.5309 46.36764 0.000000       46.36764 
1 1 1 -12 21 5  o 461.3327 42.06562 43.25148       7.453639      42.08501       9.736856      44.90259       11.58428  446.6921 57.46066 455.0130 67.61234 -8.320923      88.73080 
1 1 1 -12 21 6  o 322.6887 59.72126 22.44640       7.208476      33.13241       9.404819      7.228787       11.22318  390.8604 64.18726 213.5102 86.66905 177.3502       107.8496 
1 1 1 -12 21 7  o 347.9003 54.75025 25.74471       7.152776      28.98149       9.103468      20.52252       11.56318  362.0723 67.21627 290.7886 91.66567 71.28369       113.6689 
1 1 1 -12 21 8  o 197.5650 71.12080 8.018035       6.966117      1.250378       9.052696      17.84354       10.90777  169.8228 73.77949 271.5257 89.33285 -101.7029      115.8610 
1 1 1 -12 21 9  o 502.5395 32.44087 50.76942       6.297458      58.01070       9.634644      45.36820       8.320974  527.3391 47.55716 466.6381 46.53695 60.70105       66.53849 
1 1 1 -12 21 10 o 167.6481 64.53732 5.017653       5.926031      1.760594       8.917588      7.593478       7.930358  168.6716 73.25304 195.3192 74.78635 -26.64755      104.6853 
1 1 1 -12 21 11 o 127.7393 60.28122 -6.154098      7.809956      0.000000       0.000000      -6.154098      7.809956  ?        ?        127.7393 60.28122 0.000000       60.28122 
1 1 1 -12 21 12 o 302.5604 53.71877 20.22779       6.080787      28.00567       8.819386      13.17987       8.395339  345.3289 68.18216 230.8755 78.41661 114.4534       103.9133 
1 1 1 -12 21 13 o 623.7970 42.50276 81.98124       10.23511      81.98124       10.23511      0.000000       0.000000  623.7970 42.50276 ?        ?        0.000000       42.50276 
1 1 1 -12 21 14 o 358.1156 47.55272 28.04979       6.449892      35.36283       9.774996      22.41061       8.583720  381.6065 68.47491 295.4873 74.74708 86.11923       101.3703 
1 1 1 -12 21 15 o 270.1352 64.27499 18.00344       6.645177      6.199184       9.273229      30.46344       9.527322  178.9669 76.15753 343.2473 73.67541 -164.2805      105.9624 
1 1 1 -12 21 16 o 144.6581 63.95374 1.832729       7.073495      8.832983       8.859382      -10.47659      11.74799  187.0390 76.58681 137.4786 67.11185 49.56032       101.8309 
1 1 1 -12 21 17 o 238.3239 79.64254 17.64602       8.658502      7.339929       11.78965      29.71362       12.75747  178.9547 80.59254 280.9500 96.64172 -101.9954      125.8363 
1 1 1 -12 21 18 o 93.92198 46.41872 -9.801266      6.201733      -17.84492      8.204922      0.9187321      9.472074  96.53830 48.56215 145.9426 68.07102 -49.40425      83.61786 
1 1 1 -12 21 19 o 111.8901 52.79916 -2.284035      5.990158      -1.970734      7.692585      -2.766647      9.547501  124.5250 59.07908 131.9337 63.46019 -7.408653      86.70371 
1 1 1 -12 21 20 o 125.0162 59.77209 -1.672912      8.189842      -0.9970293     10.05826      -3.002544      14.10759  134.4724 64.79550 142.0457 70.16657 -7.573303      95.50814 
1 1 1 -12 22 1  o 119.9676 54.20010 -2.176286      5.381911      2.989166       6.466669      -13.81707      9.707726  160.8838 65.60345 128.7811 62.44179 32.10271       90.56925 
1 1 1 -12 22 2  o 405.2240 37.24476 33.15979       5.795621      30.78569       6.951144      38.57381       10.49705  385.8167 47.38873 421.1169 66.38405 -35.30023      81.56306 
1 1 1 -12 22 3  o 153.0922 62.10258 2.799855       5.758335      7.208827       7.089389      -5.749022      9.871762  193.5244 71.42759 151.4051 70.23792 42.11923       100.1762 
1 1 1 -12 22 4  o 250.5558 69.13051 14.12886       6.945922      9.057129       9.257471      20.66178       10.50673  214.1245 81.08308 294.1591 86.32867 -80.03455      118.4361 
1 1 1 -12 22 5  o 376.5749 43.02969 29.20832       6.179870      27.39967       7.204118      34.24709       12.02444  359.3144 53.23806 380.8813 83.58630 -21.56696      99.10077 
1 1 1 -12 22 6  o 232.4889 64.71933 12.13721       6.058414      15.15992       7.184014      4.693957       11.27328  257.3347 70.01975 198.3190 84.16803 59.01567       109.4853 
1 1 1 -12 22 7  o 425.3011 38.56018 36.96922       6.299643      41.50192       7.571029      26.76888       11.35751  447.4359 44.14632 328.6476 87.45153 118.7883       97.96259 
1 1 1 -12 22 8  o 133.4152 58.83151 -0.3681372     5.948134      -3.549387      7.175756      6.617924       10.63371  131.5486 60.62168 200.9309 83.25649 -69.38231      102.9885 
1 1 1 -12 22 9  o 354.1785 47.12964 26.62636       6.321594      25.47966       7.592883      29.21689       11.41242  337.8281 60.07538 339.3826 86.37189 -1.554504      105.2101 
1 1 1 -12 22 10 o 224.5497 64.48454 11.76370       5.919514      23.59176       8.695092      1.546181       8.081463  313.0396 72.88486 159.2150 69.43369 153.8246       100.6640 
1 1 1 -12 22 11 o 408.0187 40.42240 34.85386       6.320883      36.98057       9.184234      32.93997       8.712563  403.4875 60.47493 379.9512 61.11816 23.53632       85.98050 
1 1 1 -12 22 12 o 415.0164 40.71673 36.33757       6.477942      31.93218       9.247370      40.58249       9.077384  364.9298 67.74413 424.0426 56.52987 -59.11279      88.23204 
1 1 1 -12 22 13 o 591.4222 30.70431 71.48624       7.027946      61.90483       9.727449      81.94904       10.16502  532.1267 47.57296 619.4896 42.50908 -87.36285      63.79819 
1 1 1 -12 22 14 o 313.7418 54.30285 22.80688       6.376867      24.18185       8.799262      21.28597       9.254450  300.3175 75.52155 273.2796 81.23759 27.03793       110.9191 
1 1 1 -12 22 15 o 151.2630 64.70499 3.618447       6.757424      3.386327       11.05025      3.757099       8.540399  168.1099 76.62292 160.0618 70.54289 8.048065       104.1507 
1 1 1 -12 22 16 o 223.4913 70.85601 14.27818       6.901404      11.81991       8.209097      20.20363       12.74502  198.4663 76.06607 227.8877 92.40967 -29.42139      119.6896 
1 1 1 -12 22 17 o 331.5540 51.25759 26.49082       6.387049      32.36047       8.376143      18.33670       9.872486  348.8073 64.20007 224.5650 84.00985 124.2422       105.7322 
1 1 1 -12 22 18 o 98.41918 48.68594 -9.824533      6.877677      -8.350616      7.746639      -15.31084      14.94573  108.3383 53.21902 132.9129 66.67736 -24.57467      85.31199 
1 1 1 -12 22 19 o 153.0799 72.03324 5.108088       11.00722      5.108088       11.00722      0.000000       0.000000  153.0799 72.03324 ?        ?        0.000000       72.03324 
1 1 1 -12 23 1  o 239.6229 59.95803 12.66792       5.565996      9.077810       6.811430      19.88303       9.656185  205.7557 70.62490 289.1741 82.13551 -83.41846      108.3241 
1 1 1 -12 23 2  o 164.9482 62.60014 4.777398       5.525736      0.6849899      6.597533      14.39411       10.11359  146.6926 63.35693 248.3142 86.01077 -101.6216      106.8267 
1 1 1 -12 23 3  o 278.0631 65.91652 17.45663       7.009688      9.118473       9.290583      28.47626       10.68050  212.0764 81.00716 346.2064 80.89510 -134.1299      114.4822 
1 1 1 -12 23 4  o 388.4809 50.26283 31.93843       7.405257      30.14135       9.904786      34.21611       11.15083  361.5747 73.05147 381.8884 77.82787 -20.31366      106.7412 
1 1 1 -12 23 5  o 294.8356 54.47658 18.90571       6.007834      20.13270       7.125122      15.88749       11.17498  299.1721 63.30095 254.1530 90.22813 45.01913       110.2185 
1 1 1 -12 23 6  o 414.7914 39.33920 35.42760       6.261203      38.72984       7.505449      27.86991       11.35448  429.7111 45.67533 332.2489 86.97899 97.46222       98.24245 
1 1 1 -12 23 7  o 476.6833 35.31485 46.34059       6.491048      56.82850       7.777711      22.27106       11.78260  525.9108 38.34552 288.9028 92.68758 237.0080       100.3064 
1 1 1 -12 23 8  o 379.3791 44.67708 30.43693       6.456252      31.72032       7.622465      27.17871       12.14522  381.4221 52.88176 316.3553 92.80869 65.06686       106.8173 
1 1 1 -12 23 9  o 122.6122 56.25792 -2.499949      6.088881      0.4640625      7.253838      -9.569640      11.20284  146.6899 64.81232 144.2536 69.21759 2.436279       94.82464 
1 1 1 -12 23 10 o 158.4358 64.22951 4.181735       6.155329      10.07414       7.181194      -12.13609      11.95037  204.3573 72.35329 142.2577 69.04580 62.09958       100.0116 
1 1 1 -12 23 11 o 263.0242 60.89713 16.43158       6.097739      29.25210       8.423485      2.316690       8.838487  350.1690 64.31210 162.3395 71.64384 187.8295       96.27505 
1 1 1 -12 23 12 o 175.0607 73.22105 5.997980       8.335436      5.997980       8.335436      0.000000       0.000000  175.0607 73.22105 ?        ?        0.000000       73.22105 
1 1 1 -12 23 13 o 203.6412 67.34986 10.78385       6.196957      10.76917       8.755906      10.79858       8.771757  199.2142 77.95281 199.3854 78.02236 -0.1712341     110.2911 
1 1 1 -12 23 14 o 138.3540 62.03353 1.091601       6.899430      -18.15929      11.04181      13.42192       8.836946  118.5767 59.15744 210.7040 79.35267 -92.12731      98.97701 
1 1 1 -12 23 15 o 118.6134 55.89346 -2.922017      6.670165      -5.639970      8.244403      2.228303       11.34894  122.1905 58.82325 159.4003 74.40244 -37.20972      94.84670 
1 1 1 -12 23 16 o 142.3506 65.31560 1.695085       8.207867      1.695085       8.207867      0.000000       0.000000  142.3506 65.31560 ?        ?        0.000000       65.31560 
1 1 1 -12 23 17 o 114.4047 54.58987 -3.292972      6.760951      1.381962       7.789587      -17.57041      13.61294  136.4099 62.96697 125.3175 62.97223 11.09241       89.05247 
1 1 1 -12 24 1  o 336.6190 46.68804 23.90052       5.939072      25.94383       7.475325      20.40318       9.779838  343.9465 58.02946 287.6635 82.96593 56.28299       101.2461 
1 1 1 -12 24 2  o 565.5644 29.83421 64.12369       6.529581      65.62759       8.110342      61.35301       11.00834  567.4360 37.00652 534.9219 53.71685 32.51416       65.23022 
1 1 1 -12 24 3  o 223.7687 74.92346 11.73592       7.662960      4.416652       11.37804      17.81170       10.36657  193.1521 83.31316 264.9074 87.08521 -71.75533      120.5194 
1 1 1 -12 24 4  o 112.6128 52.53435 -3.983302      5.645539      -2.762353      6.728055      -6.888512      10.37838  129.3563 59.27294 147.3151 69.51026 -17.95880      91.35074 
1 1 1 -12 24 5  o 248.6827 65.90354 14.50657       6.467109      16.36085       7.698205      10.05948       11.92176  259.5807 73.20016 217.2367 88.88481 42.34395       115.1467 
1 1 1 -12 24 6  o 282.2218 57.51237 17.98436       6.089556      10.90398       6.991619      40.23506       12.39428  213.9679 71.56666 399.5437 82.60688 -185.5759      109.2963 
1 1 1 -12 24 7  o 154.1224 63.14263 3.523244       6.026069      5.725636       7.062057      -2.375110      11.55711  174.2876 69.43767 164.9322 76.33076 9.355423       103.1890 
1 1 1 -12 24 8  o 190.9125 66.33766 8.506016       6.018461      11.69383       6.954174      -1.006433      12.01284  217.2983 71.32109 169.6563 78.27196 47.64200       105.8924 
1 1 1 -12 24 9  o 191.3640 66.54124 8.748294       6.055967      7.353639       6.871015      13.60290       12.81930  181.4959 69.58415 223.0276 91.81741 -41.53166      115.2059 
1 1 1 -12 24 10 o 160.1946 64.26581 4.948876       6.092748      8.896173       7.025592      -7.025094      12.23636  190.7346 70.96455 151.0259 72.43343 39.70868       101.4030 
1 1 1 -12 24 11 o 230.6557 69.98275 14.07133       6.816323      16.21929       8.031626      8.540689       12.88778  241.1729 76.43555 194.0818 86.03859 47.09109       115.0871 
1 1 1 -12 24 12 o 182.1479 69.53286 8.479559       6.842439      22.02292       10.48688      -1.560488      9.029235  261.0671 87.64697 142.5238 66.47120 118.5432       110.0019 
1 1 1 -12 24 13 o 346.3908 99.33191 43.02755       14.05505      0.000000       0.000000      43.02755       14.05505  ?        ?        346.3908 99.33191 0.000000       99.33191 
1 1 1 -12 24 14 o 151.5553 65.50421 4.366660       7.062524      9.112712       8.316122      -7.912704      13.37650  179.1271 73.87285 143.3863 70.33371 35.74081       102.0001 
1 1 1 -12 24 15 o 145.1872 65.93387 2.693473       8.087875      2.693473       8.087875      0.000000       0.000000  145.1872 65.93387 ?        ?        0.000000       65.93387 
1 1 1 -12 24 16 o 131.4458 60.35750 1.025757       7.027125      0.6995186      8.201898      1.926216       13.62634  135.9079 63.37457 155.2937 74.97673 -19.38580      98.17253 
1 1 1 -12 25 1  o 342.0961 45.03880 24.85379       5.838147      20.28466       7.181642      33.75694       10.02487  295.8376 64.34121 377.8976 70.91344 -82.05994      95.75233 
1 1 1 -12 25 2  o 136.2268 62.68999 -2.901254      7.637523      0.1870165      10.59940      -6.236299      11.01475  169.1593 76.27673 151.9498 71.67041 17.20953       104.6651 
1 1 1 -12 25 3  o 207.7263 76.66480 10.14747       8.166877      10.90165       11.32678      9.330854       11.78634  216.8107 87.39652 210.2738 87.43326 6.536850       123.6233 
1 1 1 -12 25 4  o 390.5370 43.20153 32.34929       6.442495      26.45042       7.554785      48.07518       12.33518  340.6688 59.25504 444.4091 74.07959 -103.7403      94.86277 
1 1 1 -12 25 5  o 469.7023 36.57591 45.74102       6.619238      47.17776       7.756419      41.89034       12.69816  471.6431 42.81320 399.4737 84.49023 72.16940       94.71836 
1 1 1 -12 25 6  o 348.3034 48.47486 26.61889       6.379203      28.33174       7.491330      22.10027       12.16751  352.4886 56.64334 270.6720 94.30782 81.81662       110.0111 
1 1 1 -12 25 7  o 153.2841 63.50160 3.695191       6.184404      7.305593       7.300606      -5.478769      11.63750  181.3327 71.11814 152.5013 72.44298 28.83145       101.5174 
1 1 1 -12 25 8  o 139.8432 61.38434 1.279513       6.408308      10.68121       7.567873      -22.54421      12.04691  203.1162 73.97799 122.2568 61.11556 80.85941       95.95757 
1 1 1 -12 25 9  o 154.4054 64.37484 4.111003       6.413771      1.488766       7.485392      11.35318       12.43979  146.7941 65.29917 204.1634 87.57481 -57.36925      109.2398 
1 1 1 -12 25 10 o 355.4433 53.33279 29.47433       7.134771      22.90007       8.263123      48.73632       14.14398  290.3209 73.28197 394.6344 93.68875 -104.3135      118.9446 
1 1 1 -12 25 11 o 301.0577 72.31429 24.84872       8.348807      27.32817       10.44030      20.45085       13.90454  294.2737 85.96783 229.4456 95.14851 64.82817       128.2330 
1 1 1 -12 25 12 o 122.8394 57.58366 -2.358833      6.920750      3.101315       8.020781      -18.27032      13.69209  150.8485 67.31295 130.8907 65.39002 19.95775       93.84502 
1 1 1 -12 25 13 o 127.9778 58.78478 -0.1515616     6.673327      -8.098056      7.633258      25.61668       13.74563  110.5055 53.97809 239.1939 96.32710 -128.6884      110.4199 
1 1 1 -12 26 1  o 509.4065 29.48848 52.62938       5.808759      52.77706       6.823704      52.24074       11.06976  505.8138 34.95214 475.9347 61.31728 29.87909       70.57946 
1 1 1 -12 26 2  o 618.2641 32.09692 78.16464       7.680135      68.45660       9.690596      94.56132       12.59396  565.5963 44.47681 657.8179 49.66403 -92.22162      66.66860 
1 1 1 -12 26 3  o 336.4582 44.27892 24.46141       5.645172      23.94326       6.468287      26.11750       11.56384  326.1540 52.87726 298.5339 91.27648 27.62015       105.4865 
1 1 1 -12 26 4  o 143.5235 59.95856 2.795191       5.579872      -4.017507      6.257016      29.25878       12.33196  116.1523 54.54590 310.4652 94.11594 -194.3129      108.7799 
1 1 1 -12 26 5  o 137.7420 59.25505 1.798928       5.724702      2.592731       6.481285      -1.018086      12.20954  147.6954 63.27899 165.7427 77.29881 -18.04732      99.89663 
1 1 1 -12 26 6  o 253.4017 62.87123 15.86065       6.157543      7.721065       7.046754      42.14497       12.66300  180.9191 70.17053 384.7341 86.81440 -203.8150      111.6273 
1 1 1 -12 26 7  o 623.1994 29.82971 79.63622       7.219449      75.21558       8.448448      91.60174       13.89952  596.8533 36.62566 622.6995 58.14988 -25.84613      68.72298 
1 1 1 -12 26 8  o 142.3570 61.44057 2.521225       6.195551      5.680121       7.179375      -6.693589      12.26203  165.1051 68.41074 147.2973 71.11800 17.80782       98.68028 
1 1 1 -12 26 9  o 119.9544 57.38411 -5.354662      7.571038      -6.162071      9.638744      -4.054073      12.23331  132.3992 63.70388 151.0278 72.43172 -18.62857      96.46004 
1 1 1 -12 26 10 o 195.9702 68.90331 10.66203       6.502141      7.989254       7.563659      18.23009       12.72748  175.7749 71.21999 220.4590 91.19493 -44.68411      115.7100 
1 1 1 -12 27 1  o 331.4566 52.00297 24.79726       6.473670      27.81281       8.653783      20.96529       9.755155  334.6143 68.88918 271.7809 83.95819 62.83340       108.6034 
1 1 1 -12 27 2  o 304.2403 57.20996 21.64768       6.511404      20.19516       8.358212      23.89028       10.38550  274.8969 75.82829 286.5346 86.25962 -11.63763      114.8506 
1 1 1 -12 27 3  o 164.3289 62.02988 5.949971       5.407082      5.849559       6.277864      6.238488       10.64160  166.3260 65.71976 182.6051 79.65400 -16.27907      103.2659 
1 1 1 -12 27 4  o 142.3231 59.25428 3.067827       5.423174      -2.430876      6.187266      21.29724       11.26562  120.1276 55.68495 258.2230 90.70159 -138.0955      106.4312 
1 1 1 -12 27 5  o 191.1826 63.53703 9.190475       5.512722      6.962317       6.284646      16.62612       11.48067  172.4380 66.43883 227.7669 89.22395 -55.32889      111.2431 
1 1 1 -12 27 6  o 91.79677 45.00225 -8.391928      5.451419      -12.26072      6.183170      5.112635       11.55217  90.59379 45.04572 176.1359 79.50755 -85.54209      91.38143 
1 1 1 -11 0  1  o 133.1949 65.15760 5.203501       3.989350      5.203501       3.989350      5.203501       3.989350  133.1949 65.15760 133.1949 65.15760 0.000000       0.000000 
1 1 1 -11 0  2  f 405.0155 30.29227 32.57461       4.703378      32.57461       4.703378      32.57461       4.703378  405.0155 30.29227 405.0155 30.29227 -0.000000      0.000000 
1 1 1 -11 0  3  f 458.2927 28.19438 41.45853       4.974518      41.45853       4.974518      41.45853       4.974518  458.2927 28.19438 458.2927 28.19438 0.000000       0.000000 
1 1 1 -11 0  4  o 370.9318 35.49448 27.66112       5.005542      27.66112       5.005542      27.66112       5.005542  370.9318 35.49448 370.9318 35.49448 0.000000       0.000000 
1 1 1 -11 0  5  o 430.3021 31.62063 36.76982       5.218525      36.76982       5.218525      36.76982       5.218525  430.3021 31.62063 430.3021 31.62063 0.000000       0.000000 
1 1 1 -11 0  6  o 91.80679 62.63383 -3.838346      6.931502      -3.838346      6.931502      -3.838346      6.931502  91.80679 62.63383 91.80679 62.63383 -0.000000      0.000000 
1 1 1 -11 0  7  o 144.3862 83.30918 5.484102       7.536399      5.484102       7.536399      5.484102       7.536399  144.3862 83.30918 144.3862 83.30918 0.000000       0.000000 
1 1 1 -11 0  8  o 173.9289 90.93045 9.068025       8.059649      9.068025       8.059649      9.068025       8.059649  173.9289 90.93045 173.9289 90.93045 0.000000       0.000000 
1 1 1 -11 0  9  o 520.0803 31.79799 53.44320       6.367410      53.44320       6.367410      53.44320       6.367410  520.0803 31.79799 520.0803 31.79799 -0.000000      0.000000 
1 1 1 -11 0  10 o 425.9971 37.84352 36.36467       6.147108      36.36467       6.147108      36.36467       6.147108  425.9971 37.84352 425.9971 37.84352 0.000000       0.000000 
1 1 1 -11 0  11 o 68.85904 49.03727 -8.008313      5.737914      -8.008313      5.737914      -8.008313      5.737914  68.85904 49.03727 68.85904 49.03727 0.000000       0.000000 
1 1 1 -11 0  12 o 270.6697 70.87262 17.12660       6.436998      17.12660       6.436998      17.12660       6.436998  270.6697 70.87262 270.6697 70.87262 -0.000000      0.000000 
1 1 1 -11 0  13 o 93.94081 62.58286 -1.764350      6.177697      -1.764350      6.177697      -1.764350      6.177697  93.94081 62.58286 93.94081 62.58286 -0.000000      0.000000 
1 1 1 -11 0  14 o 171.0073 87.16375 8.621656       7.282324      8.621656       7.282324      8.621656       7.282324  171.0073 87.16375 171.0073 87.16375 0.000000       0.000000 
1 1 1 -11 0  15 o 688.7538 32.32279 93.12056       8.602329      93.12056       8.602329      93.12056       8.602329  688.7538 32.32279 688.7538 32.32279 -0.000000      0.000000 
1 1 1 -11 0  16 o 554.0443 40.19735 60.90796       8.544453      60.90796       8.544453      60.90796       8.544453  554.0443 40.19735 554.0443 40.19735 0.000000       0.000000 
1 1 1 -11 0  17 o 626.1876 39.02294 77.44720       9.405238      77.44720       9.405238      77.44720       9.405238  626.1876 39.02294 626.1876 39.02294 -0.000000      0.000000 
1 1 1 -11 0  18 f 1222.109 27.15245 291.2501       12.87250      291.2501       12.87250      291.2501       12.87250  1222.109 27.15245 1222.109 27.15245 0.000000       0.000000 
1 1 1 -11 0  19 o 303.1767 83.30725 21.81316       8.481503      21.81316       8.481503      21.81316       8.481503  303.1767 83.30725 303.1767 83.30725 0.000000       0.000000 
1 1 1 -11 0  20 o 345.0708 70.51953 26.23301       8.356480      26.23301       8.356480      26.23301       8.356480  345.0708 70.51953 345.0708 70.51953 -0.000000      0.000000 
1 1 1 -11 0  21 o 270.3586 95.73248 19.24191       9.143813      19.24191       9.143813      19.24191       9.143813  270.3586 95.73248 270.3586 95.73248 -0.000000      0.000000 
1 1 1 -11 0  22 o 447.5952 60.28421 41.70925       9.944318      41.70925       9.944318      41.70925       9.944318  447.5952 60.28421 447.5952 60.28421 0.000000       0.000000 
1 1 1 -11 0  23 o 117.3359 82.28703 -13.66353      14.22781      -13.66353      14.22781      -13.66353      14.22781  117.3359 82.28703 117.3359 82.28703 0.000000       0.000000 
1 1 1 -11 0  24 o 468.0247 99.67538 50.20020       15.92229      50.20020       15.92229      50.20020       15.92229  468.0247 99.67538 468.0247 99.67538 0.000000       0.000000 
1 1 1 -11 0  25 o 197.8526 103.9651 12.20370       10.57624      12.20370       10.57624      12.20370       10.57624  197.8526 103.9651 197.8526 103.9651 0.000000       0.000000 
1 1 1 -11 0  26 o 339.0774 94.91705 28.54473       10.81635      28.54473       10.81635      28.54473       10.81635  339.0774 94.91705 339.0774 94.91705 0.000000       0.000000 
1 1 1 -11 0  27 o 144.1155 94.88255 0.3145702      13.52914      0.3145702      13.52914      0.3145702      13.52914  144.1155 94.88255 144.1155 94.88255 0.000000       0.000000 
1 1 1 -11 0  28 o 164.9886 105.5440 5.421906       15.16732      5.421906       15.16732      5.421906       15.16732  164.9886 105.5440 164.9886 105.5440 -0.000000      0.000000 
1 1 1 -11 0  29 f 197.4776 107.1631 14.02073       11.55608      14.02073       11.55608      14.02073       11.55608  197.4776 107.1631 197.4776 107.1631 -0.000000      0.000000 
1 1 1 -11 0  30 o 98.82578 69.56738 -8.641493      10.46538      -8.641493      10.46538      -8.641493      10.46538  98.82578 69.56738 98.82578 69.56738 -0.000000      0.000000 
1 1 1 -11 0  31 o 110.0690 74.61597 -1.538649      9.519265      -1.538649      9.519265      -1.538649      9.519265  110.0690 74.61597 110.0690 74.61597 -0.000000      0.000000 
1 1 1 -11 0  32 o 96.94006 67.43842 -4.657287      9.030856      -4.657287      9.030856      -4.657287      9.030856  96.94006 67.43842 96.94006 67.43842 -0.000000      0.000000 
1 1 1 -11 1  1  o 471.9517 18.71610 43.50174       3.430371      43.55579       4.820969      43.44630       4.882164  470.1612 26.51155 469.4715 26.88971 0.6896362      37.76134 
1 1 1 -11 1  2  o 926.9478 14.61432 167.4526       5.260921      172.7240       7.486855      162.3109       7.394143  939.7671 20.51404 910.8743 20.90265 28.89276       29.28731 
1 1 1 -11 1  3  o 158.0715 46.68895 5.132408       3.064451      7.065463       4.266764      3.072938       4.404071  184.3014 55.24606 144.5590 55.63968 39.74240       78.40855 
1 1 1 -11 1  4  o 176.7413 45.85869 6.529635       3.174742      6.719538       4.407994      6.324959       4.576259  180.6406 56.54216 177.0094 57.84460 3.631226       80.88889 
1 1 1 -11 1  5  o 732.1038 19.19149 104.7992       5.456439      105.6442       6.629749      103.0250       9.606278  733.8594 23.26249 720.4173 34.33548 13.44208       41.47371 
1 1 1 -11 1  6  f 510.4745 24.55291 51.19367       4.867489      52.99856       6.115528      48.07397       8.040152  516.8854 30.60201 487.2192 42.93117 29.66620       52.72161 
1 1 1 -11 1  7  o 645.5729 26.77819 82.08086       6.713586      85.45699       9.591578      78.83810       9.400203  653.0795 37.98183 626.7714 38.80983 26.30804       54.30306 
1 1 1 -11 1  8  o 330.6192 35.76871 22.00512       4.519396      37.75848       8.188149      15.10346       5.419710  427.7356 50.25008 266.9340 54.13303 160.8016       73.86105 
1 1 1 -11 1  9  o 219.1855 48.61161 10.11858       4.029506      7.397672       5.637389      12.96092       5.761813  190.8262 64.26081 244.8381 60.86001 -54.01193      88.50645 
1 1 1 -11 1  10 o 104.8372 47.36219 -1.870972      4.109063      -0.5927078     5.804832      -3.154765      5.817372  133.8061 58.58601 121.2147 55.38277 12.59141       80.61993 
1 1 1 -11 1  11 o 281.4685 41.46458 16.18663       4.396682      15.10056       6.214324      17.27516       6.221375  264.7314 61.60240 284.8179 58.21144 -20.08655      84.75510 
1 1 1 -11 1  12 o 209.3260 54.18774 9.285632       4.439426      12.23090       6.345462      6.461843       6.213220  237.8191 66.24603 186.1187 67.14605 51.70039       94.32458 
1 1 1 -11 1  13 f 799.5178 19.71275 124.9440       6.120731      121.9701       8.663190      127.9082       8.648869  787.1935 28.33795 806.4008 27.61724 -19.20734      39.56958 
1 1 1 -11 1  14 o 823.3599 19.76557 132.4645       6.320145      132.2569       8.838960      132.6816       9.040519  820.2306 27.74835 821.3287 28.34317 -1.098145      39.66492 
1 1 1 -11 1  15 o 537.2880 27.19350 56.83042       5.655668      53.76407       7.768947      60.28767       8.249295  518.8753 38.83580 549.5818 38.90199 -30.70654      54.96893 
1 1 1 -11 1  16 f 719.6613 22.99628 101.3448       6.427080      111.9958       9.099950      90.74375       9.078615  754.1473 31.07097 676.8499 34.65438 77.29749       46.54386 
1 1 1 -11 1  17 o 325.0671 47.10185 21.56190       5.772949      35.11723       8.102181      7.583555       8.227631  414.6927 51.41166 207.0053 76.83973 207.6874       92.45271 
1 1 1 -11 1  18 f 205.4557 65.11496 8.691252       5.828746      9.837550       8.258365      7.553394       8.227903  222.7388 77.69016 206.4593 76.80062 16.27945       109.2433 
1 1 1 -11 1  19 o 568.8915 29.91483 63.93533       6.585915      56.11239       9.351292      71.63436       9.276933  526.6008 46.19257 598.2593 40.16179 -71.65857      61.21048 
1 1 1 -11 1  20 o 747.7836 25.36615 109.9202       7.366452      114.8191       10.47813      105.1326       10.35838  759.8337 35.50890 725.5460 36.88338 34.28766       51.19830 
1 1 1 -11 1  21 o 123.7555 57.25713 -4.336814      6.495825      -1.127933      8.934525      -7.935038      9.461037  160.9755 71.48647 141.8142 66.74741 19.16133       97.80354 
1 1 1 -11 1  22 f 317.3386 58.39525 21.72016       6.931436      20.46120       9.863762      22.94833       9.742427  294.8476 82.75836 314.1031 79.72884 -19.25552      114.9158 
1 1 1 -11 1  23 o 224.9429 84.98103 10.64470       10.15395      6.632206       14.60379      14.39986       14.12773  221.9951 95.04594 253.5217 99.06986 -31.52660      137.2901 
1 1 1 -11 1  24 o 403.5126 73.78263 37.66363       11.13609      27.88826       15.42294      48.31113       16.09625  316.8210 106.2916 432.3967 98.10577 -115.5757      144.6466 
1 1 1 -11 1  25 o 190.5542 72.16987 7.614965       7.334831      9.098853       10.41265      6.153454       10.33384  208.7259 83.91585 193.7662 81.31683 14.95973       116.8516 
1 1 1 -11 1  26 f 216.8269 75.05527 11.87679       7.700663      19.28536       11.36430      5.586896       10.47121  258.1689 91.06026 185.4345 79.95439 72.73436       121.1803 
1 1 1 -11 1  27 o 145.0217 66.64495 -0.7894622     8.591003      9.862849       14.48002      -6.576045      10.67231  201.6846 90.18776 141.2143 67.70605 60.47034       112.7738 
1 1 1 -11 1  28 o 265.0955 89.71324 24.39939       10.98803      30.81516       16.00144      18.67458       15.11524  259.0210 104.0651 216.4259 94.65493 42.59509       140.6737 
1 1 1 -11 1  29 o 124.8253 59.09329 -2.108470      7.614841      -15.48398      10.53238      12.54043       11.02234  114.3489 57.15977 186.1973 81.14793 -71.84841      99.25838 
1 1 1 -11 1  30 o 284.3677 68.34081 24.93160       7.453559      37.13586       10.72572      13.53363       10.36536  310.9591 85.94952 176.7633 77.81811 134.1958       115.9439 
1 1 1 -11 1  31 o 215.5017 71.16652 17.76472       6.920156      8.216151       9.889981      26.92413       9.686351  146.1074 68.60139 233.8064 83.89697 -87.69891      108.3737 
1 1 1 -11 1  32 o 120.2653 56.27914 3.062902       6.561787      -9.852330      9.012490      17.63251       9.572329  100.7502 50.70813 168.8867 74.54471 -68.13650      90.15669 
1 1 1 -11 2  1  o 162.2742 47.84327 5.408182       3.220435      5.055112       3.943028      6.115595       5.581306  160.9478 53.74527 180.3322 63.79288 -19.38445      83.41515 
1 1 1 -11 2  2  o 302.7746 27.23530 18.16658       3.168161      17.73444       4.341302      18.65895       4.633912  296.1336 38.67239 303.3581 40.33340 -7.224548      55.87788 
1 1 1 -11 2  3  o 534.1086 18.35094 55.72366       3.806413      54.71630       5.263944      56.82766       5.510693  527.7611 25.68301 537.6736 26.39122 -9.912476      36.82544 
1 1 1 -11 2  4  o 321.0626 32.69374 20.60475       4.019572      22.71589       4.892367      16.21953       7.051097  335.5850 38.22139 272.9724 67.00895 62.61261       77.14320 
1 1 1 -11 2  5  o 443.8936 26.11342 38.88206       4.481809      34.22022       5.288003      50.77085       8.444657  414.2820 33.14512 500.6124 43.87907 -86.33038      54.99065 
1 1 1 -11 2  6  o 286.9002 40.76092 16.79061       4.413831      14.32944       5.329419      22.16549       7.875781  259.9710 54.52777 319.9938 65.57946 -60.02280      85.28741 
1 1 1 -11 2  7  o 528.7252 30.42920 55.44920       6.221737      64.60500       9.136557      47.53212       8.496047  565.6816 41.88711 482.9142 45.85210 82.76740       62.10431 
1 1 1 -11 2  8  o 188.1655 56.06178 7.446824       4.403600      -1.685912      7.721595      11.84885       5.360837  148.4305 66.15350 234.6415 58.91511 -86.21109      88.58485 
1 1 1 -11 2  9  o 557.3121 21.47045 60.86433       4.646946      60.54423       6.551817      61.18835       6.591914  552.4395 30.65901 555.3707 30.68233 -2.931152      43.37488 
1 1 1 -11 2  10 o 366.0457 30.39847 26.65685       4.282209      28.48794       6.124539      24.90555       5.989630  374.2055 42.92019 348.6880 45.30209 25.51743       62.40531 
1 1 1 -11 2  11 o 504.7107 24.17981 50.00430       4.739399      57.77914       6.811398      42.70744       6.598706  539.1977 32.68253 461.6922 37.11623 77.50546       49.45465 
1 1 1 -11 2  12 o 441.7697 28.26024 38.58221       4.823009      38.58796       6.974520      38.57694       6.676750  437.3461 41.56361 438.0030 39.68270 -0.6569214     57.46521 
1 1 1 -11 2  13 o 186.0874 58.62579 7.101862       4.730323      5.234566       6.777251      8.875678       6.605433  180.7466 69.15257 208.5298 69.56140 -27.78313      98.08601 
1 1 1 -11 2  14 o 272.7403 47.92985 15.36134       4.891442      12.76858       7.154649      17.63677       6.702550  243.6163 71.16539 287.9139 61.79315 -44.29764      94.24917 
1 1 1 -11 2  15 o 145.2347 58.34428 2.325670       5.029208      0.2212418      7.117342      4.424233       7.107418  153.2997 66.00874 178.1720 70.07737 -24.87224      96.27041 
1 1 1 -11 2  16 o 431.4147 33.93016 36.95676       5.638843      43.55062       8.141141      30.87638       7.817743  464.5754 45.71540 387.6997 53.33502 76.87564       70.24615 
1 1 1 -11 2  17 o 452.0227 34.41996 40.56789       5.996839      33.20213       8.764988      47.05024       8.222596  400.4410 58.05469 483.6653 44.26698 -83.22430      73.00625 
1 1 1 -11 2  18 o 348.0539 48.01328 24.73745       6.317089      30.73784       8.656377      17.90136       9.239535  383.8146 60.04240 285.5042 80.08318 98.31042       100.0920 
1 1 1 -11 2  19 o 840.0422 22.43440 138.1697       7.318861      141.8524       10.32235      134.4466       10.37874  847.8244 31.35053 824.9474 32.39593 22.87701       45.08161 
1 1 1 -11 2  20 o 374.1331 45.17005 28.60844       6.430220      35.88135       8.976966      20.94453       9.215117  413.6890 57.42505 305.5005 77.53895 108.1885       96.48795 
1 1 1 -11 2  21 o 163.3089 65.41183 3.548990       6.301091      4.344716       9.083549      2.810950       8.748093  187.8539 77.30765 177.5882 74.68775 10.26567       107.4929 
1 1 1 -11 2  22 o 625.0354 31.75155 77.95991       7.681901      74.38962       10.26458      82.50549       11.58203  603.0214 44.13757 632.7226 47.48124 -29.70123      64.82741 
1 1 1 -11 2  23 o 543.6253 55.47978 62.73982       11.54869      63.07492       15.73437      62.34846       17.00406  522.5139 80.09357 510.2639 89.04762 12.24994       119.7684 
1 1 1 -11 2  24 o 637.6816 49.09845 85.41321       12.06555      78.05805       16.54623      93.76534       17.63200  581.7285 74.98617 641.7827 71.98401 -60.05414      103.9453 
1 1 1 -11 2  25 o 160.5342 68.33948 2.648879       7.472167      -1.918771      10.68758      7.016444       10.45088  163.4708 74.83138 198.0317 82.33598 -34.56093      111.2607 
1 1 1 -11 2  26 f 280.0666 90.52737 22.69317       11.22384      22.69317       11.22384      0.000000       0.000000  280.0666 90.52737 ?        ?        0.000000       90.52737 
1 1 1 -11 2  27 o 222.3853 79.81189 14.12909       8.766371      33.15023       14.97381      4.209820       10.81319  299.5012 104.6045 173.6367 77.77007 125.8645       130.3468 
1 1 1 -11 2  28 o 190.5873 77.17915 10.60343       8.877094      12.85934       11.50276      7.281232       13.95895  199.1971 84.79440 181.2329 83.87950 17.96416       119.2722 
1 1 1 -11 2  29 o 103.1795 50.83149 -9.203442      7.236409      -3.871987      10.45310      -14.10989      10.02780  134.6042 65.15137 113.2523 56.48111 21.35186       86.22538 
1 1 1 -11 2  30 o 149.3683 65.49423 6.386268       7.277700      14.48015       10.43405      -1.282031      10.15603  179.5184 78.57494 131.4429 63.76334 48.07553       101.1918 
1 1 1 -11 2  31 o 123.6762 57.83276 2.305689       6.907215      -2.025214      9.824612      6.538661       9.712899  121.2512 59.63633 140.8822 66.70763 -19.63093      89.47849 
1 1 1 -11 2  32 o 171.1912 68.73081 13.62211       6.974692      4.910817       9.678665      23.03295       10.05978  128.8643 62.45026 187.2911 79.49955 -58.42680      101.0951 
1 1 1 -11 3  1  o 128.1557 47.97162 2.576067       3.220040      1.244221       3.848251      5.686038       5.880506  123.0436 50.44003 178.4366 65.17747 -55.39300      82.41541 
1 1 1 -11 3  2  o 521.0481 25.17174 53.28932       5.093531      53.28932       5.093531      0.000000       0.000000  521.0481 25.17174 ?        ?        0.000000       25.17174 
1 1 1 -11 3  3  o 499.7620 23.11639 48.95633       4.486537      50.04501       5.363537      46.41956       8.187347  503.5846 27.52954 478.7610 44.54593 24.82364       52.36617 
1 1 1 -11 3  4  o 472.2422 24.23782 43.87917       4.430174      43.85242       5.327182      43.93917       7.977267  470.6861 29.28844 465.3856 44.68752 5.300476       53.43021 
1 1 1 -11 3  5  o 464.4752 25.45415 42.52303       4.573957      44.04821       5.560053      39.33001       8.044900  471.2350 30.54634 438.3825 48.04092 32.85251       56.92986 
1 1 1 -11 3  6  o 495.2173 25.30680 48.32700       4.850742      48.79581       5.984316      47.42890       8.282893  495.7367 31.24374 483.2357 44.64077 12.50098       54.48825 
1 1 1 -11 3  7  o 343.8167 34.19131 23.69234       4.504760      25.36960       8.022841      22.92007       5.443936  344.4175 62.27335 335.2021 42.79616 9.215424       75.56111 
1 1 1 -11 3  8  o 471.3431 28.32379 43.96797       5.160553      33.02774       8.907083      49.49598       6.331500  395.2439 59.90632 498.5993 32.88305 -103.3554      68.33785 
1 1 1 -11 3  9  f 128.1639 53.56279 1.007295       4.455418      -2.872813      8.301264      2.577264       5.280413  149.1925 67.36691 148.4747 59.73505 0.7177124      90.03653 
1 1 1 -11 3  10 o 84.23357 40.59649 -5.798979      3.953224      -5.000212      5.854123      -6.468575      5.359916  114.0648 53.30701 102.1803 48.71499 11.88450       72.21349 
1 1 1 -11 3  11 o 213.9109 51.83710 9.670163       4.261164      9.855989       5.993082      9.480173       6.059865  215.2923 65.68758 211.8782 66.29140 3.414078       93.32421 
1 1 1 -11 3  12 o 115.2185 51.07620 -1.196272      4.541494      2.849045       6.398159      -5.304107      6.447411  161.1937 65.43644 120.4575 56.17632 40.73620       86.24214 
1 1 1 -11 3  13 o 745.0369 20.46532 108.5209       5.921400      114.3253       8.612116      103.3165       8.154830  762.0622 29.09990 724.4821 28.98406 37.58014       41.07165 
1 1 1 -11 3  14 o 705.9857 22.00745 97.50919       6.033837      106.2749       8.951194      90.20916       8.168663  734.2036 31.39326 676.5335 31.09093 57.67004       44.18351 
1 1 1 -11 3  15 o 467.6101 30.00154 43.19507       5.419481      34.42890       7.783023      51.44604       7.550856  410.9289 49.78616 507.7795 38.57916 -96.85065      62.98423 
1 1 1 -11 3  16 o 691.5865 23.57148 93.60963       6.330842      100.2785       9.027517      87.15600       8.880614  713.2447 32.59131 663.4659 34.58620 49.77881       47.52261 
1 1 1 -11 3  17 o 362.6703 44.03448 26.59551       6.074802      34.19973       8.487041      18.60670       8.699017  407.7822 54.99466 292.3613 75.93607 115.4209       93.75874 
1 1 1 -11 3  18 o 299.4237 55.14987 18.70392       6.176669      21.05442       8.774526      16.39516       8.696259  311.1566 73.74080 274.0008 77.98800 37.15588       107.3305 
1 1 1 -11 3  19 o 458.9906 36.88412 42.09560       6.519109      38.31544       9.104090      46.07355       9.339230  430.0411 55.83006 474.1895 51.54455 -44.14841      75.98576 
1 1 1 -11 3  20 o 475.7845 35.88868 45.30745       6.582445      50.14381       9.317139      40.48798       9.300847  494.4225 49.17646 440.5672 55.59834 53.85532       74.22601 
1 1 1 -11 3  21 o 682.9410 27.64565 92.13287       7.332261      84.54783       10.00215      100.9440       10.78028  647.1439 39.99434 707.7106 39.37935 -60.56677      56.12736 
1 1 1 -11 3  22 o 574.2870 33.25606 66.03014       7.385246      66.20417       10.41785      65.85434       10.47099  566.1003 47.83453 564.3049 48.24365 1.795471       67.93816 
1 1 1 -11 3  23 o 181.2947 78.71175 1.999368       10.29006      8.360012       13.35777      -7.284549      16.13797  223.6383 93.04236 188.0251 88.07423 35.61319       128.1169 
1 1 1 -11 3  24 o 162.9770 71.29154 1.001893       8.577813      -3.234311      13.61648      3.789124       11.04493  180.9150 83.41947 190.4811 82.12297 -9.566132      117.0598 
1 1 1 -11 3  25 o 126.5433 59.15595 -4.555395      7.217709      3.001613       10.63643      -11.00520      9.826393  180.5732 79.17730 131.4037 63.49714 49.16945       101.4935 
1 1 1 -11 3  26 o 163.6959 69.51637 3.826352       7.697601      3.129322       10.94057      4.509659       10.83234  176.5275 78.70513 181.3405 79.69881 -4.813034      112.0107 
1 1 1 -11 3  27 o 282.7186 78.89393 22.50612       8.991339      27.99301       16.38331      20.14121       10.75588  263.2984 105.4702 252.0182 88.62003 11.28024       137.7588 
1 1 1 -11 3  28 o 169.1193 72.50108 6.674186       8.517174      -5.315260      10.74629      26.92875       13.96756  138.5631 66.81928 252.3482 98.53566 -113.7851      119.0550 
1 1 1 -11 3  29 o 132.6228 61.41854 0.6022685      7.500754      -9.184185      10.92302      9.334857       10.31814  125.7579 62.04959 172.3491 76.66637 -46.59128      98.63004 
1 1 1 -11 3  30 o 107.6757 52.53410 -5.190808      7.170479      -3.284526      10.35895      -6.944421      9.935481  127.2822 62.32199 118.7285 58.69277 8.553711       85.60883 
1 1 1 -11 3  31 o 218.4779 73.03925 19.11268       7.282269      26.26178       10.22724      11.76027       10.37164  218.0029 84.54064 154.7105 71.84882 63.29240       110.9476 
1 1 1 -11 4  1  o 624.4537 22.74552 76.36343       5.515997      76.36343       5.515997      0.000000       0.000000  624.4537 22.74552 ?        ?        0.000000       22.74552 
1 1 1 -11 4  2  o 573.3812 24.43374 64.48804       5.440783      64.48804       5.440783      0.000000       0.000000  573.3812 24.43374 ?        ?        0.000000       24.43374 
1 1 1 -11 4  3  o 163.4715 56.87051 5.055688       4.423863      5.055688       4.423863      0.000000       0.000000  163.4715 56.87051 ?        ?        0.000000       56.87051 
1 1 1 -11 4  4  o 413.9942 27.06792 33.85941       4.327924      37.34016       5.275424      26.69416       7.568957  433.5443 31.54894 357.0101 56.47032 76.53421       64.68564 
1 1 1 -11 4  5  o 163.5292 49.39674 5.496788       3.401484      5.249447       4.733986      5.760774       4.890690  166.9507 58.78436 172.7415 59.81283 -5.790833      83.86404 
1 1 1 -11 4  6  o 257.4054 36.70245 13.43609       3.565039      16.47577       5.184382      10.70938       4.910235  281.3258 49.24671 223.9726 56.46652 57.35316       74.92467 
1 1 1 -11 4  7  f 124.2389 49.35831 1.836223       3.559041      -7.327068      5.206048      9.876402       4.876578  97.13108 46.75551 215.0164 57.34607 -117.8854      73.99088 
1 1 1 -11 4  8  o 137.6604 53.88424 2.566254       4.184746      0.5085842      7.725461      3.420737       4.978383  159.0555 68.62808 152.3464 59.01025 6.709122       90.50979 
1 1 1 -11 4  9  f 267.1831 46.90053 14.80652       4.688958      18.04704       7.904100      13.04683       5.824559  286.1382 71.36869 246.0491 61.20707 40.08902       94.02019 
1 1 1 -11 4  10 o 573.4024 21.26728 64.37062       4.735866      64.96785       6.760584      63.79517       6.636201  572.8144 30.50068 567.7117 30.20850 5.102661       42.92837 
1 1 1 -11 4  11 o 686.0580 19.86437 92.02554       5.292534      89.26243       7.643200      94.57087       7.335807  672.9914 29.24406 693.3901 27.24220 -20.39868      39.96690 
1 1 1 -11 4  12 o 533.1147 24.36896 55.73258       5.045285      57.97079       7.259469      53.64143       7.016932  539.9250 34.80674 519.2228 35.00316 20.70215       49.36325 
1 1 1 -11 4  13 o 609.1687 23.08215 72.66591       5.460618      83.82340       8.076252      63.26965       7.411464  651.7824 31.90650 564.7117 33.95253 87.07074       46.59184 
1 1 1 -11 4  14 o 330.4547 40.59507 22.03266       5.100145      16.43329       7.306481      27.35348       7.122428  276.0993 68.47610 364.8338 51.71751 -88.73447      85.81187 
1 1 1 -11 4  15 o 143.5604 58.55818 1.900812       5.154384      -2.044086      7.428450      5.563565       7.157876  145.6857 64.91120 186.6190 71.14660 -40.93323      96.30837 
1 1 1 -11 4  16 o 547.2621 40.87978 59.82223       8.625513      59.82223       8.625513      0.000000       0.000000  547.2621 40.87978 ?        ?        0.000000       40.87978 
1 1 1 -11 4  17 o 618.0133 39.86583 76.13509       9.517088      0.000000       0.000000      76.13509       9.517088  ?        ?        618.0133 39.86583 0.000000       39.86583 
1 1 1 -11 4  18 o 187.8715 66.68081 6.606912       6.102936      16.76606       8.882710      -2.476519      8.399275  276.6685 78.84473 153.2993 68.60999 123.3692       104.5171 
1 1 1 -11 4  19 o 579.3389 30.92415 66.43237       6.932429      66.51427       9.500020      66.33909       10.13902  574.7327 42.87133 572.4434 45.99574 2.289307       62.87733 
1 1 1 -11 4  20 o 116.4588 54.62428 -5.566659      6.243076      -1.526575      8.795165      -9.669595      8.863315  158.9294 70.73466 131.7830 62.77742 27.14644       94.57481 
1 1 1 -11 4  21 o 423.9601 41.61932 36.59534       6.764139      42.08613       9.498843      30.94663       9.634474  447.0210 55.94098 375.1658 68.65681 71.85522       88.56157 
1 1 1 -11 4  22 o 138.2758 61.77878 -1.486732      6.778486      -1.572971      8.985087      -1.372815      10.32680  158.1779 70.86584 169.5014 75.95352 -11.32355      103.8793 
1 1 1 -11 4  23 o 255.6855 87.11491 15.56726       10.36144      10.79440       13.63202      22.09708       15.94490  234.6646 95.41978 290.6650 107.1497 -56.00043      143.4782 
1 1 1 -11 4  24 o 216.7458 76.65047 10.65524       8.057284      23.19025       14.44303      4.991521       9.708384  290.9756 102.6539 188.4423 78.93642 102.5332       129.4943 
1 1 1 -11 4  25 o 647.8477 32.66945 85.26478       8.192976      105.6212       11.84179      66.57307       11.34726  709.7746 43.16547 552.0891 53.59960 157.6855       68.81987 
1 1 1 -11 4  26 o 242.2109 74.68829 15.32821       7.723889      30.61570       11.01202      0.5240036      10.83656  334.1572 84.73509 166.0074 75.74745 168.1498       113.6561 
1 1 1 -11 4  27 o 193.6039 77.58191 9.908455       8.868353      8.923470       16.49272      10.30909       10.51840  198.0721 91.49764 196.4391 82.21508 1.632950       123.0087 
1 1 1 -11 4  28 o 177.6303 74.68614 8.520813       8.744046      12.98646       11.07871      1.143115       14.23991  197.7844 83.66139 164.9155 78.83946 32.86893       114.9560 
1 1 1 -11 4  29 o 253.0668 72.77079 20.06920       7.534044      20.96389       10.49723      19.11872       10.81957  225.4550 86.10960 212.9495 85.56596 12.50549       121.3936 
1 1 1 -11 4  30 o 114.9989 55.38122 -2.541070      7.323533      -5.999514      10.44452      0.8038874      10.27172  121.7660 60.19114 134.8134 65.09061 -13.04739      88.65529 
1 1 1 -11 4  31 o 152.7652 66.43456 9.433582       7.354448      17.56537       10.22834      0.7293901      10.58221  174.2642 76.98046 127.0577 62.37129 47.20647       99.07658 
1 1 1 -11 5  1  o 621.7524 19.26720 75.51665       4.652262      72.84334       5.430480      82.89056       9.019084  609.8885 22.92766 645.6148 36.11652 -35.72632      42.77945 
1 1 1 -11 5  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -11 5  3  o 276.5271 36.83620 15.44305       3.857457      16.43921       4.735958      13.47959       6.648977  283.0743 44.55286 249.4904 67.14396 33.58395       80.58082 
1 1 1 -11 5  4  o 548.4738 19.37689 58.80302       4.127317      56.63295       5.772657      61.07246       5.903352  535.6774 27.84482 557.1450 27.28365 -21.46759      38.98373 
1 1 1 -11 5  5  o 347.2100 27.05472 23.85793       3.619273      27.51913       5.297363      20.65277       4.956476  370.0514 37.37333 318.9331 40.96396 51.11829       55.45099 
1 1 1 -11 5  6  o 337.4117 28.92263 22.60364       3.753250      21.32596       5.418886      23.78174       5.203461  322.9166 44.38427 342.8940 39.81671 -19.97745      59.62662 
1 1 1 -11 5  7  o 313.6932 31.34413 19.63788       3.767352      8.354649       5.414160      30.22917       5.245521  199.8385 62.68226 388.6581 35.13287 -188.8196      71.85670 
1 1 1 -11 5  8  o 248.0180 48.32669 12.83701       4.487451      10.80506       7.642689      13.90610       5.543664  226.1698 74.79436 255.4393 57.29484 -29.26944      94.21727 
1 1 1 -11 5  9  o 138.5139 55.18671 2.300768       4.460886      -6.384122      8.406490      5.704873       5.263008  137.8846 64.25072 174.4366 61.92141 -36.55196      89.23237 
1 1 1 -11 5  10 o 276.6891 39.40298 15.54711       4.114368      18.68407       6.044165      12.83834       5.616531  298.6760 54.10036 245.0318 59.59546 53.64417       80.48893 
1 1 1 -11 5  11 o 133.6639 53.72423 1.932920       4.266700      -0.6506317     6.338412      4.073624       5.769660  140.1828 61.30276 164.7819 63.61089 -24.59909      88.34237 
1 1 1 -11 5  12 o 729.5328 19.84496 103.9923       5.622416      100.0687       8.139570      107.5728       7.775511  712.9908 29.39609 740.0090 27.05602 -27.01813      39.95195 
1 1 1 -11 5  13 o 422.7308 30.85451 35.38137       5.030378      43.90851       7.365824      27.92812       6.886406  467.9386 40.94469 369.6203 49.19618 98.31830       64.00572 
1 1 1 -11 5  14 o 238.9240 52.92409 11.95373       4.781307      14.25234       7.016421      9.960949       6.533009  257.5502 68.83170 218.8134 68.89103 38.73682       97.38468 
1 1 1 -11 5  15 o 157.7136 60.95084 3.562683       5.301850      0.1949258      7.585042      6.780083       7.413787  158.1106 68.11143 197.0536 72.98110 -38.94301      99.82689 
1 1 1 -11 5  16 o 659.6244 25.93632 85.27205       6.644053      83.66937       9.556814      86.77128       9.243248  648.9039 38.09016 661.6178 36.11058 -12.71387      52.48651 
1 1 1 -11 5  17 o 261.3350 61.63833 14.49549       6.154236      16.93378       8.772994      12.13305       8.635444  278.8500 77.97112 241.3255 79.48930 37.52451       111.3465 
1 1 1 -11 5  18 o 352.8088 46.04388 25.34177       6.158267      27.05079       8.779499      23.68648       8.640378  356.7693 65.78959 331.8544 69.28098 24.91492       95.54121 
1 1 1 -11 5  19 o 261.5820 62.50568 14.73190       6.263033      21.12860       8.809873      8.195685       8.905434  309.3416 74.27192 212.1292 79.70444 97.21233       108.9455 
1 1 1 -11 5  20 o 163.1845 65.63891 3.361450       6.374256      7.399808       9.207723      -0.3549556     8.833063  206.8087 80.21159 164.0177 72.03004 42.79102       107.8064 
1 1 1 -11 5  21 o 133.6830 60.21819 -2.165050      6.586534      -2.781017      9.361430      -1.561213      9.268790  157.5283 71.29765 161.4492 72.17880 -3.920929      101.4551 
1 1 1 -11 5  22 o 283.9951 75.52043 18.60115       8.473443      20.02668       9.829925      14.47873       16.71620  290.8281 82.96368 261.0100 105.8349 29.81808       134.4768 
1 1 1 -11 5  23 o 374.6547 74.27785 32.29779       10.42551      38.45883       13.85011      24.24275       15.83654  393.3697 92.25827 300.5092 107.3334 92.86050       141.5346 
1 1 1 -11 5  24 o 238.7916 77.77973 13.68135       8.276555      16.91359       13.99043      11.94110       10.26561  257.0354 99.10155 227.3658 85.54657 29.66959       130.9173 
1 1 1 -11 5  25 o 209.0215 74.26318 10.41988       7.571640      16.73282       10.79927      4.316126       10.61884  249.3042 88.67793 184.0438 79.93237 65.26044       119.3858 
1 1 1 -11 5  26 o 168.7490 73.01136 4.050224       8.792438      1.428065       15.31794      5.338650       10.73744  185.6354 86.57793 182.1530 79.71906 3.482468       117.6897 
1 1 1 -11 5  27 o 237.9785 81.90778 17.18451       9.164658      20.17395       15.80215      15.66937       11.24990  229.6363 98.60773 220.5645 87.71412 9.071823       131.9744 
1 1 1 -11 5  28 o 165.5260 71.98032 6.335968       8.632682      10.99950       10.92334      -1.422319      14.08902  187.4661 81.24416 157.7565 76.18339 29.70964       111.3756 
1 1 1 -11 5  29 o 223.5757 75.08355 17.01118       7.695970      16.82840       10.72323      17.20533       11.05169  199.5723 83.22473 199.7296 83.97079 -0.1572876     118.2263 
1 1 1 -11 5  30 o 248.0969 73.37220 21.78759       7.563886      9.623713       10.49013      34.96036       10.91650  157.1449 72.72507 279.4664 89.16930 -122.3215      115.0656 
1 1 1 -11 5  31 o 122.7941 58.00752 2.297745       7.265933      7.273034       10.46436      -2.334039      10.09666  139.9414 67.08184 119.4863 59.08612 20.45507       89.39320 
1 1 1 -11 6  1  o 390.8321 22.94590 30.00681       3.467484      23.78858       4.728234      37.24251       5.100414  344.8008 35.83383 433.7639 30.47113 -88.96310      47.03778 
1 1 1 -11 6  2  o 246.8120 37.48244 12.35253       3.479744      14.63514       4.385955      8.474974       5.716472  267.2403 43.77666 202.5736 64.51493 64.66670       77.96520 
1 1 1 -11 6  3  o 328.5417 30.84241 21.47160       3.889137      22.17596       4.895062      20.26591       6.404387  331.7153 38.72738 311.3018 54.98535 20.41351       67.25473 
1 1 1 -11 6  4  o 472.7891 24.49957 43.96619       4.482927      47.93891       5.597396      36.85947       7.486460  492.3830 29.40651 425.8033 46.00413 66.57974       54.59966 
1 1 1 -11 6  5  o 666.3115 17.60456 86.67700       4.555441      90.09863       6.698855      83.73347       6.213251  677.3407 25.46628 653.2522 24.49120 24.08850       35.33200 
1 1 1 -11 6  6  o 519.6281 20.00617 52.80124       4.037239      48.49363       5.783803      56.89444       5.638024  494.8763 30.23973 537.1606 27.11441 -42.28430      40.61567 
1 1 1 -11 6  7  o 558.7514 20.63426 61.08039       4.477499      60.96458       6.353794      61.19463       6.310703  555.2842 29.57041 556.4214 29.30759 -1.137207      41.63345 
1 1 1 -11 6  8  o 388.4436 31.65093 29.99631       4.733146      32.53576       8.514985      28.86082       5.693837  394.8824 57.18985 378.6030 39.29760 16.27942       69.39006 
1 1 1 -11 6  9  o 646.5482 23.07708 81.91050       5.794417      82.17255       10.79287      81.80437       6.868173  638.7859 43.77037 644.9305 27.42208 -6.144592      51.65091 
1 1 1 -11 6  10 o 504.1967 23.68808 49.81812       4.638288      53.38352       7.054830      47.10355       6.155764  517.9261 35.28467 487.2121 32.72380 30.71402       48.12333 
1 1 1 -11 6  11 o 379.7634 31.39693 28.62420       4.588975      28.33665       6.623577      28.88964       6.363797  373.0314 46.74802 377.6025 44.23455 -4.571136      64.35894 
1 1 1 -11 6  12 o 374.4312 33.70951 27.90315       4.849216      36.30248       7.207730      20.95751       6.554390  423.9852 44.43466 317.3095 55.19312 106.6757       70.85703 
1 1 1 -11 6  13 o 521.0987 26.37653 53.39573       5.320457      51.23688       7.644941      55.42345       7.409126  506.6212 39.16049 527.9989 36.35471 -21.37766      53.43415 
1 1 1 -11 6  14 o 503.2537 28.35961 49.88421       5.520031      52.61019       7.966614      47.36687       7.655674  513.2424 40.29283 486.6380 40.88778 26.60443       57.40490 
1 1 1 -11 6  15 o 245.0365 56.55408 12.61493       5.272501      13.79757       7.579010      11.50582       7.339633  253.9441 72.97733 234.2657 72.90089 19.67838       103.1515 
1 1 1 -11 6  16 o 536.1069 29.95155 56.66433       6.210958      53.95552       8.853309      59.28949       8.715553  518.4230 44.40219 544.7029 41.51353 -26.27985      60.78592 
1 1 1 -11 6  17 o 211.5825 65.80607 9.287107       5.981466      28.59084       9.005331      -5.952908      8.001506  367.9339 65.42065 136.2015 63.20273 231.7324       90.96398 
1 1 1 -11 6  18 o 410.8216 39.77776 33.89434       6.266839      32.91616       9.267840      34.71839       8.506343  395.6118 62.39031 409.9667 54.79912 -14.35486      83.03912 
1 1 1 -11 6  19 o 143.4248 61.24985 0.6138771      6.036831      23.19645       8.853029      -19.01238      8.253230  324.8869 72.05428 104.8444 52.11712 220.0425       88.92702 
1 1 1 -11 6  20 o 157.1321 64.88264 2.396861       6.425896      -7.043812      8.910986      12.62487       9.275126  139.6219 65.41576 240.7308 82.41988 -101.1089      105.2248 
1 1 1 -11 6  21 o 707.4865 39.54708 101.1125       10.82227      0.000000       0.000000      101.1125       10.82227  ?        ?        707.4865 39.54708 0.000000       39.54708 
1 1 1 -11 6  22 o 561.6794 43.36569 64.61663       9.386136      71.46103       11.09505      47.38863       17.60268  586.5790 49.15842 427.3763 106.4547 159.2027       117.2567 
1 1 1 -11 6  23 o 321.9433 84.89023 25.33834       10.76519      37.51211       13.36398      2.839784       18.16774  389.1579 90.18899 221.0611 99.75433 168.0967       134.4804 
1 1 1 -11 6  24 o 180.2844 73.46735 5.307224       8.103370      -3.147442      13.85548      9.702543       9.990074  180.0869 83.42622 212.5562 83.24012 -32.46938      117.8510 
1 1 1 -11 6  25 o 129.2017 60.19101 -3.848293      7.371035      -8.843040      10.69555      0.6699126      10.17254  141.4159 67.79665 166.2141 74.85757 -24.79817      100.9953 
1 1 1 -11 6  26 o 242.9958 81.85822 16.72478       9.147694      2.121790       16.17315      23.59407       11.09251  187.9078 88.06735 279.1852 89.97045 -91.27745      125.8989 
1 1 1 -11 6  27 o 222.8516 97.75735 19.32153       16.22946      19.32153       16.22946      0.000000       0.000000  222.8516 97.75735 ?        ?        0.000000       97.75735 
1 1 1 -11 6  28 o 214.6097 79.79289 15.57946       8.879367      11.73617       10.83232      23.45083       15.50228  188.2491 81.24426 220.2374 96.10262 -31.98837      125.8425 
1 1 1 -11 6  29 o 391.2118 52.11939 38.62143       7.721426      33.39799       10.87959      43.92271       10.96035  292.9565 88.30903 366.1331 79.37162 -73.17664      118.7364 
1 1 1 -11 6  30 o 109.2517 53.18276 -3.894487      7.231542      8.792847       10.50216      -15.33387      9.972288  152.5269 71.31999 103.9780 52.45940 48.54897       88.53548 
1 1 1 -11 6  31 o 116.6848 55.79639 0.7270143      7.141671      -0.2775419E-01 9.978249      1.519729       10.22600  122.5206 60.22924 125.9947 61.74026 -3.474190      86.25208 
1 1 1 -11 7  1  o 338.7788 26.16675 22.64511       3.415976      23.19285       4.750756      22.05877       4.915282  340.3786 36.50962 331.1716 38.96307 9.207001       53.39544 
1 1 1 -11 7  2  o 741.9681 16.51655 107.3523       4.759184      107.8565       6.592035      106.8033       6.878079  742.2691 22.86810 738.3368 23.98748 3.932312       33.14136 
1 1 1 -11 7  3  o 331.4365 31.22963 21.84534       3.972318      16.88972       4.949993      30.80960       6.657522  286.8911 45.98132 389.8139 44.79091 -102.9229      64.19118 
1 1 1 -11 7  4  o 712.9352 19.31893 99.29961       5.348858      99.96943       6.543720      97.95103       9.285147  714.2699 23.59035 703.6119 33.98033 10.65802       41.36626 
1 1 1 -11 7  5  o 526.4413 20.62536 54.19515       4.216767      53.13770       5.880800      55.31418       6.049600  518.6337 29.31771 529.1052 29.55946 -10.47150      41.63280 
1 1 1 -11 7  6  f 277.6563 35.62204 15.51788       3.752510      7.313830       5.526433      22.53629       5.111520  190.9199 63.62394 334.0096 40.21424 -143.0897      75.26746 
1 1 1 -11 7  7  o 114.6211 47.90117 0.6780987      3.563130      -1.954239      5.130958      3.129884       4.951867  118.9898 53.41332 150.4248 58.68877 -31.43505      79.35587 
1 1 1 -11 7  8  f 830.6284 20.11626 134.8572       6.489064      157.3799       12.37331      126.3125       7.621218  891.0151 35.75797 802.6256 24.45025 88.38947       43.31797 
1 1 1 -11 7  9  f 726.0914 21.05298 103.0922       5.936533      116.8073       11.66203      98.29512       6.897027  765.2984 39.37215 707.9594 25.08566 57.33899       46.68465 
1 1 1 -11 7  10 o 190.0286 54.48270 7.521266       4.228726      -0.8800793     6.151243      15.04965       5.822900  137.2659 60.19952 266.9843 57.83253 -129.7183      83.47804 
1 1 1 -11 7  11 o 208.8710 53.70129 9.160668       4.380226      7.214977       6.562192      10.72420       5.882539  195.3966 69.16640 224.9975 64.17760 -29.60091      94.35442 
1 1 1 -11 7  12 o 287.4714 44.15881 16.84082       4.772250      18.13683       6.981787      15.70433       6.538009  292.3130 63.33249 271.7266 63.15659 20.58640       89.44137 
1 1 1 -11 7  13 o 309.3324 42.50538 19.37119       4.971247      29.84761       7.469438      11.04064       6.660676  381.9849 51.67839 229.0629 69.10758 152.9220       86.29319 
1 1 1 -11 7  14 o 354.0341 38.07057 25.07862       5.152092      25.30413       7.304869      24.85541       7.267590  350.0399 55.59488 346.7694 55.86393 3.270508       78.81351 
1 1 1 -11 7  15 o 196.6321 61.55274 7.885126       5.223732      13.07678       7.577744      3.184029       7.210851  248.0010 73.46255 171.8223 69.56688 76.17876       101.1746 
1 1 1 -11 7  16 o 166.7708 62.82173 4.433915       5.539212      8.340500       7.906541      0.6681821      7.762697  211.0790 75.79230 162.3453 69.39590 48.73366       102.7632 
1 1 1 -11 7  17 o 181.0330 65.98732 5.816604       6.023013      -3.503049      8.425244      15.55746       8.613529  149.5504 67.66712 267.5145 78.06683 -117.9641      103.3115 
1 1 1 -11 7  18 o 447.0560 37.10868 39.96643       6.384422      44.66670       8.837180      34.83486       9.233744  467.7600 49.39481 407.6950 60.12430 60.06500       77.81245 
1 1 1 -11 7  19 o 697.9873 26.91830 95.94183       7.296645      77.23457       10.21949      115.3960       10.42150  618.3604 42.81941 761.7020 35.23038 -143.3416      55.44981 
1 1 1 -11 7  20 o 304.1209 57.40317 19.77057       6.531151      32.59891       9.702675      9.142328       8.831546  386.9580 66.99119 215.2446 79.66695 171.7134       104.0896 
1 1 1 -11 7  21 o 541.2302 50.47486 60.83780       10.48686      0.000000       0.000000      60.83780       10.48686  ?        ?        541.2302 50.47486 0.000000       50.47486 
1 1 1 -11 7  22 o 369.1049 63.25246 29.86995       8.740590      29.05402       10.16981      32.17637       17.09833  355.2209 76.01674 343.1604 111.7949 12.06046       135.1912 
1 1 1 -11 7  23 o 542.5947 43.75883 60.91352       9.142405      63.56860       14.81230      59.27960       11.61983  525.5650 74.67174 523.2864 58.16253 2.278625       94.65067 
1 1 1 -11 7  24 o 424.5204 54.46979 39.36632       8.772988      38.61740       14.25442      39.82297       11.13083  376.6796 96.89078 410.6033 72.45196 -33.92371      120.9839 
1 1 1 -11 7  25 o 421.3393 47.83604 38.56083       7.688622      20.11084       10.48440      60.02742       11.30908  267.7570 87.55734 515.0006 57.52755 -247.2436      104.7650 
1 1 1 -11 7  26 o 177.2565 74.60673 6.417407       8.740202      -15.08981      15.53977      16.36910       10.57064  151.2901 74.52468 232.6093 86.94718 -81.31917      114.5152 
1 1 1 -11 7  27 o 135.2031 62.20481 -0.4978619     7.513980      6.211483       10.71034      -7.000850      10.54435  174.0942 77.72790 135.1909 65.43530 38.90329       101.6042 
1 1 1 -11 7  28 o 159.6842 70.63927 5.818652       8.642375      18.48826       10.55296      -19.98411      15.06003  218.5700 85.56473 130.7436 65.77181 87.82640       107.9224 
1 1 1 -11 7  29 o 150.5279 66.37634 6.111944       7.571231      5.449432       10.45341      6.842981       10.98072  151.5282 70.94862 156.0356 72.94987 -4.507385      101.7614 
1 1 1 -11 7  30 o 115.4399 55.45964 -1.223698      7.240794      3.833146       10.09109      -6.590512      10.39577  136.9763 65.71710 117.1540 58.27756 19.82227       87.83514 
1 1 1 -11 7  31 o 96.77179 48.22346 -7.637791      7.248565      -3.324484      10.23540      -11.97752      10.26670  116.4171 57.89722 104.4318 52.75299 11.98528       78.32603 
1 1 1 -11 8  1  o 684.4545 17.15761 91.34265       4.560678      88.81898       6.226272      94.26427       6.699211  673.6568 23.79915 693.7498 24.86525 -20.09302      34.41918 
1 1 1 -11 8  2  o 346.8584 26.74136 23.73959       3.574372      24.23012       5.019046      23.23478       5.091586  347.7482 37.77189 340.0241 39.28099 7.724030       54.49507 
1 1 1 -11 8  3  o 615.7692 20.78081 74.10039       4.969450      72.99046       6.074918      76.34544       8.639832  610.1221 25.63868 620.0764 36.03370 -9.954285      44.22409 
1 1 1 -11 8  4  o 966.6569 18.16120 182.3552       6.817810      188.9411       8.531202      170.7148       11.34192  982.6940 22.35445 930.6904 31.38003 52.00360       38.52827 
1 1 1 -11 8  5  o 242.8183 40.26143 12.02077       3.663625      5.460732       5.050966      19.30356       5.321946  171.7725 60.69484 307.2933 46.01074 -135.5208      76.16333 
1 1 1 -11 8  6  o 513.0536 22.36098 51.50734       4.455348      49.53120       6.376006      53.39293       6.228219  499.8195 33.03418 519.6425 31.00373 -19.82300      45.30440 
1 1 1 -11 8  7  o 342.4120 30.28232 23.25767       3.985337      31.55066       5.993004      16.68274       5.336232  396.5901 39.43412 283.9293 50.23250 112.6609       63.86199 
1 1 1 -11 8  8  o 194.0149 55.02588 7.854625       4.337187      13.13941       7.977527      5.637053       5.167653  247.6794 75.82690 174.1936 61.40893 73.48582       97.57446 
1 1 1 -11 8  9  o 597.0579 24.14344 69.81237       5.598136      76.15009       10.34852      67.19043       6.656142  616.3150 43.51584 583.8183 29.45233 32.49670       52.54587 
1 1 1 -11 8  10 o 183.3014 55.91891 6.880724       4.343337      6.974561       6.276224      6.794485       6.016797  192.2092 67.68496 189.3707 66.29869 2.838501       94.74582 
1 1 1 -11 8  11 o 1005.202 17.72831 197.0589       6.920680      189.1279       9.962862      204.4544       9.620740  982.2717 26.11707 1021.961 24.24075 -39.68970      35.63306 
1 1 1 -11 8  12 o 1115.193 17.73709 242.5173       7.681754      254.9402       11.38041      232.1199       10.41143  1140.749 25.68857 1088.889 24.62061 51.86011       35.58198 
1 1 1 -11 8  13 o 108.7856 50.02949 -3.352849      4.853474      -14.72035      6.910743      7.711264       6.817897  99.60739 49.18567 201.4440 70.57170 -101.8366      86.02090 
1 1 1 -11 8  14 o 679.5707 22.58975 90.26524       5.961753      93.22166       8.664558      87.60718       8.215721  688.2267 32.41805 667.3759 31.69912 20.85077       45.34054 
1 1 1 -11 8  15 o 423.3271 35.41115 35.60637       5.768155      46.25669       8.734403      27.36908       7.681465  478.8325 47.60103 364.2561 56.10197 114.5764       73.57506 
1 1 1 -11 8  16 o 799.4914 22.75863 125.0144       7.066232      116.1694       9.862749      134.3431       10.12889  767.6234 33.08429 826.0423 31.57413 -58.41888      45.73288 
1 1 1 -11 8  17 o 118.4245 54.41557 -3.707194      5.725007      3.172851       8.411097      -9.645918      7.814542  180.3911 74.33193 122.1590 58.40060 58.23208       94.52971 
1 1 1 -11 8  18 o 391.4907 41.92690 31.01139       6.275311      37.56683       9.160556      25.21499       8.613910  424.5515 56.99988 341.9511 67.26112 82.60046       88.16487 
1 1 1 -11 8  19 o 178.8179 66.72826 5.656601       6.220884      5.112824       8.766856      6.208087       8.828788  191.1566 76.94733 197.8959 78.01814 -6.739288      109.5798 
1 1 1 -11 8  20 o 717.2311 39.16629 103.6607       10.86810      0.000000       0.000000      103.6607       10.86810  ?        ?        717.2311 39.16629 0.000000       39.16629 
1 1 1 -11 8  21 o 110.7156 53.40583 -9.358487      6.876585      0.2052160      9.713374      -18.96796      9.736589  171.3726 75.39053 117.9692 58.27689 53.40348       95.28865 
1 1 1 -11 8  22 o 304.5866 73.87414 21.45559       8.648618      22.96543       10.15452      17.46720       16.50412  309.3646 82.85928 269.7458 106.5662 39.61884       134.9889 
1 1 1 -11 8  23 f 472.8140 48.51135 47.16697       8.781432      47.50607       14.75611      46.98102       10.92696  435.4063 90.23164 460.1008 62.79269 -24.69455      109.9303 
1 1 1 -11 8  24 o 249.0130 78.34030 15.63618       8.449856      -0.7981230E-01 13.86850      24.91489       10.65620  185.2536 84.96445 307.8172 85.88455 -122.5635      120.8102 
1 1 1 -11 8  25 o 249.5899 74.84456 16.22898       7.829919      12.95004       11.00333      19.59252       11.14437  219.9021 86.96928 258.2042 90.23922 -38.30211      125.3267 
1 1 1 -11 8  26 o 183.8658 76.52592 7.939981       9.041417      -14.03423      16.44910      17.45314       10.82301  154.9323 76.38770 234.9413 87.94749 -80.00906      116.4897 
1 1 1 -11 8  27 o 215.9543 75.34642 14.06400       7.767888      5.672984       10.51002      24.16596       11.53185  169.3764 76.20348 256.5949 91.59739 -87.21844      119.1514 
1 1 1 -11 8  28 o 143.5186 65.57456 2.685704       8.155919      2.951675       9.836078      2.100443       14.59083  149.8811 69.72664 158.5426 76.79511 -8.661560      103.7270 
1 1 1 -11 8  29 o 176.5552 70.62576 11.28559       7.335192      3.761754       10.00391      20.03408       10.78740  143.5154 67.87850 202.1558 83.81754 -58.64046      107.8558 
1 1 1 -11 8  30 o 130.4138 60.14305 3.830501       7.082018      19.54067       9.788039      -13.42975      10.25956  190.7912 79.53362 105.7587 53.33895 85.03249       95.76346 
1 1 1 -11 9  1  o 157.0905 52.08028 4.759346       3.704720      -2.994609      6.546637      8.412275       4.493423  132.1496 59.73410 201.0068 55.65934 -68.85713      81.64634 
1 1 1 -11 9  2  o 520.9592 19.91326 52.97837       4.028784      55.09915       5.623638      50.74229       5.774477  529.3427 27.45022 507.4450 29.42826 21.89767       40.24347 
1 1 1 -11 9  3  o 776.2293 18.77120 117.5635       5.658615      118.1727       6.965254      116.3810       9.704497  777.2828 23.07437 768.6269 32.51094 8.655884       39.86713 
1 1 1 -11 9  4  o 391.9109 29.02291 30.33408       4.385891      27.16515       5.375152      36.64687       7.586561  368.4681 38.11417 425.7056 46.65305 -57.23752      60.24282 
1 1 1 -11 9  5  o 83.81190 39.78308 -4.168255      3.496674      0.6665972      5.053317      -8.609847      4.843444  133.9896 56.58004 88.55408 43.19851 45.43550       71.18576 
1 1 1 -11 9  6  o 576.2649 19.75937 64.83626       4.422046      64.10428       6.202243      65.59305       6.306494  571.4453 27.94770 578.0098 28.09473 -6.564514      39.62812 
1 1 1 -11 9  7  o 393.3177 27.19800 30.48926       4.128889      26.29121       5.924823      34.45293       5.757051  360.9495 43.12056 416.0085 35.98891 -55.05899      56.16569 
1 1 1 -11 9  8  o 720.4630 21.68707 101.4437       6.067929      95.01353       10.57992      104.5957       7.407297  691.0311 39.58849 730.5143 26.10977 -39.48322      47.42329 
1 1 1 -11 9  9  o 183.3385 55.38693 6.880785       4.276298      10.44348       6.445500      4.079568       5.715322  223.5174 68.10514 165.4198 63.45295 58.09756       93.08376 
1 1 1 -11 9  10 o 729.8282 19.38534 103.9442       5.494422      100.7221       7.905013      106.9556       7.642222  716.3888 28.41357 738.6981 26.63942 -22.30927      38.94855 
1 1 1 -11 9  11 o 626.1415 21.80292 76.59888       5.301700      80.80665       7.864820      73.09426       7.177678  640.9445 31.59660 609.9047 30.30358 31.03979       43.77959 
1 1 1 -11 9  12 o 692.1039 21.59398 93.56319       5.804063      96.98794       8.531009      90.61189       7.919436  702.3911 31.27472 679.2379 30.02233 23.15320       43.35261 
1 1 1 -11 9  13 o 418.0595 33.04651 34.60503       5.321532      38.13420       7.908922      31.68553       7.193423  434.6680 47.63247 395.7380 47.77227 38.92999       67.46141 
1 1 1 -11 9  14 o 355.3284 39.40297 25.28599       5.345794      22.67482       7.640955      27.78949       7.481747  329.0504 62.06994 368.1212 53.93368 -39.07080      82.22846 
1 1 1 -11 9  15 o 476.7279 31.60522 44.90531       5.818184      52.85899       8.505832      37.91163       7.976009  513.7852 43.02531 432.7708 48.27982 81.01434       64.66930 
1 1 1 -11 9  16 o 427.6527 36.64197 36.45440       6.026754      33.42832       8.574051      39.40963       8.473082  402.3496 56.42392 439.8595 50.51881 -37.50986      75.73513 
1 1 1 -11 9  17 o 462.3180 35.16426 42.58407       6.266169      31.90424       8.832284      53.40738       8.891414  390.0286 60.25245 514.1056 44.98669 -124.0770      75.19415 
1 1 1 -11 9  18 o 171.0380 65.32919 4.727910       6.042276      1.383947       8.348063      8.407271       8.756716  168.8819 72.07162 212.1754 79.17027 -43.29347      107.0619 
1 1 1 -11 9  19 o 213.3170 69.43967 9.693742       6.597156      6.275898       9.140613      13.40993       9.531216  199.4910 79.14951 246.7042 83.55437 -47.21326      115.0912 
1 1 1 -11 9  20 o 307.3529 60.64377 20.46096       6.981472      26.47421       9.955917      14.64327       9.792691  340.9788 77.00443 253.7630 84.69883 87.21574       114.4708 
1 1 1 -11 9  21 o 495.8451 46.91756 50.82424       8.927204      48.50937       10.58703      56.51991       16.60669  476.6227 58.41979 485.7671 91.38323 -9.144318      108.4609 
1 1 1 -11 9  22 o 225.2417 80.58301 11.35652       8.929923      17.13697       10.55552      -3.195860      16.74811  264.8997 87.91360 199.5952 92.20197 65.30449       127.3970 
1 1 1 -11 9  23 o 260.9477 77.61220 16.65424       8.445247      17.09881       14.22884      16.41245       10.49344  256.3738 99.63455 254.4022 87.63996 1.971542       132.6944 
1 1 1 -11 9  24 o 150.1236 67.57999 -0.3885419     8.279677      -10.91362      13.98987      5.285475       10.27179  157.9711 76.19384 185.7403 79.62284 -27.76923      110.2057 
1 1 1 -11 9  25 o 181.5214 75.95016 6.643775       8.972864      15.97039       16.93790      3.005312       10.57929  228.3592 100.0283 171.9101 76.96568 56.44913       126.2116 
1 1 1 -11 9  26 f 184.6363 76.50626 8.548531       8.979559      -9.861631      15.39750      18.03687       11.05393  155.0197 75.91992 233.6295 88.56993 -78.60976      116.6553 
1 1 1 -11 9  27 o 186.4360 72.25594 10.16953       7.467473      12.71793       9.912910      6.826054       11.35447  196.4046 80.78536 172.1089 78.14535 24.29575       112.3965 
1 1 1 -11 9  28 o 178.8979 74.86506 11.09694       8.720369      3.133968       10.30991      31.11529       16.34675  149.0061 69.98808 222.7088 97.89214 -73.70268      120.3379 
1 1 1 -11 9  29 o 107.9680 52.74272 -5.048837      7.292143      -13.61673      10.19840      3.914021       10.43082  108.5623 54.54626 142.0045 67.77239 -33.44222      86.99651 
1 1 1 -11 9  30 o 105.0147 51.40552 -4.002129      7.034054      -2.728252      9.977141      -5.261057      9.918427  119.5823 59.05850 115.0113 57.16471 4.571007       82.19314 
1 1 1 -11 10 1  o 561.9619 24.03596 61.73384       5.245615      56.93168       6.664216      69.55487       8.504768  537.3397 32.08181 592.6527 37.13929 -55.31299      49.07718 
1 1 1 -11 10 2  o 648.1802 20.72844 82.00377       5.217836      90.18687       9.194704      78.11674       6.337053  675.6167 35.16515 631.7323 25.83011 43.88440       43.63235 
1 1 1 -11 10 3  o 769.2415 19.41092 115.4380       5.798782      113.3243       7.079173      119.7485       10.10938  761.2429 23.94591 779.9294 33.37653 -18.68652      41.07797 
1 1 1 -11 10 4  o 540.7467 23.62758 57.17760       4.961821      53.92986       6.021677      64.04634       8.757189  523.2805 29.75451 567.3035 40.00488 -44.02301      49.85701 
1 1 1 -11 10 5  o 896.5385 16.50838 156.6171       5.747795      165.4483       8.387150      148.7968       7.892594  919.8443 23.47859 872.3752 23.29638 47.46906       33.07515 
1 1 1 -11 10 6  o 554.6168 21.02645 60.06619       4.528841      58.36927       6.463182      61.70310       6.347871  544.1642 30.70905 559.9058 29.29525 -15.74158      42.44122 
1 1 1 -11 10 7  o 183.3212 52.40727 6.928405       3.918144      10.91044       5.765498      3.511152       5.341002  227.6843 63.04786 158.0229 61.14603 69.66144       87.82864 
1 1 1 -11 10 8  o 166.0527 58.33035 5.037552       4.659268      13.44555       8.738810      1.698109       5.507354  252.7014 79.69134 146.3360 60.20574 106.3654       99.87713 
1 1 1 -11 10 9  o 104.2756 47.23273 -2.149527      4.117821      -2.187775      6.348588      -2.121750      5.410266  133.6549 59.74567 122.4743 54.92170 11.18056       81.15379 
1 1 1 -11 10 10 o 314.7754 37.52065 19.83489       4.496306      29.60452       6.680979      11.74640       6.079034  383.0219 45.82451 236.0204 64.48923 147.0016       79.11224 
1 1 1 -11 10 11 o 438.4832 29.26907 37.88444       4.955500      30.87600       7.342412      43.74756       6.715715  390.1475 49.57948 469.3470 37.14784 -79.19949      61.95229 
1 1 1 -11 10 12 o 538.9772 25.15212 56.83685       5.264692      65.75527       7.895415      49.69683       7.064489  576.5488 35.43395 500.6145 36.59051 75.93430       50.93555 
1 1 1 -11 10 13 o 923.9896 19.52514 166.5533       7.006306      169.1132       10.29224      164.3426       9.564551  928.6162 28.53946 915.9326 26.88891 12.68365       39.21115 
1 1 1 -11 10 14 o 377.4700 37.33813 28.41827       5.401701      23.30692       8.039920      32.62393       7.292913  332.7791 64.54013 401.5294 47.70200 -68.75027      80.25527 
1 1 1 -11 10 15 o 157.9583 61.47511 3.448811       5.422844      2.929401       8.048087      3.880725       7.338988  177.0006 72.79607 176.9901 70.69917 0.1052856E-01  101.4773 
1 1 1 -11 10 16 o 687.8295 24.80649 92.74890       6.626345      95.48018       9.483314      90.14322       9.262713  693.6599 35.32032 673.8636 35.52017 19.79633       50.09199 
1 1 1 -11 10 17 o 502.1121 33.18465 50.11739       6.434428      49.77013       9.065795      50.46988       9.133900  494.3015 47.82432 497.7854 47.83741 -3.483917      67.64306 
1 1 1 -11 10 18 o 679.1806 39.21906 92.60592       10.30051      92.60592       10.30051      0.000000       0.000000  679.1806 39.21906 ?        ?        0.000000       39.21906 
1 1 1 -11 10 19 o 512.5262 50.86148 54.35582       9.989864      0.000000       0.000000      54.35582       9.989864  ?        ?        512.5262 50.86148 0.000000       50.86148 
1 1 1 -11 10 20 f 331.7592 57.99669 23.61326       7.200243      28.98987       10.54327      18.91408       9.856724  355.6405 78.44371 284.0095 83.69131 71.63104       114.7068 
1 1 1 -11 10 21 o 134.4943 63.72528 -8.100356      8.892802      -4.297549      10.65662      -16.82194      16.13856  161.0638 74.09428 168.8493 81.53938 -7.785477      110.1755 
1 1 1 -11 10 22 o 439.9686 56.43556 41.85437       9.420499      37.16473       11.26323      52.77370       17.18666  399.0653 75.44003 448.5529 101.0833 -49.48761      126.1310 
1 1 1 -11 10 23 o 139.0797 64.05994 -3.118537      7.999140      30.80508       13.41190      -21.84829      9.965642  332.1562 97.55239 112.1762 56.00205 219.9799       112.4842 
1 1 1 -11 10 24 o 251.3107 79.44337 16.74160       8.680486      18.60480       14.78546      15.76160       10.72304  247.2722 99.79021 238.3655 87.86973 8.906708       132.9631 
1 1 1 -11 10 25 o 221.4779 81.09955 13.92013       9.112574      -13.09269      16.20896      26.40332       11.01876  157.3222 77.22062 295.7758 88.80757 -138.4536      117.6852 
1 1 1 -11 10 26 o 128.1695 60.12277 -2.633185      7.566243      -11.98841      10.80473      6.368839       10.59881  126.9908 62.47490 174.9610 77.77103 -47.97021      99.75694 
1 1 1 -11 10 27 o 134.0397 61.58474 0.6430938      7.330478      5.747190       10.57671      -4.075102      10.16902  163.7829 74.77174 134.7439 64.98321 29.03891       99.06377 
1 1 1 -11 10 28 f 90.90211 46.15693 -21.74179      8.538912      -21.49459      10.38259      -22.25846      15.01024  102.6215 51.97746 122.2609 61.98672 -19.63942      80.89505 
1 1 1 -11 10 29 o 112.1430 54.06052 -2.318216      7.020278      14.46531       9.865976      -19.53172      9.991558  173.4439 76.14848 99.01088 50.23860 74.43304       91.22778 
1 1 1 -11 10 30 o 90.09618 45.25254 -10.98500      6.988619      7.180870       10.12597      -27.50876      9.657466  139.4923 66.62919 86.97798 44.57203 52.51436       80.16305 
1 1 1 -11 11 1  o 278.6654 36.34710 15.53431       3.839847      22.07300       4.591490      0.3214646      7.003473  333.0184 36.07934 154.2916 65.93314 178.7268       75.15915 
1 1 1 -11 11 2  o 535.6346 23.79184 56.05344       4.949083      55.41848       6.090143      57.28810       8.492365  530.8898 29.65752 536.7844 41.04929 -5.894531      50.64200 
1 1 1 -11 11 3  o 677.6180 20.79905 89.59101       5.473390      91.34015       6.714304      86.12624       9.449867  683.4123 25.29824 659.9601 37.02003 23.45215       44.83842 
1 1 1 -11 11 4  o 382.2772 37.30114 29.08547       5.467127      32.07928       7.763476      26.14021       7.700282  397.4940 51.50267 356.2134 57.63158 41.28055       77.29116 
1 1 1 -11 11 5  o 408.6777 25.70185 32.80464       4.058406      32.85246       5.788696      32.75842       5.691444  406.5009 37.07625 406.0620 36.48054 0.4389343      52.01421 
1 1 1 -11 11 6  o 252.0640 41.83311 12.90185       3.951473      16.26414       5.613544      9.599545       5.563249  280.5121 53.48183 215.0352 62.73571 65.47690       82.43832 
1 1 1 -11 11 7  o 320.7214 33.37594 20.44358       4.096196      22.40197       6.060648      18.79671       5.557758  331.9389 48.44151 303.4236 48.82111 28.51529       68.77558 
1 1 1 -11 11 8  o 236.5496 55.41383 11.68061       5.001367      12.41269       9.241529      11.37739       5.947607  246.8444 82.27609 232.7608 63.86696 14.08362       104.1554 
1 1 1 -11 11 9  o 286.7473 40.86285 16.58034       4.421742      17.40958       6.557140      15.88878       5.988105  288.4606 60.46622 276.0411 57.71539 12.41946       83.58965 
1 1 1 -11 11 10 o 286.3938 41.05838 16.54418       4.435957      10.10908       6.533115      22.04882       6.042368  221.6762 68.74549 329.2515 48.72692 -107.5753      84.26301 
1 1 1 -11 11 11 o 409.3375 30.91307 33.07402       4.877947      32.36766       7.200589      33.67313       6.631425  400.6335 47.18461 410.2094 42.23029 -9.575867      63.32286 
1 1 1 -11 11 12 o 208.8669 57.57183 9.079856       4.820120      10.71259       7.248595      7.785548       6.453783  228.4411 72.63676 200.9970 68.75134 27.44411       100.0142 
1 1 1 -11 11 13 o 365.1471 36.58398 26.56544       5.118056      34.09991       7.860600      21.02073       6.743248  409.9050 50.44372 318.5729 56.57699 91.33209       75.79924 
1 1 1 -11 11 14 o 1278.210 18.39047 318.6748       9.128997      315.2640       13.16891      321.8304       12.66645  1268.198 26.73835 1281.907 25.44312 -13.70874      36.90923 
1 1 1 -11 11 15 o 312.6862 48.81844 20.06997       5.734449      16.59352       8.366004      23.15085       7.875660  276.0411 75.74851 330.7519 63.62371 -54.71082      98.92326 
1 1 1 -11 11 16 o 180.1714 64.51685 6.014884       5.725326      5.108262       8.483003      6.773358       7.759015  191.2948 76.13808 197.4880 74.35948 -6.193268      106.4253 
1 1 1 -11 11 17 o 688.2962 35.95400 94.48096       9.577248      0.000000       0.000000      94.48096       9.577248  ?        ?        688.2962 35.95400 0.000000       35.95400 
1 1 1 -11 11 18 o 345.3259 52.78122 24.95992       6.853654      31.27431       10.02493      19.41870       9.391145  377.3333 71.01746 291.7827 80.33272 85.55069       107.2232 
1 1 1 -11 11 19 o 352.0273 53.66521 26.10060       7.104580      20.15692       10.18189      31.74027       9.918088  293.7579 84.63401 379.4397 69.88141 -85.68176      109.7558 
1 1 1 -11 11 20 o 554.0784 36.26719 61.83208       7.760867      65.09112       11.09547      58.71025       10.85938  558.4526 51.74814 528.8428 53.61619 29.60980       74.51554 
1 1 1 -11 11 21 o 208.9259 93.82769 1.568516       15.85212      0.000000       0.000000      1.568516       15.85212  ?        ?        208.9259 93.82769 0.000000       93.82769 
1 1 1 -11 11 22 o 149.4909 67.06269 -0.9654298     8.074883      3.401588       12.60112      -4.008089      10.51825  194.8844 85.79832 157.3989 72.83551 37.48555       112.5449 
1 1 1 -11 11 23 f 186.9688 75.15452 6.882897       8.350155      11.52743       13.73970      4.162787       10.51476  222.9370 93.67224 182.7657 79.45865 40.17130       122.8339 
1 1 1 -11 11 24 o 108.5097 53.19444 -11.34754      7.615557      -28.42909      11.07615      3.967978       10.48796  109.1528 55.09662 176.3190 77.91653 -67.16618      95.42863 
1 1 1 -11 11 25 o 104.9010 52.50021 -18.64385      9.007833      -8.757471      16.94014      -22.54125      10.63618  164.1106 80.21486 111.2707 55.87951 52.83991       97.75962 
1 1 1 -11 11 26 o 103.2513 50.78535 -9.899529      7.127243      -14.75617      10.15357      -5.182161      10.00692  116.5933 57.93172 134.7060 64.83779 -18.11277      86.94839 
1 1 1 -11 11 27 o 215.5205 77.67145 16.17259       8.310647      20.99527       10.13324      6.263913       14.52485  231.3910 85.39728 166.3622 79.55705 65.02879       116.7134 
1 1 1 -11 11 28 o 94.80616 47.94590 -18.20514      8.627606      -18.29922      10.44460      -18.00307      15.30754  105.2369 53.16543 124.7292 63.16800 -19.49236      82.56367 
1 1 1 -11 11 29 o 214.2537 71.60121 17.48496       6.998314      13.16047       10.13474      21.42638       9.675451  163.5682 74.09387 203.9812 81.27380 -40.41301      109.9788 
1 1 1 -11 12 1  f 487.5554 23.98775 46.41183       4.541940      52.04024       5.489963      34.20324       8.085553  515.1062 27.54362 411.4869 51.74119 103.6193       58.61571 
1 1 1 -11 12 2  o 339.8167 32.56726 22.85866       4.245233      21.99790       5.049159      24.93474       7.841548  331.6845 40.00579 347.6820 60.25886 -15.99750      72.32976 
1 1 1 -11 12 3  o 509.7918 25.29853 50.79335       5.008596      48.12066       6.149762      56.05876       8.631769  494.1888 32.21955 530.9236 42.21243 -36.73474      53.10357 
1 1 1 -11 12 4  o 134.5357 54.23441 1.754377       4.362081      4.832593       5.316455      -4.586634      7.630478  169.4969 61.96358 138.4394 63.32022 31.05750       88.59422 
1 1 1 -11 12 5  o 457.4348 24.27302 40.99622       4.296591      40.53725       6.064318      41.45883       6.088348  452.7505 34.75537 457.9589 34.48612 -5.208435      48.96150 
1 1 1 -11 12 6  o 593.6469 23.95198 68.84909       5.522015      64.68752       9.335828      71.08852       6.848459  570.2477 42.46041 602.3217 29.27766 -32.07397      51.57585 
1 1 1 -11 12 7  o 251.6972 50.80307 13.06488       4.794719      13.66624       8.259826      12.75925       5.888367  255.2048 76.94942 246.6630 61.64244 8.541779       98.59515 
1 1 1 -11 12 8  o 359.7506 38.12969 25.79426       5.245922      26.10769       9.677885      25.66385       6.242584  350.9063 73.37717 356.7371 46.14093 -5.830780      86.67869 
1 1 1 -11 12 9  f 681.6030 20.65737 90.62666       5.468077      92.82279       8.094429      88.78320       7.416080  688.0004 30.29490 673.2707 28.36329 14.72968       41.50010 
1 1 1 -11 12 10 o 139.4508 55.24430 2.252817       4.446766      4.184225       6.635791      0.6785739      5.990895  174.6077 67.99004 145.4628 61.52511 29.14488       91.69507 
1 1 1 -11 12 11 o 363.4100 34.34772 26.20849       4.790082      25.63929       7.168067      26.66778       6.438853  353.9912 53.83801 363.3691 46.70960 -9.377960      71.27635 
1 1 1 -11 12 12 o 769.8045 21.00202 115.6751       6.278697      117.1289       9.140846      114.3764       8.639209  772.3943 30.47329 763.6254 29.13169 8.768921       42.15776 
1 1 1 -11 12 13 o 534.5845 27.45030 56.17351       5.679687      56.42019       8.472891      55.97222       7.653973  531.7097 41.35801 530.8974 37.36164 0.8122559      55.73489 
1 1 1 -11 12 14 o 361.6627 39.59930 26.25681       5.470957      22.87185       8.070632      29.13481       7.441773  328.2160 65.61058 376.8850 52.24954 -48.66901      83.87349 
1 1 1 -11 12 15 o 377.3513 40.44405 28.67705       5.834552      32.29467       8.705883      25.72735       7.861222  393.3860 58.78908 349.8345 60.02410 43.55145       84.01814 
1 1 1 -11 12 16 o 351.4514 45.74453 25.25614       6.095587      21.49161       8.896544      28.58712       8.368584  311.8452 74.48401 367.7207 60.72061 -55.87555      96.09818 
1 1 1 -11 12 17 o 214.0987 66.99375 9.783881       6.188756      15.15100       9.239364      5.416226       8.334809  260.2288 81.92649 190.4809 75.57851 69.74788       111.4633 
1 1 1 -11 12 18 o 549.5781 47.21779 61.87151       9.979877      0.000000       0.000000      61.87151       9.979877  ?        ?        549.5781 47.21779 0.000000       47.21779 
1 1 1 -11 12 19 o 515.4175 55.48334 55.85562       10.93082      55.85562       10.93082      0.000000       0.000000  515.4175 55.48334 ?        ?        0.000000       55.48334 
1 1 1 -11 12 20 o 651.9562 31.69814 84.78179       8.025649      82.68244       11.40459      86.84141       11.29615  632.6505 46.74925 649.8232 45.03967 -17.17267      64.91582 
1 1 1 -11 12 21 o 276.3415 79.21384 18.44669       8.939899      13.48094       10.45299      31.97190       17.25121  239.0894 86.96409 331.7942 112.4098 -92.70471      142.1222 
1 1 1 -11 12 22 o 232.9058 78.02696 13.32298       8.310989      25.87437       13.48717      5.639325       10.55259  301.1756 99.34723 191.8780 81.43373 109.2976       128.4575 
1 1 1 -11 12 23 o 162.9385 70.74973 2.765527       8.315364      -1.449860      13.35775      5.432651       10.62517  174.7415 81.27995 185.8438 80.33439 -11.10233      114.2805 
1 1 1 -11 12 24 o 117.3466 57.30050 -10.73495      8.581347      -25.75076      16.24017      -4.918344      10.10767  141.1666 70.62727 142.8596 67.76119 -1.692963      97.87640 
1 1 1 -11 12 25 o 133.7599 63.20585 -3.386359      8.637755      4.807499       15.98138      -6.767841      10.26653  182.8966 86.28620 135.0906 65.18678 47.80598       108.1417 
1 1 1 -11 12 26 o 203.4171 72.39075 12.62273       7.197464      15.49749       10.30926      9.889073       10.05308  207.4020 83.45780 180.9357 78.17736 26.46632       114.3543 
1 1 1 -11 12 27 o 95.99630 48.31784 -16.41527      8.188334      -21.40610      10.07852      -6.723679      14.04456  101.7485 51.49915 138.4646 68.68516 -36.71605      85.84762 
1 1 1 -11 12 28 o 151.1097 68.11992 7.434879       8.447203      2.858952       9.901810      19.66826       16.19006  138.0004 65.90850 172.3760 82.84386 -34.37558      105.8633 
1 1 1 -11 12 29 o 110.8756 53.78071 -2.197941      7.220129      4.916035       12.71206      -5.585773      8.772449  138.2389 67.96120 110.5071 54.72233 27.73174       87.25398 
1 1 1 -11 13 1  o 511.5518 27.55630 51.29325       5.454236      51.29325       5.454236      0.000000       0.000000  511.5518 27.55630 ?        ?        0.000000       27.55630 
1 1 1 -11 13 2  o 750.8268 22.22693 109.9509       6.481077      109.9509       6.481077      0.000000       0.000000  750.8268 22.22693 ?        ?        0.000000       22.22693 
1 1 1 -11 13 3  o 857.8035 24.07102 143.6462       8.018816      143.6462       8.018816      0.000000       0.000000  857.8035 24.07102 ?        ?        0.000000       24.07102 
1 1 1 -11 13 4  o 651.5923 22.68955 82.84450       5.741560      82.94702       7.035368      82.64005       9.935016  651.2004 27.81917 646.3791 39.77096 4.821289       48.53489 
1 1 1 -11 13 5  o 856.1224 17.19964 142.7282       5.718514      142.4257       8.042034      143.0375       8.133138  854.0134 24.24785 855.8010 24.47132 -1.787659      34.45002 
1 1 1 -11 13 6  o 182.3648 53.94804 6.754385       4.088636      8.222828       5.786949      5.290747       5.777473  203.0200 64.93835 176.9340 64.60771 26.08604       91.60319 
1 1 1 -11 13 7  o 343.2345 38.51477 23.49183       5.045305      38.96751       9.289900      17.01766       6.008671  437.9906 55.88984 287.0433 55.91217 150.9473       79.05596 
1 1 1 -11 13 8  f 676.2076 23.47372 89.28848       6.164387      91.98703       10.93037      88.02987       7.464780  681.1082 41.52119 670.5032 28.66739 10.60498       50.45620 
1 1 1 -11 13 9  o 626.8885 22.46528 76.71574       5.469280      79.25488       7.791900      74.24978       7.678801  635.5405 31.56982 614.1757 32.30741 21.36475       45.17104 
1 1 1 -11 13 10 o 535.4019 25.34759 56.05537       5.270412      58.81625       7.758502      53.68967       7.181834  545.1112 36.86594 521.0159 35.70958 24.09534       51.32515 
1 1 1 -11 13 11 o 285.9932 44.41024 16.60204       4.772507      13.41837       6.926989      19.47884       6.584700  251.7753 68.85934 306.3957 57.44883 -54.62044      89.67707 
1 1 1 -11 13 12 o 479.6871 29.37738 45.33192       5.446300      45.69476       8.204926      45.04613       7.281888  477.1354 44.80450 475.3327 39.81411 1.802673       59.93836 
1 1 1 -11 13 13 o 954.3690 19.98342 177.8568       7.406520      174.7960       10.97343      180.4180       10.03779  942.8279 29.96968 959.0184 26.95152 -16.19049      40.30591 
1 1 1 -11 13 14 o 299.9330 49.41086 18.55680       5.554931      27.82141       8.392329      11.33284       7.410654  363.6464 61.62665 231.6499 73.42167 131.9965       95.85711 
1 1 1 -11 13 15 o 485.1890 33.08176 46.78819       6.196251      41.63391       9.311109      50.88505       8.301228  448.7525 54.54957 502.2069 42.97691 -53.45438      69.44544 
1 1 1 -11 13 16 o 180.5043 67.11900 5.763976       6.282980      -6.117779      9.390224      15.39514       8.454249  147.8337 68.55363 263.0068 77.51079 -115.1730      103.4772 
1 1 1 -11 13 17 o 466.7908 37.12578 43.77381       6.674555      50.94510       9.819440      37.61480       9.100050  496.3456 51.70063 423.1383 56.81266 73.20724       76.81557 
1 1 1 -11 13 18 o 801.5948 25.72625 126.6478       8.008652      139.2430       11.83336      116.0030       10.87866  834.2493 36.52449 761.2868 36.79589 72.96252       51.84569 
1 1 1 -11 13 19 o 305.4080 62.79690 20.48807       7.199356      16.83690       10.54115      23.68014       9.856185  266.9227 87.81873 318.5728 79.82754 -51.65015      118.6784 
1 1 1 -11 13 20 o 411.1876 55.66722 36.30433       8.660769      41.22184       10.62961      26.59235       14.93820  430.9875 65.57542 314.1474 104.5997 116.8401       123.4554 
1 1 1 -11 13 21 o 189.4869 77.87583 5.982823       9.202322      8.947100       10.90159      -1.365222      17.16391  211.2106 85.52908 200.3657 92.83227 10.84488       126.2262 
1 1 1 -11 13 22 o 162.8896 70.29266 2.676529       8.107169      -7.416385      12.99975      9.100329       10.37105  160.1655 76.22353 204.7364 83.23667 -44.57085      112.8644 
1 1 1 -11 13 23 o 140.3306 63.98819 -1.083953      7.716671      13.34053       12.35408      -10.31225      9.881456  220.2274 90.33824 129.6490 62.89366 90.57841       110.0755 
1 1 1 -11 13 24 o 193.6346 77.79475 9.842442       8.942248      6.161453       16.22507      11.44835       10.71680  191.4355 89.22325 202.3905 83.69821 -10.95505      122.3363 
1 1 1 -11 13 25 o 118.9969 56.29232 -3.474604      6.885937      -0.7804835     9.733965      -6.173401      9.742411  145.4021 68.20228 131.1691 63.34555 14.23299       93.08174 
1 1 1 -11 13 26 o 128.0884 58.76284 0.5000584      6.640184      0.3229707      9.862626      0.6468853      8.980514  142.7702 67.48656 140.2546 65.69890 2.515610       94.18482 
1 1 1 -11 13 27 o 140.4060 65.14442 3.322535       8.496251      -1.057878      10.19194      13.30080       15.38251  133.3984 64.51075 169.3443 81.21755 -35.94591      103.7204 
1 1 1 -11 13 28 o 142.6910 66.97972 5.832413       9.417446      4.155084       12.49741      8.036359       14.32555  141.3391 69.04512 148.9361 73.00155 -7.597031      100.4811 
1 1 1 -11 14 1  o 243.9048 45.47391 12.10676       4.148893      7.808904       4.964306      22.06236       7.555557  196.8533 59.72274 327.1183 61.73829 -130.2651      85.89774 
1 1 1 -11 14 2  o 606.6723 21.25260 71.73779       5.007192      78.51791       6.106774      57.82772       8.746969  634.2626 24.79218 540.1730 42.02705 94.08954       48.79473 
1 1 1 -11 14 3  o 345.9803 40.57922 23.88174       5.348794      23.88174       5.348794      0.000000       0.000000  345.9803 40.57922 ?        ?        0.000000       40.57922 
1 1 1 -11 14 4  o 364.1492 36.86697 26.31672       5.141840      36.35303       6.258261      5.468239       9.019943  428.3135 38.01915 201.7146 79.06735 226.5989       87.73312 
1 1 1 -11 14 5  o 581.2480 22.34078 65.90376       5.042985      63.79272       7.102452      68.05012       7.161633  569.5717 32.24169 588.5031 31.44927 -18.93134      45.03979 
1 1 1 -11 14 6  o 518.3212 23.39694 52.43828       4.709622      53.60719       6.594587      51.22150       6.728246  521.7878 32.70896 509.6712 34.19064 12.11664       47.31677 
1 1 1 -11 14 7  o 323.5367 41.76908 20.99730       5.125602      10.89234       8.867081      26.06813       6.281356  236.0854 80.58768 359.9449 45.98658 -123.8595      92.78545 
1 1 1 -11 14 8  o 384.0722 44.83422 29.60350       6.561441      0.000000       0.000000      29.60350       6.561441  ?        ?        384.0722 44.83422 0.000000       44.83422 
1 1 1 -11 14 9  o 604.2991 26.26453 71.43936       6.163814      59.85088       10.74752      77.11913       7.524202  545.2362 51.36228 626.9684 30.90202 -81.73218      59.94179 
1 1 1 -11 14 10 o 697.5725 32.06409 95.61559       8.686328      95.61559       8.686328      0.000000       0.000000  697.5725 32.06409 ?        ?        0.000000       32.06409 
1 1 1 -11 14 11 o 279.9772 48.79999 16.09269       5.113146      17.46929       7.595967      14.95211       6.914183  286.0299 69.14596 265.0462 67.10633 20.98367       96.35571 
1 1 1 -11 14 12 o 452.7427 31.33471 40.53413       5.475528      43.18506       8.356934      38.54004       7.248048  462.2415 47.21611 437.8604 43.18682 24.38113       63.98799 
1 1 1 -11 14 13 o 1065.835 19.24899 221.8549       7.967570      224.3292       11.97967      219.8922       10.66949  1067.946 28.88468 1058.637 25.95186 9.308838       38.83071 
1 1 1 -11 14 14 o 441.3723 36.42944 38.92722       6.188525      37.66853       9.184244      39.97398       8.375369  425.6871 56.98510 442.1107 49.63801 -16.42361      75.57271 
1 1 1 -11 14 15 o 311.5750 52.38479 20.26463       6.113715      28.78725       9.227629      13.59635       8.162257  365.3206 67.52851 249.0505 76.77538 116.2701       102.2475 
1 1 1 -11 14 16 o 238.8764 65.48991 12.43796       6.256798      18.73826       9.375221      7.378366       8.401534  287.3516 80.69292 203.1133 77.16451 84.23831       111.6499 
1 1 1 -11 14 17 o 349.6905 50.56819 25.49030       6.667921      31.44758       9.791230      20.33794       9.105766  378.8711 69.09110 298.9875 77.70765 79.88361       103.9810 
1 1 1 -11 14 18 o 475.9292 39.46671 45.93000       7.228776      55.44999       10.65250      37.80415       9.841647  514.0394 54.17727 418.4788 62.47038 95.56067       82.69054 
1 1 1 -11 14 19 o 297.3417 62.19447 19.56752       6.950983      6.700469       9.958834      31.79047       9.706375  201.5688 81.70435 376.3514 68.95132 -174.7826      106.9106 
1 1 1 -11 14 20 o 497.6765 46.80139 51.98713       8.939275      44.62208       10.68263      69.19212       16.32741  447.5773 63.21825 538.8416 80.49146 -91.26428      102.3495 
1 1 1 -11 14 21 o 131.7211 61.40277 -4.288711      7.689748      -14.74234      12.06491      2.863289       9.979398  140.0552 68.29049 176.0671 76.95978 -36.01184      102.8902 
1 1 1 -11 14 22 o 288.2914 71.86066 20.82395       8.017036      16.37220       12.58079      23.86773       10.40279  238.6377 93.42357 293.8271 85.80640 -55.18935      126.8491 
1 1 1 -11 14 23 o 230.6952 74.15340 14.33417       7.538828      22.11913       11.17232      7.826280       10.21492  266.3714 90.46088 188.2882 80.02294 78.08325       120.7760 
1 1 1 -11 14 24 o 419.7131 58.24027 42.65845       9.237167      14.37492       16.55796      55.43801       11.13007  206.5616 94.01146 472.6019 62.14930 -266.0403      112.6973 
1 1 1 -11 14 25 o 143.4207 63.07120 3.184665       6.792922      8.558767       9.636353      -2.123671      9.577208  175.0250 76.08025 137.8050 65.53645 37.22000       100.4153 
1 1 1 -11 14 26 o 258.0357 72.94527 21.22657       7.634853      46.24432       13.61317      9.746305       9.221704  327.2662 98.81156 170.4994 74.26771 156.7669       123.6099 
1 1 1 -11 14 27 o 104.2911 51.67486 -8.524015      7.865319      -4.516603      9.630747      -16.55015      13.62954  121.2622 59.52128 119.2477 60.30142 2.014481       84.72923 
1 1 1 -11 14 28 o 213.9745 76.33247 19.63898       8.007241      16.98355       9.722917      25.23595       14.11581  180.0500 77.33259 181.5668 84.14513 -1.516769      114.2836 
1 1 1 -11 15 1  o 1040.973 17.09039 210.9128       6.909068      215.7742       8.316561      200.0838       12.41231  1052.384 20.34894 1011.014 31.61312 41.36969       37.59612 
1 1 1 -11 15 2  o 617.3367 21.77179 74.29485       5.219683      82.77489       6.332150      56.31654       9.219903  651.2022 25.03844 532.2474 45.02746 118.9548       51.52082 
1 1 1 -11 15 3  o 526.4514 29.12145 54.37254       5.930730      54.37254       5.930730      0.000000       0.000000  526.4514 29.12145 ?        ?        0.000000       29.12145 
1 1 1 -11 15 4  o 1057.864 17.91098 217.9235       7.358293      230.0972       8.866631      190.9897       13.18849  1086.423 21.01510 986.5352 34.42345 99.88831       40.33124 
1 1 1 -11 15 5  o 857.1110 20.72961 143.2218       6.900111      144.6558       8.471449      140.3954       11.89378  860.5405 25.34886 845.1503 36.23749 15.39026       44.22353 
1 1 1 -11 15 6  o 373.6367 31.92154 27.57083       4.587470      26.62943       6.518090      28.49486       6.457656  363.5355 47.28801 376.8543 45.01472 -13.31879      65.28768 
1 1 1 -11 15 7  o 467.1175 30.49622 42.95090       5.501871      43.80944       9.290102      42.48712       6.828096  465.8320 52.25349 462.7675 38.33875 3.064484       64.80962 
1 1 1 -11 15 8  o 230.9673 52.97383 11.08094       4.650460      4.959122       6.579062      17.19413       6.574429  179.7420 68.28453 286.8073 60.90693 -107.0653      91.50099 
1 1 1 -11 15 9  o 478.1252 28.26229 44.96161       5.224480      47.09395       7.540126      42.99253       7.245724  486.2468 40.29253 464.3635 40.58643 21.88333       57.19044 
1 1 1 -11 15 10 o 386.7868 36.48916 29.79641       5.416277      31.53592       8.340818      28.52804       7.122251  391.5010 56.49378 374.2323 50.27768 17.26871       75.62666 
1 1 1 -11 15 11 o 827.6514 24.73821 134.1625       7.951401      121.9981       14.82092      139.0788       9.422194  777.9935 49.30856 841.3873 28.83554 -63.39380      57.12112 
1 1 1 -11 15 12 o 424.7205 33.96040 35.86493       5.554648      26.15278       8.272557      43.83860       7.495690  352.0303 62.81470 467.1954 41.75275 -115.1651      75.42532 
1 1 1 -11 15 13 o 449.8265 34.29177 40.28412       5.945368      49.74777       9.208969      33.52045       7.785254  494.3570 48.59496 404.1055 50.72557 90.25156       70.24638 
1 1 1 -11 15 14 o 480.3938 33.16764 45.91013       6.149952      64.15932       9.566017      33.05373       8.029143  563.4293 44.06937 399.5590 53.05600 163.8703       68.97137 
1 1 1 -11 15 15 o 284.4223 57.81442 17.23697       6.168344      19.11132       9.384114      15.81103       8.185022  290.7355 80.40891 266.4797 75.59614 24.25583       110.3647 
1 1 1 -11 15 16 o 361.7301 46.25661 26.92361       6.349285      19.31181       9.461947      33.15866       8.563601  290.6094 80.87428 396.4762 57.27819 -105.8669      99.10318 
1 1 1 -11 15 17 o 520.7624 34.60244 54.36528       6.958178      68.23756       10.20796      42.32567       9.509794  577.0414 45.93192 447.9712 55.87797 129.0702       72.33318 
1 1 1 -11 15 18 o 253.0608 68.29684 14.49507       6.867814      18.24326       9.952115      11.08725       9.489501  276.1580 84.71741 226.4213 82.78255 49.73668       118.4483 
1 1 1 -11 15 19 o 371.1350 59.45222 30.25569       8.279700      20.69062       10.02536      50.77610       14.68416  289.1727 84.17477 456.8072 85.92668 -167.6345      120.2863 
1 1 1 -11 15 20 o 283.4857 80.95795 20.29929       9.355089      27.55075       12.31809      10.41679       14.38017  318.7214 93.45658 224.4619 95.15088 94.25949       133.3710 
1 1 1 -11 15 21 o 182.4491 71.78872 6.887633       7.461625      6.675074       12.35827      7.009574       9.360328  197.9787 86.10793 189.6190 78.30352 8.359604       116.3874 
1 1 1 -11 15 22 o 281.3040 70.73673 20.18456       7.719862      25.05141       12.57706      17.24250       9.778690  280.0811 95.97535 244.9388 84.58985 35.14232       127.9324 
1 1 1 -11 15 23 o 134.5014 63.14992 -3.010258      8.379423      -20.66641      17.01611      2.641975       9.627691  147.3253 73.49010 161.1248 72.67113 -13.79945      103.3532 
1 1 1 -11 15 24 o 215.2197 71.80052 13.53797       7.037457      22.93619       10.23296      5.103955       9.693840  258.8023 86.58089 164.3577 73.62302 94.44456       113.6512 
1 1 1 -11 15 25 o 167.8814 69.61397 8.184923       7.442253      29.91044       12.99957      -2.407480      9.076973  253.3624 96.04935 131.3564 62.83704 122.0060       114.7779 
1 1 1 -11 15 26 o 253.8811 65.48230 19.35960       6.498507      11.38281       9.258889      27.10424       9.123167  172.3508 74.74608 272.0026 80.61404 -99.65173      109.9345 
1 1 1 -11 15 27 o 200.7451 74.41405 16.42435       7.711149      24.57147       9.436233      0.4733901E-01  13.37870  232.6410 82.87778 136.5773 67.62259 96.06369       106.9651 
1 1 1 -11 16 1  o 887.4121 18.02176 153.3439       6.210842      154.8519       7.480280      149.9969       11.14405  891.2183 21.61254 874.8459 32.80072 16.37231       39.28090 
1 1 1 -11 16 2  o 554.5319 28.08396 60.28089       6.028291      60.28089       6.028291      0.000000       0.000000  554.5319 28.08396 ?        ?        0.000000       28.08396 
1 1 1 -11 16 3  o 594.9828 27.27076 69.21180       6.301293      69.21180       6.301293      0.000000       0.000000  594.9828 27.27076 ?        ?        0.000000       27.27076 
1 1 1 -11 16 4  o 804.4442 21.31420 126.2078       6.658754      134.9054       8.285002      110.3393       11.19083  830.8853 25.67577 747.4907 38.68282 83.39459       46.42850 
1 1 1 -11 16 5  o 394.9833 33.02121 30.83447       5.018773      28.79537       5.876451      36.33081       9.647887  379.9168 40.45108 420.9219 60.78138 -41.00504      73.01141 
1 1 1 -11 16 6  o 847.2957 26.16713 140.4284       8.610316      149.8594       12.36856      131.5604       11.99374  872.2701 36.51237 816.8647 37.80739 55.40533       52.55998 
1 1 1 -11 16 7  f 671.9761 29.89729 88.58092       7.802139      97.43935       11.23610      80.33268       10.84222  700.3359 41.49746 634.6613 44.26663 65.67468       60.67598 
1 1 1 -11 16 8  o 861.9092 19.38455 144.9194       6.488513      147.7794       9.168031      142.0491       9.184277  868.4413 27.18364 851.2669 27.78121 17.17438       38.86832 
1 1 1 -11 16 9  o 344.9343 38.07130 23.81488       5.014921      20.31944       7.085781      27.32295       7.098575  311.2212 60.80651 365.5714 51.42154 -54.35025      79.63420 
1 1 1 -11 16 10 o 723.7918 21.88478 102.4223       6.151540      110.6021       9.045499      95.38414       8.390557  749.5486 31.07454 696.0862 31.03844 53.46240       43.92052 
1 1 1 -11 16 11 o 160.8862 60.75806 4.117590       5.189128      11.56075       7.789104      -1.822065      6.958080  234.3642 75.37859 141.4248 62.93164 92.93947       98.19534 
1 1 1 -11 16 12 o 380.2067 46.15439 29.43753       6.675201      25.92613       12.78571      30.75326       7.826523  335.3982 94.25105 385.6790 53.71134 -50.28082      108.4812 
1 1 1 -11 16 13 o 244.1792 61.83953 12.81638       5.870358      19.55068       8.624371      7.002778       8.013163  297.4004 74.75585 199.9377 75.50292 97.46271       106.2503 
1 1 1 -11 16 14 o 211.0535 66.10565 9.434542       6.024104      12.37128       8.968976      7.020788       8.131237  240.2429 81.05404 199.9842 75.92806 40.25870       111.0623 
1 1 1 -11 16 15 f 137.7728 59.85564 -0.1349720     5.958278      4.460592       8.837665      -3.964433      8.067462  187.7780 76.64545 142.2316 65.07428 45.54649       100.5445 
1 1 1 -11 16 16 o 418.8948 42.37597 35.79976       6.798879      29.27691       9.914112      41.59094       9.341546  361.8593 73.06517 444.6799 55.28669 -82.82059      91.62498 
1 1 1 -11 16 17 o 398.7346 44.12135 32.78889       6.717701      39.05074       10.08860      27.80091       9.004148  423.4076 63.29681 353.1093 68.12910 70.29831       92.99495 
1 1 1 -11 16 18 o 213.8459 69.74825 10.30358       6.654708      13.36753       10.08830      7.943343       8.854335  238.7493 85.62534 201.9533 78.56545 36.79602       116.2077 
1 1 1 -11 16 19 o 260.7054 76.91759 16.68288       8.321273      16.14069       10.56784      17.56758       13.49928  251.3611 87.87256 257.2804 97.79576 -5.919312      131.4747 
1 1 1 -11 16 20 o 399.9922 51.82352 35.07975       7.860958      41.25722       13.18837      31.67561       9.790152  394.5422 88.27966 361.3331 72.29184 33.20911       114.1026 
1 1 1 -11 16 21 o 309.9016 66.26733 23.38301       7.733875      16.81528       13.12181      26.87895       9.573429  236.7937 94.55348 320.3122 77.74534 -83.51848      122.4120 
1 1 1 -11 16 22 o 323.9956 60.68432 25.36875       7.355006      5.918825       10.84244      41.94812       10.01041  179.8904 79.37225 413.2099 64.48721 -233.3195      102.2671 
1 1 1 -11 16 23 o 128.9753 62.35717 -6.887082      9.508845      0.000000       0.000000      -6.887082      9.508845  ?        ?        128.9753 62.35717 0.000000       62.35717 
1 1 1 -11 16 24 o 192.6923 69.21924 11.07714       6.595275      3.246270       9.169038      19.47236       9.493689  151.5029 69.33773 233.3993 83.13166 -81.89638      108.2525 
1 1 1 -11 16 25 o 119.9206 58.41694 -5.260652      8.768441      0.000000       0.000000      -5.260652      8.768441  ?        ?        119.9206 58.41694 0.000000       58.41694 
1 1 1 -11 16 26 o 170.5337 70.73285 10.95288       7.686386      14.84748       9.516264      3.643342       13.03707  182.0288 77.29716 145.4750 70.94532 36.55383       104.9194 
1 1 1 -11 17 1  o 708.0676 20.59850 97.75691       5.664196      97.23077       6.788616      98.96245       10.27594  705.5078 24.77716 708.0885 37.50217 -2.580750      44.94798 
1 1 1 -11 17 2  o 826.9272 30.44604 134.0210       9.777461      134.0210       9.777461      0.000000       0.000000  826.9272 30.44604 ?        ?        0.000000       30.44604 
1 1 1 -11 17 3  o 308.0964 49.31954 19.33319       5.702057      19.33319       5.702057      0.000000       0.000000  308.0964 49.31954 ?        ?        0.000000       49.31954 
1 1 1 -11 17 4  o 711.8644 21.51460 98.89658       5.947832      100.1499       7.007949      95.66850       11.24711  715.6894 25.21381 694.0966 41.92139 21.59277       48.91972 
1 1 1 -11 17 5  o 767.4549 22.76551 115.0469       6.785131      114.6729       8.293585      115.8038       11.79919  765.0706 27.91340 764.3372 39.88850 0.7334595      48.68522 
1 1 1 -11 17 6  o 504.0575 38.95093 50.52317       7.565591      64.15600       10.98256      38.21112       10.43700  564.0396 50.67878 428.8379 64.68002 135.2016       82.16960 
1 1 1 -11 17 7  o 442.9051 30.63143 38.72585       5.236366      54.75288       7.663199      24.68808       7.171873  524.9243 37.84498 346.0811 55.21714 178.8432       66.94158 
1 1 1 -11 17 8  o 495.5938 32.48277 48.57635       6.217239      51.98067       7.747396      42.41805       10.42007  510.6015 39.37418 452.7007 60.80699 57.90082       72.44181 
1 1 1 -11 17 9  o 115.9480 52.15257 -2.062937      4.919098      -1.156434      6.972874      -2.961054      6.940549  145.0367 63.83875 136.3544 61.58169 8.682297       88.70000 
1 1 1 -11 17 10 o 176.8042 62.50661 5.817650       5.357713      3.672571       7.711921      7.818864       7.448825  177.8815 71.97021 204.0907 73.53589 -26.20926      102.8943 
1 1 1 -11 17 11 o 137.7978 58.18635 0.8221129      5.344051      -0.1288224     8.017530      1.582364       7.168756  159.6585 69.39847 160.7276 67.60439 -1.069092      96.88395 
1 1 1 -11 17 12 o 373.0885 40.78719 28.11339       5.813409      21.11707       8.539652      34.15597       7.936271  310.4683 72.19255 407.3789 51.30143 -96.91061      88.56410 
1 1 1 -11 17 13 o 569.2233 29.48113 64.10820       6.494767      49.76958       9.331212      77.58198       9.045428  492.9454 49.40797 622.8240 37.57283 -129.8785      62.07145 
1 1 1 -11 17 14 o 438.0194 46.16283 39.25826       7.734359      35.06126       16.21263      40.49485       8.800325  375.5840 106.3403 441.8305 52.30300 -66.24649      118.5068 
1 1 1 -11 17 15 o 321.1443 52.20880 21.71377       6.287701      17.01830       9.405735      25.50749       8.454447  271.6729 82.15852 341.2729 66.17887 -69.59991      105.4972 
1 1 1 -11 17 16 o 262.1665 63.34710 15.26191       6.377641      18.75264       9.820591      12.71603       8.386843  280.9224 83.72569 236.9281 78.35104 43.99431       114.6685 
1 1 1 -11 17 17 o 307.6255 58.52632 20.78769       6.736522      15.05950       9.918745      25.69234       9.178069  250.3392 85.23386 332.8333 73.01373 -82.49408      112.2311 
1 1 1 -11 17 18 o 93.97626 46.72747 -14.66437      6.653308      -6.335286      9.704290      -22.05215      9.139487  143.7070 67.62667 105.3439 52.74530 38.36313       85.76382 
1 1 1 -11 17 19 o 177.9010 75.04059 4.745758       8.873167      8.205640       12.24333      0.9179942      12.87780  206.3878 87.65952 182.5479 83.01502 23.83989       120.7298 
1 1 1 -11 17 20 o 127.5719 59.53809 -3.685439      7.263399      -16.47431      12.25515      3.239434       9.017961  134.9031 66.39999 167.8153 73.26092 -32.91225      98.87427 
1 1 1 -11 17 21 o 163.3259 69.49699 4.427284       7.721192      18.68838       13.16486      -3.050515      9.532935  238.1272 94.82702 144.1024 67.56124 94.02483       116.4332 
1 1 1 -11 17 22 o 217.3102 81.52822 14.60066       9.310808      0.000000       0.000000      14.60066       9.310808  ?        ?        217.3102 81.52822 0.000000       81.52822 
1 1 1 -11 17 23 o 139.1909 63.49069 1.220126       7.605519      -7.795084      13.94691      5.035637       9.073325  145.0975 71.30306 160.1665 71.52328 -15.06903      100.9936 
1 1 1 -11 17 24 o 163.1628 66.70986 7.644714       6.708995      -7.824651      9.202012      25.19825       9.802319  118.3067 58.09298 259.6357 84.64967 -141.3289      102.6663 
1 1 1 -11 17 25 o 109.1146 52.09667 -2.558024      6.176667      -15.18997      8.673189      10.44130       8.798408  99.38287 49.98423 167.9617 72.85312 -68.57880      88.35158 
1 1 1 -11 18 1  o 396.5712 31.62599 31.05956       4.830218      31.97448       5.954605      29.29923       8.259531  400.7569 38.74326 377.6546 58.18457 23.10229       69.90340 
1 1 1 -11 18 2  o 363.1972 43.14885 26.49069       5.967033      26.49069       5.967033      0.000000       0.000000  363.1972 43.14885 ?        ?        0.000000       43.14885 
1 1 1 -11 18 3  o 393.3963 33.26098 30.64523       5.033900      40.41328       6.026918      8.109443       9.154353  451.8042 34.61246 217.1185 80.96102 234.6857       88.04948 
1 1 1 -11 18 4  o 701.0757 22.04998 96.00078       6.003452      105.2176       7.335724      77.30850       10.44680  733.1765 25.76360 622.4830 43.48755 110.6934       50.54631 
1 1 1 -11 18 5  o 339.3009 40.72977 23.12730       5.259668      26.59291       6.360213      15.63029       9.354605  362.5231 46.22822 270.0403 81.99544 92.48285       94.12917 
1 1 1 -11 18 6  o 209.6723 67.89769 8.925494       6.311631      4.891645       8.417686      14.10574       9.539118  191.5401 75.96770 258.4262 83.44921 -66.88608      112.8488 
1 1 1 -11 18 7  o 241.1724 53.43138 12.16757       4.872667      10.66824       7.114532      13.49222       6.687280  226.5414 71.95441 251.3353 67.20935 -24.79391      98.46082 
1 1 1 -11 18 8  o 539.2281 26.80303 57.05584       5.612864      62.83549       7.888079      51.12817       7.988448  562.3358 36.31402 505.3750 41.05741 56.96078       54.81258 
1 1 1 -11 18 9  o 256.7232 55.32255 13.86432       5.352999      22.19998       7.801013      6.446747       7.358886  323.0581 64.43824 193.6465 72.51366 129.4116       97.00782 
1 1 1 -11 18 10 o 361.4115 47.03734 26.66744       6.445510      22.73915       8.060705      33.63273       10.73349  325.8708 65.95768 394.6335 72.71478 -68.76279      98.17257 
1 1 1 -11 18 11 o 1017.092 20.11338 202.2927       7.944624      218.5529       11.78460      188.7460       10.75645  1053.295 28.80957 979.0886 28.28909 74.20648       40.37653 
1 1 1 -11 18 12 o 728.0776 24.56585 104.1094       6.946042      103.9317       10.25442      104.2601       9.442147  721.5840 36.71405 725.0756 33.53200 -3.491638      49.72240 
1 1 1 -11 18 13 o 580.4969 29.38140 66.76887       6.602128      64.95238       9.552878      68.42983       9.134785  565.6724 43.82728 582.4454 40.63923 -16.77301      59.76937 
1 1 1 -11 18 14 o 126.1986 57.23270 -2.547661      6.067607      -0.4362250     9.105112      -4.234340      8.137903  164.7788 72.71860 141.1114 64.85379 23.66742       97.43720 
1 1 1 -11 18 15 o 198.8376 68.96597 8.312626       6.503392      10.24617       10.14881      6.965478       8.471211  223.2129 84.80755 196.9678 76.78540 26.24509       114.4042 
1 1 1 -11 18 16 o 325.1893 64.83495 23.75676       7.900651      -14.63162      17.37800      33.75871       8.870380  177.4765 85.42916 392.5728 60.09531 -215.0963      104.4490 
1 1 1 -11 18 17 o 386.0408 47.03426 31.58618       6.905637      20.30276       10.45801      40.30965       9.195453  280.7895 86.96141 429.1122 56.55710 -148.3227      103.7352 
1 1 1 -11 18 18 o 190.7164 77.58786 7.014842       9.018673      14.91747       12.35746      -1.991309      13.19207  238.3568 92.79063 175.9109 81.46091 62.44588       123.4746 
1 1 1 -11 18 19 o 198.1987 74.92120 9.347938       7.895165      17.51479       12.64660      4.132216       10.10657  244.2526 94.20818 177.4211 77.50282 66.83151       121.9913 
1 1 1 -11 18 20 o 186.9778 82.85455 6.251758       11.93937      6.251758       11.93937      0.000000       0.000000  186.9778 82.85455 ?        ?        0.000000       82.85455 
1 1 1 -11 18 21 o 131.7433 62.68284 -4.632684      8.781116      0.000000       0.000000      -4.632684      8.781116  ?        ?        131.7433 62.68284 0.000000       62.68284 
1 1 1 -11 18 22 o 254.9696 74.83385 19.33861       7.894732      12.10384       14.27053      22.52935       9.477063  191.7930 87.28472 262.4770 83.01227 -70.68404      120.4560 
1 1 1 -11 18 23 o 96.52631 47.59248 -8.913335      6.386530      -6.052793      8.907083      -11.94006      9.162154  121.5401 59.13275 111.3373 55.27071 10.20283       80.94154 
1 1 1 -11 18 24 o 217.7933 67.24364 14.88932       6.258609      14.50647       8.628912      15.31429       9.091190  193.0797 76.80849 194.8818 78.38911 -1.802094      109.7470 
1 1 1 -11 18 25 o 317.2874 61.96180 29.19437       7.361024      21.67983       8.939066      45.02400       12.97407  226.3401 80.66157 301.9813 97.30079 -75.64117      126.3872 
1 1 1 -11 19 1  o 170.5063 59.32647 5.366351       4.814286      8.487740       5.824656      -1.363926      8.552888  204.8553 65.10993 160.9428 70.77432 43.91257       96.16813 
1 1 1 -11 19 2  o 223.0981 66.59248 10.36049       6.209080      10.36049       6.209080      0.000000       0.000000  223.0981 66.59248 ?        ?        0.000000       66.59248 
1 1 1 -11 19 3  o 501.2872 28.14779 49.42777       5.457554      53.26522       6.759723      42.24327       9.249242  519.0275 33.71872 455.6590 53.27396 63.36850       63.04813 
1 1 1 -11 19 4  o 151.8039 59.14959 3.101456       5.024889      7.845521       6.152431      -6.403125      8.708392  199.6890 67.13271 142.4663 66.04811 57.22275       94.17619 
1 1 1 -11 19 5  o 215.8395 68.06787 9.606586       6.375479      8.632977       8.675654      10.74967       9.400480  216.9127 79.17637 234.2797 82.79957 -17.36699      114.5629 
1 1 1 -11 19 6  o 876.9286 24.98487 150.6362       8.508820      153.7613       11.25334      146.4645       13.00171  883.1940 32.80931 859.3557 38.95827 23.83838       50.93327 
1 1 1 -11 19 7  o 483.4264 31.62589 46.23782       5.904739      46.33822       6.991772      45.98813       11.02632  482.1076 37.64197 470.1934 61.88829 11.91418       72.43671 
1 1 1 -11 19 8  o 457.6114 45.21560 42.32468       7.930403      42.32468       7.930403      0.000000       0.000000  457.6114 45.21560 ?        ?        0.000000       45.21560 
1 1 1 -11 19 9  o 126.4704 55.64582 -0.9518389     5.293607      3.106078       7.701584      -4.585727      7.288098  173.9432 71.33696 132.9562 61.20498 40.98706       93.99474 
1 1 1 -11 19 10 o 310.4530 48.65518 19.90930       5.673396      26.51931       8.361503      14.26991       7.723240  352.7933 63.35756 255.1575 73.76807 97.63576       97.24149 
1 1 1 -11 19 11 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -11 19 12 o 307.0823 59.72105 20.24874       6.865702      29.83268       8.841646      5.692940       10.89631  372.2822 63.42899 205.9508 84.70316 166.3313       105.8199 
1 1 1 -11 19 13 o 259.1568 59.81734 14.64903       5.898164      17.58965       8.850265      12.29943       7.911059  276.1107 78.70574 234.8889 76.01037 41.22182       109.4174 
1 1 1 -11 19 14 o 325.4171 49.91296 22.36458       6.106536      16.82301       9.001327      27.08959       8.311729  267.0417 80.28660 350.8195 63.33770 -83.77783      102.2624 
1 1 1 -11 19 15 o 222.5550 67.92955 11.30278       6.408267      3.035909       9.435925      18.37971       8.730449  178.4617 76.40344 276.8050 77.91709 -98.34329      109.1263 
1 1 1 -11 19 16 o 326.6461 59.13937 23.81078       7.225888      25.68268       11.80722      22.68989       9.136672  311.5993 91.53515 305.0639 77.08832 6.535339       119.6716 
1 1 1 -11 19 17 o 165.0983 72.22099 2.076822       8.803354      0.000000       0.000000      2.076822       8.803354  ?        ?        165.0983 72.22099 0.000000       72.22099 
1 1 1 -11 19 18 o 167.1106 73.17091 2.875765       9.055552      -9.586271      13.18578      14.00035       12.45814  154.0913 74.23363 227.2894 91.64445 -73.19807      117.9379 
1 1 1 -11 19 19 o 305.5052 96.03660 29.63323       12.70131      29.63323       12.70131      0.000000       0.000000  305.5052 96.03660 ?        ?        0.000000       96.03660 
1 1 1 -11 19 20 o 539.2275 33.56098 60.87559       6.993202      57.81610       9.683642      64.21033       10.10988  503.7715 50.16393 532.0303 49.49854 -28.25879      70.47357 
1 1 1 -11 19 21 o 154.5396 66.83949 4.443301       7.363446      6.528224       12.29761      3.278019       9.193726  175.1646 80.21592 156.1903 70.67736 18.97429       106.9106 
1 1 1 -11 19 22 o 129.0177 60.13631 -0.5228105     7.372781      -0.4660650     12.86375      -0.5505698     8.997181  151.3715 73.02392 137.3494 64.78106 14.02211       97.61700 
1 1 1 -11 19 23 o 155.7366 64.72411 6.803892       6.454302      11.81838       9.062494      1.642303       9.194460  179.2759 75.74038 139.8436 65.81399 39.43228       100.3399 
1 1 1 -11 19 24 o 130.4327 60.29570 2.103999       7.181277      0.2064654E-01  8.608978      6.869845       13.02087  129.0111 61.57089 153.7865 74.00626 -24.77538      96.26994 
1 1 1 -11 20 1  o 872.6269 27.73798 149.2900       9.400078      149.2900       9.400078      0.000000       0.000000  872.6269 27.73798 ?        ?        0.000000       27.73798 
1 1 1 -11 20 2  o 379.3108 44.71544 29.02166       6.460311      29.02166       6.460311      0.000000       0.000000  379.3108 44.71544 ?        ?        0.000000       44.71544 
1 1 1 -11 20 3  o 725.2622 22.54864 102.8346       6.351017      110.3999       7.703550      86.78196       11.22152  750.5170 26.43032 658.6143 44.12770 91.90265       51.43750 
1 1 1 -11 20 4  o 382.8752 37.93334 29.30197       5.566129      34.72470       6.597498      15.90994       10.36797  416.0341 41.38322 271.7652 86.92002 144.2690       96.26869 
1 1 1 -11 20 5  o 513.0507 55.98714 53.98709       10.97409      0.000000       0.000000      53.98709       10.97409  ?        ?        513.0507 55.98714 0.000000       55.98714 
1 1 1 -11 20 6  o 454.4519 34.10430 41.03667       5.975115      40.04863       7.075850      43.49219       11.15481  446.5791 41.26590 455.0611 64.96362 -8.482056      76.96198 
1 1 1 -11 20 7  o 114.0485 54.44497 -8.233578      6.741274      -2.662343      9.036497      -15.22499      10.12294  158.1134 70.93627 131.2452 63.66558 26.86818       95.31664 
1 1 1 -11 20 8  o 552.6285 31.48876 60.51121       6.729999      64.91838       8.372062      52.46178       11.31448  569.8867 38.04690 501.8641 59.19125 68.02255       70.36456 
1 1 1 -11 20 9  o 381.7532 38.95771 29.37938       5.694757      28.29673       8.091163      30.44217       8.016562  366.2838 58.87515 381.6750 55.72634 -15.39111      81.06608 
1 1 1 -11 20 10 o 117.0181 53.73619 -3.377944      5.571201      -6.705369      7.937220      -0.1466001     7.821786  131.2722 61.57847 156.1866 68.20560 -24.91444      91.89076 
1 1 1 -11 20 11 f 203.2442 64.79484 8.815373       5.765051      15.34494       8.234690      2.538593       8.073719  260.1700 76.44745 170.8947 71.80560 89.27521       104.8821 
1 1 1 -11 20 12 o 257.0981 60.63103 14.52598       5.955365      15.05413       8.783825      14.07667       8.101775  255.2205 79.80531 248.1211 76.49066 7.099411       110.5428 
1 1 1 -11 20 13 o 119.7825 56.43135 -5.918143      6.792007      -8.305765      8.385484      -1.363903      11.58119  128.6080 61.20892 176.3940 79.61726 -47.78609      100.4263 
1 1 1 -11 20 14 o 312.9837 69.04700 22.59296       8.167362      7.948110       11.15484      39.51633       11.99125  209.4710 85.87402 408.0860 78.51360 -198.6150      116.3561 
1 1 1 -11 20 15 o 296.0929 62.01879 19.96310       6.903018      6.711078       11.35126      27.74002       8.695740  201.0157 84.83727 346.3747 67.06803 -145.3589      108.1457 
1 1 1 -11 20 16 o 178.1853 69.48851 6.320587       6.939618      19.09649       11.48546      -1.025210      8.709075  262.5377 91.61786 151.3675 68.61547 111.1702       114.4636 
1 1 1 -11 20 17 o 356.9549 66.53983 30.53131       8.884728      35.54994       12.02861      24.50594       13.17998  361.5760 86.76839 280.9447 98.13813 80.63129       130.9956 
1 1 1 -11 20 18 o 215.1568 79.35976 12.57854       8.748538      14.47612       11.96978      10.40236       12.81837  222.4075 89.77604 204.9420 88.41385 17.46553       126.0030 
1 1 1 -11 20 19 o 194.5461 72.69708 10.11616       7.388537      -8.671597      13.11147      18.85833       8.943829  147.7971 71.86964 252.2635 80.73493 -104.4664      108.0897 
1 1 1 -11 20 20 o 111.4391 52.67641 -3.476465      6.008755      -6.204522      8.076169      -0.9394544E-01 8.992881  120.0781 57.91057 143.8312 66.83179 -23.75314      88.43146 
1 1 1 -11 20 21 o 212.0724 72.32059 13.98155       7.141068      15.70108       10.63147      12.56800       9.639272  203.8647 83.73552 191.3260 79.27160 12.53870       115.3066 
1 1 1 -11 20 22 f 119.9223 56.76662 -1.791783      7.023625      0.7498131      8.203620      -8.769732      13.59303  134.4523 62.92102 134.9198 67.03621 -0.4674225     91.93970 
1 1 1 -11 20 23 o 131.9978 59.07161 3.025604       6.224876      17.95295       8.639091      -13.09321      8.977250  211.9259 78.72351 104.6526 52.38103 107.2733       94.55772 
1 1 1 -11 21 1  o 667.5161 34.70882 88.22984       8.966620      88.22984       8.966620      0.000000       0.000000  667.5161 34.70882 ?        ?        0.000000       34.70882 
1 1 1 -11 21 2  o 697.4940 26.20000 95.41834       7.096918      100.6667       9.127972      87.39683       11.28476  714.3669 32.90220 660.1004 44.27693 54.26654       55.16341 
1 1 1 -11 21 3  o 257.2946 61.78773 14.10188       6.096205      13.25585       7.794512      15.43466       9.783134  248.3985 74.71759 266.6566 84.34295 -18.25816      112.6785 
1 1 1 -11 21 4  o 231.3575 77.94732 11.06857       8.294495      -2.701535      14.54076      17.71044       10.09866  200.6038 89.99239 282.6573 85.05281 -82.05353      123.8249 
1 1 1 -11 21 5  o 113.2157 53.80608 -7.325489      6.434452      -10.86241      8.791968      -3.246085      9.442163  128.7570 61.65910 159.3520 71.91067 -30.59499      94.72586 
1 1 1 -11 21 6  o 562.2073 28.67394 62.42821       6.239737      64.91103       7.461760      56.65482       11.37847  571.4598 33.77232 522.7070 56.97564 48.75287       66.23287 
1 1 1 -11 21 7  o 128.7372 57.15097 -1.356318      5.705857      4.990197       6.883651      -15.29106      10.20001  178.7356 69.34531 131.0067 63.63200 47.72888       94.11590 
1 1 1 -11 21 8  o 506.4016 35.08778 51.28928       6.857934      47.62529       8.422224      58.49865       11.81402  483.1688 45.41792 527.8638 58.61988 -44.69501      74.15577 
1 1 1 -11 21 9  o 189.8567 68.37228 7.021555       6.438685      2.190647       7.967180      16.11691       10.93201  168.3603 71.06621 265.0104 89.48525 -96.65007      114.2717 
1 1 1 -11 21 10 o 203.3745 65.34274 8.903395       5.854270      10.77077       8.492827      7.212775       8.080900  223.5906 78.73528 197.7112 75.54252 25.87933       109.1142 
1 1 1 -11 21 11 o 337.2053 51.38742 24.09898       6.516706      32.41936       10.95127      19.53750       8.108599  373.7778 77.96681 291.8269 71.99270 81.95084       106.1215 
1 1 1 -11 21 12 o 106.4998 51.45359 -8.786324      6.444881      -7.377427      10.52821      -9.630697      8.150456  149.3157 70.31857 122.1953 58.74027 27.12035       91.62489 
1 1 1 -11 21 13 o 117.0020 55.10638 -5.384348      6.468730      6.064693       10.74293      -11.89658      8.102202  197.6259 82.92236 115.2268 56.13556 82.39904       100.1365 
1 1 1 -11 21 14 o 131.3179 59.55518 -1.791948      6.570324      -11.14491      10.81843      3.673913       8.270257  139.1062 67.07154 170.9429 72.29430 -31.83672      98.61570 
1 1 1 -11 21 15 o 383.4405 58.69603 33.27327       8.462304      28.62659       11.49452      38.77208       12.50414  324.7658 88.65308 384.8487 85.84648 -60.08282      123.4058 
1 1 1 -11 21 16 o 105.3178 51.55207 -10.65735      7.072404      11.20545       11.20454      -25.13711      9.118468  211.9000 86.37431 98.73437 49.85595 113.1657       99.73032 
1 1 1 -11 21 17 o 451.5294 52.91991 46.28288       9.103689      55.44968       12.07351      34.20324       13.85963  474.6955 67.38387 321.9139 100.1781 152.7816       120.7321 
1 1 1 -11 21 18 o 150.1353 63.67345 3.631806       6.444406      -1.899312      8.745368      10.20411       9.533021  140.1991 65.39735 194.1280 79.46226 -53.92888      102.9129 
1 1 1 -11 21 19 o 359.8840 47.43601 29.78383       6.468213      22.66192       8.356999      40.42479       10.21510  279.3050 75.32110 386.7273 70.61803 -107.4223      103.2481 
1 1 1 -11 21 20 o 116.0457 55.59695 -4.325687      7.166133      -9.021579      10.46837      -0.1845795     9.830561  125.8548 61.83218 143.1505 67.57750 -17.29572      91.59660 
1 1 1 -11 21 21 o 118.7649 57.29449 -4.273376      7.919276      2.161242       9.420471      -19.77631      14.62238  144.2041 67.46610 125.9794 63.55506 18.22472       92.68722 
1 1 1 -11 22 1  o 423.3644 50.00270 36.73304       8.062505      36.73304       8.062505      0.000000       0.000000  423.3644 50.00270 ?        ?        0.000000       50.00270 
1 1 1 -11 22 2  o 139.3878 60.13100 0.7200009E-01  5.928668      -1.731120      7.606321      2.863122       9.463498  147.8241 65.78713 185.4673 77.82475 -37.64320      101.9050 
1 1 1 -11 22 3  o 130.9668 58.68237 -2.004987      6.163267      -2.175045      7.837580      -1.729419      9.976942  147.9612 66.24459 168.9744 75.26144 -21.01323      100.2628 
1 1 1 -11 22 4  o 673.9170 38.54078 90.98496       10.04496      96.53053       17.08816      88.05695       12.41678  674.8163 66.05200 656.7682 49.03566 18.04803       82.26398 
1 1 1 -11 22 5  o 528.7652 35.70988 55.93473       7.289985      54.11679       9.214961      58.97556       11.91792  514.8138 46.59591 530.1207 58.88417 -15.30688      75.09011 
1 1 1 -11 22 6  o 387.9619 46.96992 31.00067       6.932620      26.60229       8.703585      38.63457       11.46634  349.2611 66.59897 418.1593 73.27928 -68.89819      99.02159 
1 1 1 -11 22 7  o 588.4662 32.66759 69.11060       7.436286      68.72354       9.429530      69.74728       12.09379  581.7256 42.02193 577.5763 54.56326 4.149353       68.86938 
1 1 1 -11 22 8  o 182.3149 68.64081 6.080594       6.611218      10.27547       8.598443      0.1440894E-01  10.33994  220.1547 79.04034 175.0632 77.36303 45.09148       110.6002 
1 1 1 -11 22 9  o 167.7455 67.25026 4.079532       6.666919      8.767059       8.701955      -2.582091      10.37373  208.8929 78.72987 164.5440 74.70426 44.34891       108.5316 
1 1 1 -11 22 10 o 197.8167 82.59212 5.605723       10.57891      5.605723       10.57891      0.000000       0.000000  197.8167 82.59212 ?        ?        0.000000       82.59212 
1 1 1 -11 22 11 o 222.2278 67.27053 11.33078       6.303524      18.43366       10.68598      7.540230       7.806361  270.0616 88.39913 194.2856 74.24473 75.77605       115.4413 
1 1 1 -11 22 12 o 145.2227 62.51796 1.250125       6.381793      -8.380301      10.63426      6.670526       7.978112  145.1705 69.04491 187.5265 74.08984 -42.35600      101.2744 
1 1 1 -11 22 13 o 409.1950 45.73014 35.61462       7.142820      54.83181       11.85386      24.65907       8.950188  489.9897 63.80748 317.9839 73.88525 172.0058       97.62389 
1 1 1 -11 22 14 o 221.1293 71.45396 12.08029       6.992955      15.04035       11.54941      10.36701       8.786671  235.4464 90.22784 207.6561 78.90784 27.79036       119.8645 
1 1 1 -11 22 15 o 178.2750 66.56911 7.170176       6.193231      6.758894       9.013883      7.537947       8.523756  183.7589 76.43933 186.5411 75.59714 -2.782135      107.5077 
1 1 1 -11 22 16 o 247.8602 69.08913 15.91273       6.899396      10.70080       8.430589      26.48210       12.00558  201.4316 77.11319 287.6338 93.67649 -86.20212      121.3331 
1 1 1 -11 22 17 o 286.4040 65.25277 21.00935       7.095877      28.31261       8.559519      4.960996       12.68838  329.2725 69.13813 177.5790 81.37994 151.6934       106.7838 
1 1 1 -11 22 18 o 129.7107 58.36768 0.6761628      6.169044      -3.069366      8.257437      5.407415       9.280616  129.9239 61.51545 164.9235 73.06695 -34.99954      95.51402 
1 1 1 -11 22 19 o 242.5620 70.58724 17.38456       7.050868      15.79278       8.172572      22.01878       13.94459  218.8336 77.21750 218.4968 93.19424 0.3367767      121.0277 
1 1 1 -11 22 20 o 148.4032 64.60938 4.915399       6.971254      -0.6239494     9.961167      10.23284       9.759607  138.8518 66.25700 174.8391 76.27364 -35.98738      101.0330 
1 1 1 -11 23 1  o 449.0366 32.63361 40.22819       5.651917      42.48487       6.736817      34.86473       10.38585  459.3320 38.11013 399.7694 69.41474 59.56259       79.18831 
1 1 1 -11 23 2  o 192.9602 62.20823 7.793618       5.302651      5.944239       6.412665      11.79242       9.429535  181.6483 67.75600 235.0412 82.94260 -53.39290      107.0997 
1 1 1 -11 23 3  o 319.5674 46.70943 21.16947       5.625734      26.53816       6.912638      10.63920       9.681202  356.2122 51.46184 227.4759 83.54674 128.7363       98.12431 
1 1 1 -11 23 4  o 350.8091 53.32124 25.94598       7.035668      24.12022       9.606750      28.05812       10.33274  324.8352 77.27620 350.6146 77.90807 -25.77939      109.7328 
1 1 1 -11 23 5  o 213.0975 63.09951 9.932359       5.591411      14.46247       6.647649      -1.023382      10.33795  254.5833 66.50693 171.2362 76.41461 83.34715       101.3033 
1 1 1 -11 23 6  o 462.1049 39.84877 43.47834       7.081353      42.89864       8.865472      44.50009       11.76980  452.2335 51.39172 447.3032 70.05428 4.930298       86.88332 
1 1 1 -11 23 7  o 405.2311 45.37721 34.08157       7.018586      40.18860       9.014189      24.67899       11.18497  434.4295 54.63793 317.2230 87.80556 117.2065       103.4172 
1 1 1 -11 23 8  o 203.1856 70.13741 8.986959       6.722320      12.45079       8.499155      3.199450       10.98609  232.1148 78.89966 189.0052 81.69419 43.10956       113.5742 
1 1 1 -11 23 9  o 154.5116 65.37298 2.123027       6.767099      8.189523       8.762197      -6.843556      10.65265  202.0274 78.27773 150.8901 70.95920 51.13728       105.6533 
1 1 1 -11 23 10 o 113.2012 54.36736 -8.084040      6.946542      -10.42123      8.939087      -4.521014      11.03711  126.2789 60.90733 159.0435 73.94643 -32.76460      95.80072 
1 1 1 -11 23 11 o 445.5664 41.19955 41.40917       7.048358      57.78123       11.98729      32.75792       8.713822  505.9734 62.32236 380.9808 60.94946 124.9927       87.17174 
1 1 1 -11 23 12 o 543.4385 35.11189 60.64481       7.370617      65.91274       12.23312      57.64254       9.235104  540.8635 59.20704 519.5902 46.25064 21.27325       75.13052 
1 1 1 -11 23 13 o 160.4571 70.17867 2.348901       8.309333      0.000000       0.000000      2.348901       8.309333  ?        ?        160.4571 70.17867 0.000000       70.17867 
1 1 1 -11 23 14 o 130.1131 58.38054 -0.3184760     6.122442      11.58383       8.528312      -12.97599      8.794713  209.8708 78.16629 114.9525 56.51616 94.91828       96.45747 
1 1 1 -11 23 15 o 326.4242 51.66882 24.42065       6.331883      21.56425       8.729043      27.59267       9.198673  278.1855 77.77212 320.8317 75.14698 -42.64615      108.1461 
1 1 1 -11 23 16 o 131.6632 60.03047 -0.3111316     6.789644      1.136254       8.388201      -3.061178      11.56237  147.4745 67.03973 150.5437 71.71091 -3.069199      98.16710 
1 1 1 -11 23 17 o 140.6039 62.51478 2.168022       6.852514      8.639275       8.048568      -14.88179      13.06424  177.9256 72.94313 132.1358 65.66432 45.78979       98.14532 
1 1 1 -11 23 18 o 130.6120 59.60083 0.6854812      6.710436      -2.852126      7.621501      12.88540       14.15351  123.6865 58.71731 187.4790 85.92910 -63.79259      104.0747 
1 1 1 -11 23 19 o 103.7929 51.49929 -11.19357      7.915051      -19.68206      10.57197      -0.3669481     11.93953  107.9990 54.42770 146.4942 70.59007 -38.49522      89.13660 
1 1 1 -11 24 1  o 406.3445 35.40926 33.31232       5.531934      38.51145       6.733637      22.51791       9.702510  434.7690 40.34031 310.4399 79.98306 124.3290       89.58030 
1 1 1 -11 24 2  o 239.3739 57.19522 12.50791       5.244308      13.29967       6.315789      10.74989       9.411149  243.9142 65.35443 224.6259 82.39242 19.28824       105.1652 
1 1 1 -11 24 3  o 198.7384 70.88102 8.183689       6.903996      8.066260       9.322248      8.326334       10.27452  207.0016 80.59091 212.2803 84.01283 -5.278778      116.4176 
1 1 1 -11 24 4  o 241.4094 59.94109 12.91300       5.593794      15.71322       6.676018      6.314407       10.24817  264.0679 65.43284 200.7455 82.30507 63.32240       105.1455 
1 1 1 -11 24 5  o 248.2977 59.28383 13.68451       5.637619      13.68246       6.725223      13.68935       10.33970  244.4919 68.23320 241.9791 86.69604 2.512772       110.3267 
1 1 1 -11 24 6  o 216.1049 63.87260 10.54121       5.733580      9.113545       6.816356      13.99500       10.60201  203.7099 70.60873 242.4099 87.67185 -38.70004      112.5697 
1 1 1 -11 24 7  o 151.1471 61.45399 3.058133       5.653696      0.8357047      6.686657      8.631032       10.58853  146.4494 63.51672 210.0193 84.55614 -63.56990      105.7550 
1 1 1 -11 24 8  o 225.2609 64.98718 11.75100       5.999712      12.15011       6.985542      10.62870       11.71397  226.7980 71.20986 221.1687 88.97461 5.629303       113.9619 
1 1 1 -11 24 9  o 367.3027 45.23685 28.62779       6.316372      34.22588       7.413313      13.79814       12.06586  399.3069 48.82239 234.9236 91.62386 164.3833       103.8198 
1 1 1 -11 24 10 o 563.2966 34.34644 64.95667       7.477683      73.23573       9.036328      46.97145       13.31861  593.4510 39.43283 429.8021 82.79581 163.6489       91.70657 
1 1 1 -11 24 11 o 185.3968 82.89706 3.671911       12.23068      0.000000       0.000000      3.671911       12.23068  ?        ?        185.3968 82.89706 0.000000       82.89706 
1 1 1 -11 24 12 o 289.9008 55.53023 19.33924       6.024191      20.53006       8.419541      18.09014       8.623092  279.8186 75.66243 258.7649 78.75826 21.05371       109.2139 
1 1 1 -11 24 13 o 237.4944 65.12038 14.20085       6.185868      22.65796       8.450384      4.437063       9.079762  292.2983 74.28672 169.2770 73.71576 123.0213       104.6543 
1 1 1 -11 24 14 o 371.9315 45.90668 30.85446       6.490106      26.80061       8.915204      35.42504       9.466364  314.9166 74.12770 372.5608 67.93010 -57.64417      100.5456 
1 1 1 -11 24 15 o 139.1123 61.98107 1.564224       6.772557      -3.049528      8.421496      10.01081       11.39469  132.3831 62.51062 189.4353 82.53463 -57.05219      103.5352 
1 1 1 -11 24 16 o 219.9829 72.71932 14.43173       7.224770      6.611960       8.202566      41.49017       15.25823  166.4615 71.24980 308.7967 105.7120 -142.3352      127.4816 
1 1 1 -11 24 17 o 135.9653 59.15965 2.831074       5.838015      11.03993       8.061919      -6.219669      8.465240  187.1510 74.30767 119.9598 58.19774 67.19113       94.38542 
1 1 1 -11 25 1  o 248.3897 55.10494 13.52260       5.176547      19.77466       6.310571      0.6617390      9.050908  301.2129 56.00846 165.5918 72.81252 135.6211       91.86192 
1 1 1 -11 25 2  o 168.6504 62.09233 5.496563       5.352072      10.92543       6.406707      -7.043170      9.736985  219.0462 68.10143 143.4713 67.58401 75.57489       95.94479 
1 1 1 -11 25 3  o 478.4096 38.93124 46.92666       7.170391      47.71498       9.516517      45.89137       10.90579  472.3156 52.78482 454.1203 63.58161 18.19525       82.63691 
1 1 1 -11 25 4  o 876.6104 21.54828 151.6093       7.335795      158.5104       8.713249      134.8101       13.59453  893.8231 25.10155 806.2303 43.58058 87.59277       50.29269 
1 1 1 -11 25 5  o 275.0722 56.66304 16.84087       5.851579      10.94002       6.755836      34.56409       11.70828  216.7198 70.25327 373.3721 82.90611 -156.6523      108.6690 
1 1 1 -11 25 6  o 278.8830 56.42590 17.38424       5.901380      21.21073       6.744270      4.881790       12.19081  307.2503 58.66130 195.9196 85.36420 111.3307       103.5770 
1 1 1 -11 25 7  o 151.1737 63.21125 2.737962       6.209582      0.9037962      7.252811      7.773678       12.01760  149.1771 65.39698 204.9562 86.93887 -55.77907      108.7894 
1 1 1 -11 25 8  f 104.8393 50.37104 -6.885186      5.975738      -10.99477      6.905549      5.367373       11.92375  103.6677 50.78596 192.5994 84.15656 -88.93169      98.29314 
1 1 1 -11 25 9  o 228.4364 76.68677 13.45477       8.028104      14.35564       10.46845      12.16846       12.50905  230.4823 86.45238 219.2982 90.53702 11.18405       125.1837 
1 1 1 -11 25 10 o 115.7501 54.00836 -3.394495      5.971366      -4.000269      6.851648      -1.480917      12.17763  122.1352 57.26691 166.1731 77.39841 -44.03792      96.28091 
1 1 1 -11 25 11 o 495.3315 38.62343 51.97549       7.371039      55.55561       8.740466      43.15933       13.71595  504.7709 45.06120 379.9897 93.56683 124.7812       103.8521 
1 1 1 -11 25 12 o 137.5863 61.72277 0.5232149      6.840310      2.342753       8.015062      -4.355247      13.12405  153.0730 67.85546 157.8404 75.51976 -4.767380      101.5263 
1 1 1 -11 25 13 o 138.9881 60.21320 2.287189       5.995757      7.363925       8.271950      -3.332462      8.703027  176.0118 73.22208 134.4855 63.51666 41.52637       96.93214 
1 1 1 -11 25 14 o 375.8396 52.70673 33.49675       7.481482      35.75008       8.775192      27.49979       14.31561  375.6954 62.32866 254.3824 99.63768 121.3130       117.5267 
1 1 1 -11 25 15 o 141.5042 62.90168 2.468792       6.934022      6.276451       8.502443      -5.092878      11.98184  164.7690 71.54286 142.8275 69.27961 21.94157       99.58938 
1 1 1 -11 26 1  o 135.7137 57.66972 1.348033       5.303699      7.456938       6.490940      -10.92346      9.199721  186.9659 68.44893 126.8477 61.33013 60.11824       91.90561 
1 1 1 -11 26 2  o 184.3372 70.84081 6.874700       7.131879      16.41268       10.49696      -1.303274      9.719817  251.3086 87.59294 159.0018 72.23556 92.30679       113.5363 
1 1 1 -11 26 3  o 149.3558 61.73229 2.873058       5.825292      -1.558972      7.000871      12.84752       10.50257  135.9733 61.58886 227.9323 86.35132 -91.95900      106.0648 
1 1 1 -11 26 4  o 192.3458 66.28347 8.449525       6.002627      13.35146       7.060043      -4.337592      11.40276  233.7976 71.28696 158.9892 74.33324 74.80838       102.9916 
1 1 1 -11 26 5  o 434.5135 36.08164 39.00785       6.033523      43.35164       6.984157      26.22985       11.97875  455.2122 39.90973 304.1521 92.88264 151.0600       101.0939 
1 1 1 -11 26 6  o 144.7977 60.23952 2.722774       5.599056      3.568878       6.418323      0.2864829E-01  11.45299  155.8099 64.63143 169.8625 77.64836 -14.05260      101.0272 
1 1 1 -11 26 7  o 329.0618 64.11193 25.80564       7.898497      36.14981       10.51514      12.41196       11.96513  379.7330 73.96273 218.0348 89.10986 161.6982       115.8061 
1 1 1 -11 26 8  o 306.0365 55.43444 21.55733       6.345835      13.88258       7.313276      44.94542       12.76666  230.7231 72.91745 408.4979 83.29848 -177.7748      110.7050 
1 1 1 -11 26 9  o 232.8960 65.17279 13.63577       6.126813      12.60212       6.938049      17.29670       13.05708  219.2457 71.20341 232.9102 93.85289 -13.66449      117.8062 
1 1 1 -11 26 10 o 361.0354 52.58274 29.98950       7.156082      28.46442       8.257594      34.58937       14.34105  338.0136 65.26927 311.3911 102.4307 26.62256       121.4583 
1 1 1 -11 26 11 o 137.8872 60.38950 1.773538       6.171475      0.9723634      7.039969      4.432968       12.82630  139.7785 62.66788 176.7239 81.29448 -36.94534      102.6453 
1 1 1 -11 26 12 o 118.0764 55.30882 -2.753232      6.364041      -8.466679      7.232083      16.85364       13.39734  108.4335 52.87199 215.6622 91.65044 -107.2287      105.8076 
1 1 1 -11 26 13 o 165.4726 67.60864 6.611888       6.885174      4.699483       8.053429      11.80661       13.27309  158.2330 69.15079 192.8579 86.28638 -34.62498      110.5765 
1 1 1 -11 27 1  o 340.1320 49.16129 25.27797       6.305373      23.69061       8.576612      27.14509       9.301752  309.4656 72.61352 330.3555 74.30368 -20.88992      103.8930 
1 1 1 -11 27 2  o 282.9918 60.80151 18.70886       6.482992      16.60265       8.666759      21.38459       9.768464  251.1420 79.37954 281.4793 83.41487 -30.33736      115.1484 
1 1 1 -11 27 3  o 168.5190 63.09122 6.025084       5.570142      10.11824       6.627939      -3.817225      10.27775  203.7019 69.67281 150.4570 70.41613 53.24498       99.05923 
1 1 1 -11 27 4  o 414.4902 39.55744 36.26505       6.290226      40.66592       7.528692      26.09053       11.44739  433.8023 45.35970 299.3723 90.66081 134.4300       101.3750 
1 1 1 -11 27 5  o 284.7376 56.94912 18.85074       6.077392      20.21713       7.199724      15.46398       11.33497  287.0704 65.96495 231.0640 89.17009 56.00645       110.9174 
1 1 1 -11 27 6  o 332.4191 61.63932 26.40399       7.664402      14.43259       9.938935      43.96763       12.03856  225.2018 84.28344 408.2470 78.78580 -183.0452      115.3729 
1 1 1 -11 27 7  o 277.8752 59.31704 18.51804       6.206324      13.49202       7.262989      32.12027       11.94836  224.6377 72.84481 325.8292 90.95432 -101.1915      116.5292 
1 1 1 -11 27 8  o 176.0248 67.14077 7.387038       6.376504      9.213903       7.582662      2.975315       11.78345  189.8212 73.02239 172.0420 78.68864 17.77914       107.3507 
1 1 1 -11 27 9  o 119.7850 55.91316 -2.742470      6.410048      -8.698295      7.547312      12.67453       12.14287  111.7066 54.36768 205.5622 87.30376 -93.85559      102.8484 
1 1 1 -11 27 10 o 115.8427 54.74557 -3.796772      6.483452      -1.479482      7.644486      -9.735169      12.23750  133.1834 61.79317 139.6781 68.25260 -6.494675      92.06961 
1 1 1 -11 28 1  o 176.9849 65.60036 7.061216       5.992414      8.307106       8.341392      5.732467       8.614305  190.6368 75.61847 177.0338 74.26665 13.60300       105.9891 
1 1 1 -11 28 2  o 94.86490 45.53349 -5.524664      4.856322      -4.556062      5.899197      -7.561222      8.553987  110.4362 52.19976 125.8571 60.41504 -15.42086      79.84229 
1 1 1 -11 28 3  o 253.1492 55.90014 14.98299       5.348789      14.87682       6.334273      15.24680       9.985023  244.4790 65.42641 230.6740 84.82849 13.80502       107.1284 
1 1 1 -11 28 4  o 199.3264 71.02432 10.12892       6.930396      18.51328       9.617618      1.072911       9.995415  252.2205 83.92713 160.8126 73.13308 91.40790       111.3203 
1 1 1 -10 0  1  f 820.8765 27.67822 131.8435       8.800826      131.8435       8.800826      131.8435       8.800826  820.8765 27.67822 820.8765 27.67822 0.000000       0.000000 
1 1 1 -10 0  2  o 84.00470 55.80302 -1.253920      4.851354      -1.253920      4.851354      -1.253920      4.851354  84.00470 55.80302 84.00470 55.80302 -0.000000      0.000000 
1 1 1 -10 0  3  o 1239.012 28.87634 299.9636       13.87755      299.9636       13.87755      299.9636       13.87755  1239.012 28.87634 1239.012 28.87634 0.000000       0.000000 
1 1 1 -10 0  4  o 1047.048 20.57594 213.6389       8.359410      213.6389       8.359410      213.6389       8.359410  1047.048 20.57594 1047.048 20.57594 -0.000000      0.000000 
1 1 1 -10 0  5  o 152.9365 68.53671 6.708977       4.340288      6.708977       4.340288      6.708977       4.340288  152.9365 68.53671 152.9365 68.53671 0.000000       0.000000 
1 1 1 -10 0  6  o 316.3706 39.43379 20.49409       4.641743      20.49409       4.641743      20.49409       4.641743  316.3706 39.43379 316.3706 39.43379 0.000000       0.000000 
1 1 1 -10 0  7  o 81.08864 53.86401 -1.154867      4.519426      -1.154867      4.519426      -1.154867      4.519426  81.08864 53.86401 81.08864 53.86401 0.000000       0.000000 
1 1 1 -10 0  8  f 96.13199 65.04275 -3.172849      7.162041      -3.172849      7.162041      -3.172849      7.162041  96.13199 65.04275 96.13199 65.04275 -0.000000      0.000000 
1 1 1 -10 0  9  o 748.7415 34.39623 110.4064       9.953557      110.4064       9.953557      110.4064       9.953557  748.7415 34.39623 748.7415 34.39623 -0.000000      0.000000 
1 1 1 -10 0  10 o 394.7407 59.94545 32.91439       8.561617      32.91439       8.561617      32.91439       8.561617  394.7407 59.94545 394.7407 59.94545 0.000000       0.000000 
1 1 1 -10 0  11 o 544.0345 30.21056 58.34226       6.337828      58.34226       6.337828      58.34226       6.337828  544.0345 30.21056 544.0345 30.21056 0.000000       0.000000 
1 1 1 -10 0  12 o 107.5230 66.01411 1.989416       5.317802      1.989416       5.317802      1.989416       5.317802  107.5230 66.01411 107.5230 66.01411 0.000000       0.000000 
1 1 1 -10 0  13 o 224.6283 79.84212 13.21114       6.345611      13.21114       6.345611      13.21114       6.345611  224.6283 79.84212 224.6283 79.84212 -0.000000      0.000000 
1 1 1 -10 0  14 o 765.9629 27.36846 114.8081       8.117583      114.8081       8.117583      114.8081       8.117583  765.9629 27.36846 765.9629 27.36846 0.000000       0.000000 
1 1 1 -10 0  15 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -10 0  16 o 783.3959 28.65596 120.0700       8.691681      120.0700       8.691681      120.0700       8.691681  783.3959 28.65596 783.3959 28.65596 -0.000000      0.000000 
1 1 1 -10 0  17 o 708.8295 31.22902 98.50793       8.558653      98.50793       8.558653      98.50793       8.558653  708.8295 31.22902 708.8295 31.22902 0.000000       0.000000 
1 1 1 -10 0  18 o 700.5955 32.40947 96.29217       8.774960      96.29217       8.774960      96.29217       8.774960  700.5955 32.40947 700.5955 32.40947 0.000000       0.000000 
1 1 1 -10 0  19 o 697.9261 34.10804 95.66823       9.194382      95.66823       9.194382      95.66823       9.194382  697.9261 34.10804 697.9261 34.10804 0.000000       0.000000 
1 1 1 -10 0  20 o 319.6370 77.68307 23.38393       8.356236      23.38393       8.356236      23.38393       8.356236  319.6370 77.68307 319.6370 77.68307 -0.000000      0.000000 
1 1 1 -10 0  21 o 87.42299 61.26991 -7.982532      7.851406      -7.982532      7.851406      -7.982532      7.851406  87.42299 61.26991 87.42299 61.26991 0.000000       0.000000 
1 1 1 -10 0  22 o 426.4733 60.51434 37.99412       9.439832      37.99412       9.439832      37.99412       9.439832  426.4733 60.51434 426.4733 60.51434 0.000000       0.000000 
1 1 1 -10 0  23 o 322.4096 90.38595 25.11265       9.794734      25.11265       9.794734      25.11265       9.794734  322.4096 90.38595 322.4096 90.38595 0.000000       0.000000 
1 1 1 -10 0  24 o 302.2532 123.3723 26.42758       14.24842      26.42758       14.24842      26.42758       14.24842  302.2532 123.3723 302.2532 123.3723 -0.000000      0.000000 
1 1 1 -10 0  25 o 601.3097 69.66397 75.29417       15.69912      75.29417       15.69912      75.29417       15.69912  601.3097 69.66397 601.3097 69.66397 0.000000       0.000000 
1 1 1 -10 0  26 o 569.3388 51.89341 65.92676       11.25472      65.92676       11.25472      65.92676       11.25472  569.3388 51.89341 569.3388 51.89341 0.000000       0.000000 
1 1 1 -10 0  27 o 142.9452 88.80309 3.924759       9.899587      3.924759       9.899587      3.924759       9.899587  142.9452 88.80309 142.9452 88.80309 0.000000       0.000000 
1 1 1 -10 0  28 o 168.2644 105.2977 6.497530       14.17519      6.497530       14.17519      6.497530       14.17519  168.2644 105.2977 168.2644 105.2977 -0.000000      0.000000 
1 1 1 -10 0  29 o 131.1964 89.82497 -5.077995      14.53968      -5.077995      14.53968      -5.077995      14.53968  131.1964 89.82497 131.1964 89.82497 0.000000       0.000000 
1 1 1 -10 0  30 o 313.3616 99.32770 27.09855       10.63465      27.09855       10.63465      27.09855       10.63465  313.3616 99.32770 313.3616 99.32770 0.000000       0.000000 
1 1 1 -10 0  31 o 131.6887 84.44704 3.531843       9.782225      3.531843       9.782225      3.531843       9.782225  131.6887 84.44704 131.6887 84.44704 0.000000       0.000000 
1 1 1 -10 0  32 o 158.5624 92.73219 9.464525       9.534039      9.464525       9.534039      9.464525       9.534039  158.5624 92.73219 158.5624 92.73219 -0.000000      0.000000 
1 1 1 -10 1  1  o 357.4355 29.11366 25.24872       4.006199      28.12788       5.628110      22.29150       5.703891  374.8535 39.24265 331.4472 45.51427 43.40622       60.09604 
1 1 1 -10 1  2  o 356.8811 24.08435 25.03823       3.318472      28.34579       4.188279      19.45981       5.439217  378.8970 28.67576 308.8044 46.82356 70.09265       54.90670 
1 1 1 -10 1  3  o 614.7758 18.15933 73.73397       4.335554      74.97242       5.417784      71.52853       7.229856  619.1362 22.53240 602.0491 31.02767 17.08710       38.34612 
1 1 1 -10 1  4  f 313.4349 29.09772 19.47716       3.501477      22.17280       4.290621      14.10246       6.058516  333.5129 33.58369 257.4871 61.44318 76.02576       70.02235 
1 1 1 -10 1  5  o 584.3400 17.25860 66.61708       3.916509      70.35395       5.622964      63.09591       5.458268  599.1478 24.16592 567.2675 24.77644 31.88025       34.61017 
1 1 1 -10 1  6  o 284.7357 30.59056 16.16710       3.329617      17.41356       4.794883      15.00632       4.627172  291.8948 43.63771 269.8877 45.78360 22.00711       63.24862 
1 1 1 -10 1  7  o 557.7057 18.90209 60.78624       4.093952      62.58607       5.828510      59.03352       5.751699  564.1285 26.60428 547.7701 27.03770 16.35834       37.93185 
1 1 1 -10 1  8  o 412.2771 27.87210 33.64167       4.436375      32.87196       5.390223      35.25788       7.810770  405.4601 34.56183 413.9586 49.57178 -8.498535      60.43080 
1 1 1 -10 1  9  o 166.3008 60.63212 4.986534       5.085530      9.944004       7.002196      -0.5474970     7.398181  216.9315 71.58464 150.5306 66.01827 66.40091       97.37953 
1 1 1 -10 1  10 o 172.8589 55.32451 6.117309       4.199833      8.893354       7.080574      4.610488       5.216582  208.3112 71.97780 163.7824 61.10748 44.52873       94.41889 
1 1 1 -10 1  11 o 286.0113 37.14135 16.57912       4.028047      13.50664       5.752872      19.53409       5.641788  250.0867 60.00136 306.4649 49.05803 -56.37813      77.50389 
1 1 1 -10 1  12 o 365.8125 31.02738 26.66045       4.366343      24.49621       6.146912      28.86461       6.203358  344.8893 47.12657 376.4335 43.21719 -31.54413      63.94247 
1 1 1 -10 1  13 o 312.8645 35.80215 19.69730       4.271725      20.69719       6.044396      18.69958       6.037871  315.4060 51.09410 298.3050 54.11166 17.10095       74.42230 
1 1 1 -10 1  14 o 592.6964 22.13288 68.79812       5.094460      70.93801       7.443702      66.91262       6.987251  598.2045 32.15943 581.3386 31.06162 16.86591       44.71077 
1 1 1 -10 1  15 o 508.6506 25.79931 50.90557       5.079627      50.64147       7.268617      51.15767       7.101646  503.7162 37.42413 506.6813 36.33197 -2.965118      52.15916 
1 1 1 -10 1  16 o 391.6419 33.88672 30.51251       5.103242      20.40323       7.091853      41.36870       7.349171  310.9246 60.91106 453.7232 42.19136 -142.7986      74.09634 
1 1 1 -10 1  17 o 487.7674 29.05124 46.91033       5.478141      36.95784       7.510612      58.22408       8.007789  427.6828 45.93940 540.6895 38.38560 -113.0067      59.86554 
1 1 1 -10 1  18 f 306.2816 47.54899 19.17118       5.472356      25.36378       7.704404      12.86583       7.774228  349.1600 58.91493 246.2128 74.74649 102.9472       95.17355 
1 1 1 -10 1  19 o 222.3272 62.03598 10.41787       5.559613      8.382227       7.694666      12.64130       8.041775  210.3701 74.85105 244.5375 76.34289 -34.16737      106.9155 
1 1 1 -10 1  20 o 551.2045 30.18919 59.97660       6.437807      73.04866       9.367530      48.27651       8.862329  604.8347 40.10804 488.4034 47.31751 116.4312       62.02904 
1 1 1 -10 1  21 o 484.2120 34.69847 46.71186       6.481645      48.94147       9.024207      44.33595       9.315597  490.1483 48.02516 464.1556 52.60873 25.99274       71.23268 
1 1 1 -10 1  22 o 189.0245 67.31535 6.926369       6.224627      0.7729067      8.612659      13.65539       9.006445  167.4565 72.35677 248.6455 81.14407 -81.18906      108.7192 
1 1 1 -10 1  23 o 793.2404 35.58103 125.7481       10.96103      0.000000       0.000000      125.7481       10.96103  ?        ?        793.2404 35.58103 0.000000       35.58103 
1 1 1 -10 1  24 f 408.6347 65.85625 36.59448       10.09585      27.42167       13.67373      47.58808       14.96945  329.7449 98.91241 447.2687 89.30754 -117.5238      133.2648 
1 1 1 -10 1  25 o 527.8127 54.70063 59.31807       11.04966      60.15887       15.33488      58.41011       15.93558  507.3539 80.51845 493.9232 86.21342 13.43060       117.9660 
1 1 1 -10 1  26 o 636.3009 46.56410 85.14109       11.42655      0.000000       0.000000      85.14109       11.42655  ?        ?        636.3009 46.56410 0.000000       46.56410 
1 1 1 -10 1  27 o 375.9474 53.38152 31.40201       7.574838      26.35537       10.83466      36.22718       10.59426  311.4662 86.49374 383.7211 73.77263 -72.25485      113.6819 
1 1 1 -10 1  28 o 214.1626 77.47874 12.44335       8.280946      -7.341703      14.38440      22.25086       10.12751  160.0215 77.20258 275.2056 85.63304 -115.1841      115.2964 
1 1 1 -10 1  29 o 143.9804 68.53434 -3.415696      10.52012      -1.742184      15.13984      -4.978123      14.62873  165.8859 79.82182 158.0832 76.64988 7.802673       110.6649 
1 1 1 -10 1  30 o 136.9224 62.26257 1.589636       7.242613      3.581761       10.49127      -0.2242066     10.01082  155.8895 72.35010 143.2420 67.79552 12.64754       99.15024 
1 1 1 -10 1  31 o 263.4243 70.00282 21.87561       7.283691      20.78044       10.49578      22.89298       10.11610  212.4153 84.64442 228.3961 85.11925 -15.98076      120.0415 
1 1 1 -10 1  32 o 142.5444 62.95843 6.293024       6.838855      7.847425       9.642119      4.719464       9.701356  147.8569 68.86855 138.7885 65.99123 9.068405       95.38197 
1 1 1 -10 2  1  o 908.5667 14.04927 160.7222       4.957224      158.0590       6.834877      163.6780       7.200557  899.8784 19.55775 915.5632 20.25116 -15.68475      28.15342 
1 1 1 -10 2  2  o 382.7361 22.79071 28.75010       3.372209      25.19628       4.191753      35.26942       5.677399  356.6444 30.55958 421.2139 35.02475 -64.56949      46.48248 
1 1 1 -10 2  3  o 369.3354 24.33789 26.82810       3.471292      23.15999       4.261584      34.06071       5.984087  341.2638 32.54993 412.9597 37.72998 -71.69592      49.83021 
1 1 1 -10 2  4  o 530.0680 20.17853 54.89796       4.153832      60.27970       5.219678      45.60349       6.859532  554.6846 24.23091 478.2241 37.22810 76.46048       44.41924 
1 1 1 -10 2  5  o 459.8850 20.34418 41.34261       3.633435      44.91144       5.183083      37.89410       5.094957  477.0894 28.09843 437.5533 30.16777 39.53610       41.22640 
1 1 1 -10 2  6  o 946.1003 15.09082 174.4902       5.544700      179.2401       8.044650      170.1918       7.652798  956.9175 21.64735 932.6278 21.12924 24.28973       30.24983 
1 1 1 -10 2  7  o 841.9674 18.19985 138.4866       5.951017      137.1100       7.214048      141.4184       10.52814  836.5444 22.20558 845.5025 32.06335 -8.958130      39.00187 
1 1 1 -10 2  8  o 140.3405 53.09585 3.093159       3.967428      1.854028       4.737187      6.004086       7.260684  137.6722 56.14531 188.1118 71.67001 -50.43956      91.04332 
1 1 1 -10 2  9  o 373.3407 39.35486 28.17982       5.620035      19.38037       8.081829      36.41935       7.820473  295.9867 71.18121 420.7889 48.76007 -124.8022      86.28040 
1 1 1 -10 2  10 o 225.8230 51.16848 10.80321       4.383587      7.279997       7.629731      12.53927       5.355789  198.4962 73.93295 241.5501 57.85608 -43.05397      93.87975 
1 1 1 -10 2  11 o 269.4724 39.55602 14.82293       4.016349      10.98546       5.839509      18.26792       5.532841  225.2236 63.83858 295.8773 49.92849 -70.65366      81.04455 
1 1 1 -10 2  12 o 268.9247 40.49089 14.78320       4.097660      16.83762       5.964481      12.94681       5.639129  281.4585 56.52999 245.1770 59.76704 36.28149       82.26627 
1 1 1 -10 2  13 o 392.3242 29.74717 30.54229       4.498573      26.50904       6.368617      34.55869       6.355290  359.6631 46.69737 414.0152 40.02613 -54.35217      61.50395 
1 1 1 -10 2  14 f 436.3544 28.13948 37.62497       4.743098      23.79620       6.647492      51.96679       6.769684  338.8410 52.19205 511.0919 34.30576 -172.2509      62.45715 
1 1 1 -10 2  15 o 562.4398 24.21163 61.99932       5.288445      75.23186       7.748907      50.46231       7.235447  616.4730 32.48132 502.9443 37.30993 113.5287       49.46784 
1 1 1 -10 2  16 o 591.6190 23.91345 68.54380       5.494300      67.06174       7.920782      69.91823       7.627729  581.3082 35.25255 594.3238 33.18038 -13.01563      48.41157 
1 1 1 -10 2  17 f 292.2724 45.70122 17.44233       5.017436      16.06053       7.239774      18.71939       6.959947  273.6244 68.33482 297.5718 62.22774 -23.94745      92.42262 
1 1 1 -10 2  18 o 435.6599 34.79448 37.68309       5.837777      43.09261       8.194565      32.10864       8.318558  462.3512 46.25867 395.0480 55.77262 67.30316       72.45999 
1 1 1 -10 2  19 o 1115.125 19.36168 242.7124       8.384833      236.2665       11.70755      249.5006       12.01429  1097.352 27.47211 1127.683 27.43363 -30.33081      38.82423 
1 1 1 -10 2  20 o 223.6337 63.67750 10.60039       5.796421      5.224205       7.890574      16.90237       8.542996  188.9243 73.98009 278.1196 76.63920 -89.19528      106.5205 
1 1 1 -10 2  21 o 247.4100 61.68048 13.15456       5.905767      13.47991       8.125483      12.79020       8.598619  248.6766 76.59265 243.6937 79.27382 4.982864       110.2305 
1 1 1 -10 2  22 f 426.0301 39.21038 36.63479       6.414568      38.39647       9.162930      34.94167       8.982888  427.8625 56.52864 406.8226 58.54296 21.03995       81.38038 
1 1 1 -10 2  23 f 522.0168 34.30148 54.56863       6.915142      50.72442       9.399961      59.10308       10.20904  495.1747 49.54587 534.6883 49.73523 -39.51361      70.20247 
1 1 1 -10 2  24 o 357.5920 63.68864 27.97762       8.520357      26.34322       10.43962      31.23824       14.74539  335.5413 81.02937 349.1215 102.2165 -13.58020      130.4377 
1 1 1 -10 2  25 o 449.1964 61.69186 44.13149       10.47782      55.34338       14.56659      32.11116       15.08261  486.6581 79.84343 345.7239 103.9234 140.9342       131.0536 
1 1 1 -10 2  26 o 230.4707 84.94896 12.80977       10.02159      0.000000       0.000000      12.80977       10.02159  ?        ?        230.4707 84.94896 0.000000       84.94896 
1 1 1 -10 2  27 o 291.3724 66.03165 20.35396       7.299113      24.05966       10.42022      16.78407       10.22748  297.2753 85.61050 247.3806 86.44791 49.89474       121.6651 
1 1 1 -10 2  28 f 124.9975 60.11675 -7.435935      8.561918      -8.926003      14.07933      -6.561531      10.78537  155.2446 75.25572 142.6410 68.30373 12.60361       101.6308 
1 1 1 -10 2  29 o 116.1988 56.97446 -10.38616      8.749278      -13.12756      11.07564      -5.835997      14.26910  126.3957 62.38622 154.7725 75.19528 -28.37676      97.70553 
1 1 1 -10 2  30 o 131.6382 61.12754 -0.5879287E-01 7.504167      10.08135       10.82125      -9.452553      10.41538  178.0856 78.89854 124.1124 61.11284 53.97318       99.79858 
1 1 1 -10 2  31 o 143.3178 63.88922 4.830902       7.206412      3.621779       10.19544      6.038115       10.18738  145.0184 68.56967 151.9960 70.79397 -6.977585      98.55753 
1 1 1 -10 2  32 o 165.4010 67.59614 10.51500       6.884769      16.93822       9.932468      4.574744       9.551754  180.4712 77.84223 137.9142 65.54777 42.55704       101.7641 
1 1 1 -10 3  1  o 188.5932 37.59610 7.280201       2.656951      5.176369       3.602818      9.788561       3.933975  161.2057 51.20437 217.0428 47.95062 -55.83711      70.15091 
1 1 1 -10 3  2  o 120.2881 44.04332 2.367668       2.687531      0.3626326      3.602453      4.884161       4.035851  112.9435 47.73679 160.1059 54.36969 -47.16237      72.35237 
1 1 1 -10 3  3  o 296.1313 30.64235 17.44391       3.473007      20.92333       4.394489      11.65502       5.668292  323.3640 35.58235 234.1722 61.52801 89.19171       71.07601 
1 1 1 -10 3  4  o 494.2238 21.05165 47.75954       4.040525      48.69097       5.049702      46.10191       6.736473  497.4009 26.23433 481.0112 36.32993 16.38971       44.81187 
1 1 1 -10 3  5  o 726.7722 18.07366 103.1192       5.101201      106.9373       6.449366      96.73891       8.337122  739.0192 22.47157 700.4006 30.65079 38.61859       38.00582 
1 1 1 -10 3  6  o 939.7275 15.12263 172.1618       5.518961      165.4274       7.606709      179.6471       8.019631  919.3619 21.30504 957.9709 21.55630 -38.60901      30.30806 
1 1 1 -10 3  7  o 264.3714 39.91738 14.25283       3.970663      11.16471       4.813071      20.83272       7.025616  229.2025 54.81199 312.9276 59.99449 -83.72519      81.26311 
1 1 1 -10 3  8  o 120.8366 50.57616 0.8101469      3.980813      0.3073591      4.978364      1.701655       6.629134  129.6524 55.50140 155.4334 65.17455 -25.78101      85.60448 
1 1 1 -10 3  9  o 333.5519 43.36641 22.74057       5.484643      31.17865       8.011953      15.29912       7.523942  386.0974 54.98713 262.8712 71.71171 123.2262       90.36677 
1 1 1 -10 3  10 o 114.6984 50.35137 -0.6953530     4.312551      9.975369       7.434295      -6.107177      5.294375  218.1137 73.79333 102.4353 48.71893 115.6785       88.42505 
1 1 1 -10 3  11 o 157.7926 52.67730 4.908464       3.787870      2.116566       5.342916      7.729693       5.370907  145.6598 59.54034 193.1659 62.64215 -47.50615      86.42390 
1 1 1 -10 3  12 o 183.1358 53.51221 7.028769       4.044868      4.991754       5.774355      8.991262       5.667747  171.1570 64.20621 206.2248 64.04356 -35.06778      90.68636 
1 1 1 -10 3  13 o 383.1285 30.99160 29.17731       4.571732      39.44389       6.622642      19.83099       6.318861  443.1169 38.87733 307.3392 54.95844 135.7777       67.31921 
1 1 1 -10 3  14 f 414.9958 29.28949 34.08406       4.690145      36.02762       6.751594      32.27143       6.520189  422.7599 41.66462 399.5476 42.68115 23.21231       59.64580 
1 1 1 -10 3  15 o 582.7505 23.39535 66.50665       5.294685      66.66347       7.597260      66.35856       7.382969  579.8073 33.88751 578.7914 32.98245 1.015808       47.28853 
1 1 1 -10 3  16 o 142.9353 57.52251 2.187055       4.897985      2.401423       7.011688      1.982763       6.844917  164.7405 67.87326 160.7289 66.71432 4.011581       95.17132 
1 1 1 -10 3  17 o 729.4423 22.26982 104.0263       6.308637      95.03667       8.886771      113.1589       8.957166  694.4089 32.95344 758.5626 30.40543 -64.15369      44.83770 
1 1 1 -10 3  18 o 739.2151 31.90621 107.5525       9.159547      107.5525       9.159547      0.000000       0.000000  739.2151 31.90621 ?        ?        0.000000       31.90621 
1 1 1 -10 3  19 o 128.6318 56.76050 -1.226322      5.545913      -6.114593      7.550889      4.499354       8.172104  130.9235 60.96900 187.0700 74.64373 -56.14647      96.37897 
1 1 1 -10 3  20 o 252.4955 60.51059 13.56064       5.856031      14.34522       8.142935      12.72022       8.427765  257.3332 76.13597 244.6146 78.37997 12.71858       109.2708 
1 1 1 -10 3  21 o 428.4139 38.39647 36.85708       6.320479      34.27548       8.608575      39.87622       9.309535  405.5529 56.16598 437.9657 56.01786 -32.41278      79.32602 
1 1 1 -10 3  22 o 328.5757 52.50494 22.61624       6.474265      15.76343       8.717947      31.04312       9.667485  264.4694 78.89989 377.4760 68.46863 -113.0066      104.4660 
1 1 1 -10 3  23 o 430.7904 42.82940 37.89505       7.070334      44.14362       9.966122      31.56343       10.03213  456.7926 57.45053 377.1840 71.09525 79.60867       91.40622 
1 1 1 -10 3  24 o 181.4829 74.25301 4.418672       8.319429      -1.864566      10.02870      18.28518       14.89829  165.2149 74.37460 275.5548 103.1785 -110.3399      127.1903 
1 1 1 -10 3  25 o 319.2766 100.9147 27.10197       14.00712      27.10197       14.00712      0.000000       0.000000  319.2766 100.9147 ?        ?        0.000000       100.9147 
1 1 1 -10 3  26 o 352.4611 54.97136 27.27750       7.278957      26.08362       10.38544      28.43023       10.20493  321.5367 82.70066 340.0818 78.80916 -18.54507      114.2378 
1 1 1 -10 3  27 o 482.1879 41.36823 49.10590       7.671590      40.39462       11.13904      56.96619       10.58099  404.3960 73.64030 504.8145 54.85461 -100.4184      91.82550 
1 1 1 -10 3  28 o 121.3860 58.90546 -9.173136      8.688014      -4.432178      14.99849      -11.56724      10.65826  167.3219 80.23431 130.4413 63.73015 36.88062       102.4650 
1 1 1 -10 3  29 o 244.4199 80.95087 18.69314       8.951420      11.47756       10.95937      33.15460       15.51517  194.9707 82.87592 274.7443 104.7459 -79.77364      133.5669 
1 1 1 -10 3  30 o 152.7470 66.90607 5.058797       7.577397      3.512136       10.36625      6.833386       11.10384  154.1368 71.66468 165.9021 76.06564 -11.76527      104.5075 
1 1 1 -10 3  31 o 152.7651 66.43631 6.923709       7.355233      -0.7654665     10.19648      15.26520       10.62019  133.3875 64.51022 183.2860 79.77070 -49.89848      102.5911 
1 1 1 -10 3  32 o 94.46971 47.09930 -9.306881      6.950425      2.747574       9.797371      -21.52019      9.861715  133.0651 64.07501 95.21580 48.47034 37.84930       80.34290 
1 1 1 -10 4  1  f 387.9618 20.39653 29.48323       3.062288      26.73003       4.130391      32.84389       4.563365  367.6400 29.16902 407.7887 29.00434 -40.14874      41.13494 
1 1 1 -10 4  2  o 445.4971 18.82454 38.74225       3.256846      34.05542       4.494313      43.92517       4.726181  415.4433 28.02001 472.5750 25.85002 -57.13174      38.12276 
1 1 1 -10 4  3  o 467.4881 19.40863 42.68475       3.523656      45.60996       4.992890      39.78214       4.973569  481.2479 26.82162 448.8942 28.67942 32.35370       39.26714 
1 1 1 -10 4  4  o 896.7176 17.10236 156.8788       5.955793      158.8885       7.409054      153.2085       10.01264  901.3124 21.16701 882.1768 29.22571 19.13568       36.08579 
1 1 1 -10 4  5  o 186.8127 54.81750 7.276393       4.236650      7.276393       4.236650      0.000000       0.000000  186.8127 54.81750 ?        ?        0.000000       54.81750 
1 1 1 -10 4  6  o 361.1765 28.67107 25.85585       3.988458      23.20385       4.793047      31.82678       7.191928  339.7208 36.92426 394.3029 47.95370 -54.58209      60.52237 
1 1 1 -10 4  7  o 605.1172 21.12864 71.69463       4.965227      69.02962       6.046298      77.21381       8.701173  592.4242 26.28021 622.0518 36.17451 -29.62762      44.71291 
1 1 1 -10 4  8  o 374.8519 32.16907 28.02207       4.637649      31.44096       5.813932      22.04088       7.689903  395.1005 38.37494 319.7520 64.15797 75.34848       74.75882 
1 1 1 -10 4  9  o 307.7148 37.75478 19.15994       4.417134      18.99300       7.627500      19.24418       5.418121  294.4297 68.06818 305.0492 47.26410 -10.61948      82.86840 
1 1 1 -10 4  10 o 117.8224 50.53477 0.1175379      4.141578      -6.193450      7.138096      3.320234       5.085007  124.6370 58.44374 152.2979 59.45782 -27.66092      83.37208 
1 1 1 -10 4  11 o 624.2616 19.92138 76.25346       4.829631      69.10180       6.857054      83.29389       6.803521  590.6995 29.98955 650.3914 26.93587 -59.69189      40.31022 
1 1 1 -10 4  12 o 321.4426 34.41003 20.71964       4.228802      20.88734       5.994747      20.55353       5.966213  317.2765 50.33290 314.6061 50.54319 2.670319       71.33033 
1 1 1 -10 4  13 o 897.3040 17.67756 157.1944       6.160131      161.0527       8.789076      153.4690       8.636413  905.8041 24.98509 884.1567 25.15221 21.64734       35.45262 
1 1 1 -10 4  14 o 259.8583 45.79099 13.91403       4.452254      16.22560       6.655187      12.04141       5.990078  275.2524 63.54570 237.1885 63.68692 38.06389       89.96711 
1 1 1 -10 4  15 o 164.9145 59.24720 4.865890       4.831990      -0.4929740E-01 7.214108      8.865173       6.507344  152.8784 66.13958 208.8992 69.01242 -56.02071      95.58849 
1 1 1 -10 4  16 o 759.1544 21.18995 112.6235       6.247238      107.4741       8.816264      117.8168       8.853713  739.0117 30.71887 774.1708 29.44833 -35.15912      42.55412 
1 1 1 -10 4  17 o 414.7574 34.06337 34.14290       5.438217      25.92984       7.685665      42.37795       7.695945  353.4968 57.99641 459.3795 43.66327 -105.8827      72.59521 
1 1 1 -10 4  18 o 457.2166 33.16156 41.39291       5.848192      40.34664       8.077950      42.54529       8.477709  446.9646 47.25367 458.7100 48.31625 -11.74539      67.58231 
1 1 1 -10 4  19 o 379.6475 40.71137 28.93990       5.908727      23.16560       7.973202      35.97430       8.800291  331.0671 64.33174 418.3026 55.54604 -87.23550      84.99374 
1 1 1 -10 4  20 o 385.4632 41.79527 29.96210       6.156362      32.06944       8.410501      27.52969       9.035925  393.1187 56.73154 359.1676 67.25263 33.95111       87.98514 
1 1 1 -10 4  21 o 437.0962 38.36393 38.37615       6.446342      43.43856       9.193630      33.48013       9.041288  458.8583 52.53865 398.4591 60.31407 60.39926       79.98810 
1 1 1 -10 4  22 o 473.1396 36.90028 44.97117       6.726664      43.06666       9.429685      46.94446       9.598440  454.1852 54.55224 475.3692 52.88927 -21.18393      75.98172 
1 1 1 -10 4  23 o 207.3607 69.23242 9.139962       6.542860      5.401509       8.901178      13.53400       9.650135  191.8262 77.42273 245.8529 84.07005 -54.02670      114.2893 
1 1 1 -10 4  24 o 88.37749 44.90915 -29.25214      8.193389      -24.39467      9.728818      -41.10208      15.19543  108.7079 54.42815 129.3828 65.21048 -20.67487      84.94016 
1 1 1 -10 4  25 o 597.8047 38.98296 72.93329       9.000751      84.41882       15.12531      66.63609       11.19960  619.2652 63.80635 560.8909 52.00733 58.37433       82.31654 
1 1 1 -10 4  26 o 374.3186 54.50601 30.74438       7.690811      22.80936       10.93250      38.51872       10.82125  293.4554 88.53791 404.0439 71.58413 -110.5885      113.8563 
1 1 1 -10 4  27 o 488.8838 49.64788 52.36092       9.295370      19.84679       16.99744      66.23362       11.10268  248.8809 104.3600 545.9680 53.03314 -297.0871      117.0621 
1 1 1 -10 4  28 o 211.3022 78.89580 12.45951       8.698882      -21.18675      15.66000      27.47457       10.46133  142.5673 71.01804 306.6686 84.92964 -164.1014      110.7096 
1 1 1 -10 4  29 o 144.1153 65.91786 0.9485529      8.270054      3.730831       10.27455      -4.170571      13.93671  162.4032 73.96869 155.0184 75.07977 7.384827       105.3961 
1 1 1 -10 4  30 o 191.4231 73.39816 12.02202       7.645392      13.40170       10.55415      10.49862       11.09019  189.3248 80.92240 176.9177 79.03371 12.40709       113.1139 
1 1 1 -10 4  31 o 125.9102 59.21050 0.5385232      7.416445      -1.746220      10.29393      3.004498       10.69441  130.7305 63.59618 142.6093 68.21643 -11.87877      93.26283 
1 1 1 -10 4  32 o 157.2331 66.99232 9.586741       7.191811      16.22424       9.966478      2.375738       10.38813  175.1048 76.71475 132.5629 64.34826 42.54187       100.1292 
1 1 1 -10 5  1  o 214.7204 35.47415 9.349051       2.854801      11.49021       3.957252      7.025438       4.122407  236.1105 44.79575 184.2475 54.07580 51.86304       70.22002 
1 1 1 -10 5  2  o 379.6333 21.48169 28.27333       3.154103      34.65108       4.348400      21.19223       4.581906  419.2677 26.84710 324.9787 36.96233 94.28900       45.68348 
1 1 1 -10 5  3  o 460.1883 22.39149 41.45248       4.001719      42.68424       4.784169      38.58316       7.301831  465.4863 26.57518 437.1757 43.58902 28.31058       51.05137 
1 1 1 -10 5  4  o 252.0095 45.82038 13.11877       4.319201      13.11877       4.319201      0.000000       0.000000  252.0095 45.82038 ?        ?        0.000000       45.82038 
1 1 1 -10 5  5  o 508.2589 27.56459 50.96753       5.420476      50.96753       5.420476      0.000000       0.000000  508.2589 27.56459 ?        ?        0.000000       27.56459 
1 1 1 -10 5  6  o 330.1907 32.39035 21.76656       4.099971      23.30037       4.932648      18.33854       7.374214  340.0385 38.00281 290.6934 66.73206 49.34506       76.79441 
1 1 1 -10 5  7  o 431.1893 26.93663 36.72964       4.488057      37.49830       5.439502      35.09046       7.943362  434.0226 32.50759 412.6776 50.62563 21.34497       60.16392 
1 1 1 -10 5  8  o 171.6600 49.51809 6.140170       3.483565      5.694603       5.174299      6.509551       4.711209  173.4554 61.41614 179.1691 58.69815 -5.713669      84.95537 
1 1 1 -10 5  9  o 488.8114 24.85437 47.06805       4.702611      54.13495       8.979767      44.39756       5.520086  516.1193 45.25794 473.0924 30.20259 43.02695       54.41027 
1 1 1 -10 5  10 o 497.1524 26.00583 48.74327       5.003530      50.40205       8.809266      47.95329       6.079335  497.5562 46.11417 491.1440 32.04839 6.412231       56.15706 
1 1 1 -10 5  11 o 386.7344 28.43815 29.63204       4.241163      25.32968       6.019044      33.87450       5.976997  352.0284 45.06149 410.5900 37.91222 -58.56155      58.88866 
1 1 1 -10 5  12 o 387.3205 29.37349 29.73620       4.385394      30.93308       6.361197      28.65214       6.053969  390.8124 42.60254 376.1303 42.17129 14.68207       59.94492 
1 1 1 -10 5  13 o 307.7387 38.87209 19.12198       4.542042      22.61335       6.584058      15.95171       6.273989  330.0483 53.17400 273.6189 60.63724 56.42938       80.64954 
1 1 1 -10 5  14 o 656.1784 21.86991 84.22573       5.573100      83.87711       7.952630      84.56216       7.812348  652.2821 31.39405 655.1541 30.70508 -2.871948      43.91341 
1 1 1 -10 5  15 o 935.5718 18.71295 170.8273       6.799037      172.3187       9.570552      169.3076       9.660664  937.3382 26.29134 928.9397 26.77882 8.398499       37.52785 
1 1 1 -10 5  16 o 952.1500 18.87098 176.9010       6.977950      186.1654       10.07372      168.3555       9.674981  974.4165 26.62055 926.5450 26.88782 47.87146       37.83661 
1 1 1 -10 5  17 f 875.4924 20.26891 149.6386       6.891451      164.8393       9.909142      135.3994       9.590629  916.7048 27.83419 830.2261 29.74560 86.47864       40.73748 
1 1 1 -10 5  18 o 749.7144 23.15647 109.9198       6.742115      116.8259       9.699742      103.4642       9.377977  770.2921 32.42476 724.6236 33.32489 45.66846       46.49638 
1 1 1 -10 5  19 o 391.7177 40.31453 30.78248       6.045284      34.81012       8.916862      27.35661       8.223780  410.4255 57.52359 361.8142 60.67534 48.61133       83.60898 
1 1 1 -10 5  20 o 152.0909 62.21131 2.208024       5.837990      -2.299063      8.154959      6.946002       8.361234  151.2514 67.65543 202.2642 76.94639 -51.01274      102.4598 
1 1 1 -10 5  21 o 235.6185 64.95139 12.03239       6.134684      18.68520       8.258244      3.840657       9.163746  290.3372 73.24622 187.5523 77.46564 102.7849       106.6111 
1 1 1 -10 5  22 o 546.2479 33.15079 59.52045       6.999267      65.52290       10.10286      53.98034       9.705986  566.2353 46.34912 511.8707 49.44147 54.36456       67.76947 
1 1 1 -10 5  23 o 168.4766 70.65965 2.569022       7.794772      5.416064       9.074141      -5.446242      15.22536  192.7164 78.03464 190.5298 87.97786 2.186569       117.5989 
1 1 1 -10 5  24 o 538.2526 42.08978 59.25352       8.728104      58.19308       10.45036      61.69929       15.87069  526.7108 51.75787 515.7173 81.98621 10.99347       96.95677 
1 1 1 -10 5  25 o 193.8127 75.09895 7.241175       8.065336      2.914093       13.52513      9.628997       10.04720  199.6337 88.33755 215.0586 83.68305 -15.42485      121.6815 
1 1 1 -10 5  26 o 183.3107 71.92434 6.636846       7.470039      10.28873       10.89200      3.393694       10.26438  214.2989 85.94224 179.7549 78.32508 34.54396       116.2794 
1 1 1 -10 5  27 o 136.4904 64.10812 -4.383087      8.649565      0.3499524      15.26395      -6.621788      10.49771  184.7823 86.26217 143.4285 68.32381 41.35381       110.0423 
1 1 1 -10 5  28 o 164.9670 71.83223 4.361864       8.619898      -3.524490      15.14670      8.139440       10.48302  167.5178 80.40804 187.1943 80.34693 -19.67651      113.6709 
1 1 1 -10 5  29 o 157.6232 69.98601 4.267966       8.559914      8.776279       10.57352      -4.306060      14.58159  180.3822 79.02193 155.5441 75.67265 24.83809       109.4112 
1 1 1 -10 5  30 o 212.7731 79.23822 16.56476       8.763333      12.39141       10.62454      25.44651       15.49949  182.7282 79.65215 212.7594 94.33484 -30.03120      123.4647 
1 1 1 -10 5  31 o 137.5524 62.80449 3.941426       7.464930      15.61503       10.50673      -7.958301      10.60801  181.4025 79.13804 119.4186 59.31475 61.98390       98.89929 
1 1 1 -10 5  32 o 93.10548 46.66005 -10.81469      7.228447      -20.96205      10.15996      -0.4133148     10.28634  96.65646 49.20316 125.8961 61.73879 -29.23962      78.94700 
1 1 1 -10 6  1  o 581.0142 19.37928 65.93124       4.372727      63.69017       5.220279      71.20158       8.005447  570.2640 23.57164 599.0851 34.55543 -28.82117      41.82941 
1 1 1 -10 6  2  o 289.1548 31.61723 16.67984       3.492584      21.18720       4.124716      5.261381       6.565025  325.9133 33.04537 179.8254 68.23664 146.0879       75.81712 
1 1 1 -10 6  3  o 614.6727 19.21028 73.81013       4.585700      68.57168       5.376283      87.79703       8.784986  591.5954 23.40073 665.2526 34.11852 -73.65717      41.37230 
1 1 1 -10 6  4  o 549.4786 25.53346 59.27822       5.448645      59.27822       5.448645      0.000000       0.000000  549.4786 25.53346 ?        ?        0.000000       25.53346 
1 1 1 -10 6  5  o 276.1754 47.13885 15.76697       4.874363      15.76697       4.874363      0.000000       0.000000  276.1754 47.13885 ?        ?        0.000000       47.13885 
1 1 1 -10 6  6  o 604.0460 20.80162 71.40596       4.879722      72.06453       5.927723      70.02142       8.594896  605.7230 25.19914 591.8639 37.58799 13.85913       45.25322 
1 1 1 -10 6  7  o 479.8665 21.14211 45.08467       3.940006      46.37838       5.640882      43.85227       5.505599  483.7527 30.17638 470.3023 30.30523 13.45041       42.76706 
1 1 1 -10 6  8  o 224.6905 42.09776 10.42736       3.538445      13.58591       5.246590      7.791975       4.792428  253.0513 54.96106 192.8437 58.71849 60.20758       80.42747 
1 1 1 -10 6  9  o 161.2866 56.16460 4.932076       4.315220      6.843969       8.311618      4.226561       5.049018  199.9783 76.56470 159.7844 60.01908 40.19397       97.28536 
1 1 1 -10 6  10 o 644.5674 22.24626 81.40849       5.568695      84.51336       10.68053      80.24933       6.525916  647.6884 42.70139 638.8160 26.30496 8.872375       50.15336 
1 1 1 -10 6  11 o 430.0164 26.11186 36.46479       4.340005      40.21256       6.379352      33.23560       5.921570  448.3069 36.97128 406.9843 37.90127 41.32263       52.94697 
1 1 1 -10 6  12 o 424.2614 27.28934 35.52600       4.472438      34.15170       6.251262      36.96709       6.401375  412.2992 39.52600 429.3426 38.81167 -17.04337      55.39540 
1 1 1 -10 6  13 o 613.3727 21.65929 73.58968       5.159369      83.10104       7.504474      65.06442       7.104817  649.7183 29.74179 573.4306 32.03196 76.28772       43.71065 
1 1 1 -10 6  14 o 483.1318 27.15092 45.95496       5.073575      45.03663       7.101772      46.91224       7.250785  474.8777 38.84864 484.7236 38.84426 -9.845978      54.93718 
1 1 1 -10 6  15 o 205.2552 57.87616 8.810525       4.812631      1.534736       6.825091      16.00584       6.787242  158.1301 66.20789 274.0762 64.78927 -115.9461      92.63441 
1 1 1 -10 6  16 o 658.1437 23.78628 84.73827       6.079603      86.49358       8.667743      83.03844       8.529634  661.5850 33.84925 648.1514 34.00513 13.43353       47.98042 
1 1 1 -10 6  17 f 465.0428 31.76770 42.73047       5.702960      47.81218       8.264482      38.11097       7.879679  488.2989 44.05594 434.3929 47.48195 53.90594       64.77238 
1 1 1 -10 6  18 o 287.5211 51.46019 17.06860       5.535069      13.91984       7.756858      20.33519       7.900664  255.1449 73.97588 308.9339 67.72000 -53.78900      100.2917 
1 1 1 -10 6  19 o 261.7589 59.67920 14.50457       5.931980      8.347023       8.218170      21.20239       8.571131  212.0293 77.11124 313.1899 71.97881 -101.1605      105.4850 
1 1 1 -10 6  20 o 290.9361 54.48553 17.74771       5.929877      27.41183       8.565790      8.853970       8.217287  359.1333 63.75133 214.1038 77.22289 145.0295       100.1379 
1 1 1 -10 6  21 o 242.0100 66.04766 12.76788       6.380816      8.578356       8.870379      17.26039       9.185544  213.3230 79.66590 276.5779 80.59028 -63.25491      113.3201 
1 1 1 -10 6  22 o 490.4603 36.14980 48.29593       6.837000      41.53814       9.554120      55.38875       9.788082  444.1969 56.67604 518.4240 49.20624 -74.22702      75.05617 
1 1 1 -10 6  23 o 247.2702 76.27104 13.85966       8.054039      25.64738       9.397414      -18.75617      15.63175  336.6725 73.90080 163.8243 79.38593 172.8483       108.4595 
1 1 1 -10 6  24 o 457.4706 99.59908 52.86837       17.19303      0.000000       0.000000      52.86837       17.19303  ?        ?        457.4706 99.59908 0.000000       99.59908 
1 1 1 -10 6  25 o 356.3900 63.44162 28.53090       8.458820      41.54454       14.59683      21.95110       10.37925  399.5031 95.39820 295.1991 85.56670 104.3040       128.1502 
1 1 1 -10 6  26 o 242.3223 74.00142 14.59408       7.603638      9.517996       10.77094      19.63680       10.73549  208.4891 84.80147 268.4980 88.63843 -60.00894      122.6705 
1 1 1 -10 6  27 o 157.7380 70.47132 1.466054       8.819277      -5.246724      15.44946      4.710908       10.74137  171.3280 81.96368 179.7843 79.18002 -8.456314      113.9628 
1 1 1 -10 6  28 o 191.1714 74.01188 9.696128       7.828310      -8.588708      11.00954      28.39438       11.13330  136.6821 66.32409 300.5063 89.05135 -163.8242      111.0362 
1 1 1 -10 6  29 o 155.5353 69.33390 4.167081       8.486455      7.369034       10.33999      -2.441332      14.85462  172.5793 76.75912 157.9121 76.72108 14.66718       108.5269 
1 1 1 -10 6  30 o 176.1940 73.36990 10.53397       8.317014      1.389507       9.908343      32.34405       15.30208  142.4707 67.43545 233.0295 98.43288 -90.55878      119.3171 
1 1 1 -10 6  31 o 121.0235 57.31766 -0.8233806E-01 7.178988      -2.534910      10.12853      2.393707       10.17689  126.3520 61.81520 137.4051 65.94222 -11.05315      90.38526 
1 1 1 -10 6  32 o 126.7398 59.49603 2.892477       7.432627      2.652152       10.18038      3.166807       10.87679  131.2326 63.70229 133.2639 64.94867 -2.031265      90.97424 
1 1 1 -10 7  1  o 471.3781 22.32226 43.48127       4.086350      42.29398       4.963275      45.97953       7.199583  463.1320 27.72276 479.4796 39.00223 -16.34760      47.85107 
1 1 1 -10 7  2  o 765.8577 17.43663 114.4491       5.186074      111.8328       6.247040      120.2500       9.302078  756.1554 21.27332 781.0596 30.66675 -24.90424      37.32297 
1 1 1 -10 7  3  o 1567.117 18.28710 479.5111       11.12946      484.2671       13.74949      470.4736       18.95358  1572.639 22.51281 1543.850 31.61246 28.78882       38.80946 
1 1 1 -10 7  4  o 266.1483 47.34156 14.65666       4.713891      14.65666       4.713891      0.000000       0.000000  266.1483 47.34156 ?        ?        0.000000       47.34156 
1 1 1 -10 7  5  o 226.1761 44.02634 10.58950       3.727989      16.59753       4.589807      -1.058666      6.390830  284.9960 42.79111 138.4321 61.01587 146.5639       74.52527 
1 1 1 -10 7  6  o 589.0333 18.28676 67.77313       4.183162      67.67281       6.066028      67.86410       5.776365  586.6549 26.62525 587.8387 25.30279 -1.183777      36.73058 
1 1 1 -10 7  7  o 327.8444 29.16900 21.35023       3.674995      22.70332       5.352726      20.14369       5.054539  334.2301 42.17745 314.4448 42.47857 19.78528       59.86122 
1 1 1 -10 7  8  o 801.1041 16.49942 125.2283       5.133169      130.2559       7.522452      120.8473       7.022140  814.8890 23.77021 785.1500 23.02973 29.73901       33.09669 
1 1 1 -10 7  9  o 217.1234 51.77190 9.949421       4.303986      -3.141248      7.897962      15.47909       5.133147  144.7276 65.49747 272.4379 50.37175 -127.7103      82.62706 
1 1 1 -10 7  10 o 189.5196 57.08374 7.478856       4.547297      9.786289       8.737294      6.621672       5.325364  222.5611 79.70010 183.4140 62.45370 39.14714       101.2550 
1 1 1 -10 7  11 f 124.0544 51.54323 0.9835306      4.091612      -1.421135      5.865454      3.262810       5.710485  130.8631 58.02689 158.2873 62.63642 -27.42419      85.38408 
1 1 1 -10 7  12 o 414.1609 28.69855 33.88986       4.587447      43.58358       6.793835      25.76607       6.219413  467.1687 37.76978 355.7615 46.09950 111.4072       59.59631 
1 1 1 -10 7  13 o 558.0200 22.96960 60.93309       4.977727      64.02909       7.071844      57.89297       7.007732  569.0662 32.13078 540.5836 33.54564 28.48254       46.45102 
1 1 1 -10 7  14 o 280.5153 45.94709 16.09895       4.832096      12.52527       6.799439      19.74539       6.868312  242.5038 68.93826 306.7092 59.81117 -64.20534      91.26807 
1 1 1 -10 7  15 o 155.7971 58.20781 3.887799       4.736435      11.74900       6.805715      -3.496101      6.595873  235.8810 69.55218 130.4283 59.35125 105.4527       91.43345 
1 1 1 -10 7  16 o 414.9642 34.35921 34.15951       5.487280      33.62054       7.664232      34.72634       7.859837  407.1049 49.49514 413.6818 49.93362 -6.576904      70.30743 
1 1 1 -10 7  17 o 393.3228 37.21686 30.82981       5.617238      27.79921       7.965801      33.82741       7.922326  366.7065 57.85298 407.7422 51.15714 -41.03571      77.22707 
1 1 1 -10 7  18 o 215.0305 61.78561 9.690630       5.432996      12.33966       7.648540      6.992723       7.718775  241.6782 74.28983 200.5463 74.42892 41.13190       105.1601 
1 1 1 -10 7  19 o 631.0474 26.71751 78.17281       6.547657      77.40288       9.201060      78.96270       9.319648  623.3290 38.19371 629.5573 38.30059 -6.228271      54.08969 
1 1 1 -10 7  20 o 352.3208 46.89308 25.43091       6.256806      28.88855       8.833290      21.94942       8.863708  368.2028 64.10315 315.7417 73.63858 52.46112       97.63122 
1 1 1 -10 7  21 o 147.0783 67.91755 -5.342316      9.075487      0.000000       0.000000      -5.342316      9.075487  ?        ?        147.0783 67.91755 0.000000       67.91755 
1 1 1 -10 7  22 o 161.7072 66.03821 2.993568       6.565037      -2.651478      8.891422      9.759851       9.734476  154.3303 69.70056 222.1198 83.35662 -67.78955      108.6577 
1 1 1 -10 7  23 o 216.6100 77.86573 9.848917       8.347266      6.387259       9.602180      20.55690       16.88814  200.2086 80.55135 288.8506 109.4828 -88.64197      135.9228 
1 1 1 -10 7  24 o 130.4826 60.26015 -4.000227      7.147096      -6.963480      10.10603      -1.035225      10.10901  147.7379 69.36044 167.3224 75.05064 -19.58449      102.1933 
1 1 1 -10 7  25 o 227.9764 77.40679 12.39742       8.180482      18.12469       13.53860      9.103960       10.26658  261.2739 98.25420 210.0018 83.70490 51.27211       129.0752 
1 1 1 -10 7  26 o 221.1222 75.25097 12.20509       7.731337      -12.48547      10.80018      38.15606       11.07242  133.9727 65.16593 392.9688 75.29424 -258.9961      99.57821 
1 1 1 -10 7  27 o 187.9882 76.39689 8.130768       8.732206      -23.37794      15.23423      23.54872       10.65660  139.6868 69.65681 281.9560 87.85912 -142.2691      112.1218 
1 1 1 -10 7  28 o 100.2563 49.84718 -13.85111      7.566807      -14.61558      10.49119      -13.02224      10.92410  121.0699 59.93338 126.5911 62.38253 -5.521172      86.50775 
1 1 1 -10 7  29 o 114.5965 55.89566 -7.670600      8.102020      -10.16022      10.08850      -3.147977      13.59737  122.2026 60.16737 150.8092 73.30072 -28.60659      94.83199 
1 1 1 -10 7  30 o 164.2747 71.69794 8.690125       8.632635      19.28359       10.39151      -14.90300      15.50787  209.4714 83.96629 131.5768 66.26046 77.89459       106.9616 
1 1 1 -10 7  31 o 109.2663 53.20542 -4.038815      7.252796      -2.067023      10.44572      -5.874286      10.07816  127.0344 62.28053 118.7815 58.79010 8.252838       85.64544 
1 1 1 -10 8  1  o 574.5272 17.21144 64.38519       3.840218      63.89021       5.324063      64.92200       5.544414  571.0961 24.00524 575.5181 24.80668 -4.421997      34.51989 
1 1 1 -10 8  2  o 645.4913 16.89529 81.27043       4.235300      83.47813       5.997331      79.07406       5.981935  652.7941 23.65668 635.1998 24.24953 17.59430       33.87740 
1 1 1 -10 8  3  o 712.4677 15.99631 98.97556       4.426015      95.65923       6.190413      102.4438       6.330602  698.9390 22.80617 723.3719 22.53489 -24.43292      32.06154 
1 1 1 -10 8  4  o 241.8178 39.60693 11.92847       3.590717      11.95504       4.519682      11.88300       5.912458  239.0565 50.27725 235.5075 63.28872 3.548935       80.82861 
1 1 1 -10 8  5  o 254.2678 39.80193 13.17249       3.801358      11.53041       4.631629      16.56147       6.653831  234.0711 52.27243 277.8714 63.09916 -43.80028      81.93846 
1 1 1 -10 8  6  o 502.1392 20.54547 49.31484       4.006528      48.95576       5.785781      49.64566       5.553527  497.3997 30.09385 501.3429 28.64255 -3.943237      41.54558 
1 1 1 -10 8  7  f 485.3509 21.32188 46.09871       4.018919      45.27076       5.818137      46.85428       5.558004  477.7953 31.53282 486.7280 29.54365 -8.932648      43.21048 
1 1 1 -10 8  8  o 504.0461 21.57592 49.72393       4.223452      51.41879       6.054892      48.11790       5.894081  509.6271 30.73711 492.8737 30.95015 16.75342       43.61974 
1 1 1 -10 8  9  o 202.6697 53.98410 8.651785       4.325106      -7.110913      7.937515      15.30825       5.158117  131.0421 61.50542 271.1341 50.85497 -140.0919      79.80692 
1 1 1 -10 8  10 o 639.0890 22.55985 79.95380       5.599195      64.70877       9.827409      87.28124       6.813199  566.5505 45.03720 666.7635 26.31184 -100.2131      52.15997 
1 1 1 -10 8  11 f 556.6538 22.15776 60.61736       4.790039      61.70015       6.857033      59.58538       6.694178  558.5729 31.74130 548.9521 31.53275 9.620789       44.74176 
1 1 1 -10 8  12 f 409.0760 28.59894 33.03216       4.514824      33.29127       6.695128      32.81607       6.114195  406.5699 43.05820 404.8051 39.39144 1.764740       58.35832 
1 1 1 -10 8  13 o 725.8284 20.05620 102.8632       5.653410      105.2252       8.075986      100.5936       7.916655  732.0928 28.40543 715.7790 28.47966 16.31384       40.22387 
1 1 1 -10 8  14 o 465.1664 28.66029 42.62572       5.152252      45.68793       7.450151      39.81871       7.132964  478.3346 40.48563 445.9622 41.66830 32.37241       58.09762 
1 1 1 -10 8  15 o 610.7169 23.68009 72.93512       5.616312      72.40645       7.891187      73.47781       7.995163  605.4296 33.69567 609.8453 33.89191 -4.415710      47.79184 
1 1 1 -10 8  16 o 628.4812 24.33809 77.26191       5.940277      74.85260       8.490198      79.57236       8.314206  615.0398 35.69925 634.7858 33.84826 -19.74603      49.19492 
1 1 1 -10 8  17 o 260.6174 56.32790 14.21008       5.534771      14.56937       7.827937      13.85091       7.826759  260.9296 73.89637 254.8986 74.42496 6.030960       104.8797 
1 1 1 -10 8  18 o 375.1399 41.06809 28.28272       5.885360      19.89644       8.296346      36.77830       8.350227  303.8009 71.50687 424.5110 51.71925 -120.7101      88.25029 
1 1 1 -10 8  19 o 480.9088 35.20226 46.04228       6.528793      40.90689       8.889513      52.05622       9.619896  446.5506 52.24781 505.6019 49.63281 -59.05124      72.06420 
1 1 1 -10 8  20 o 759.2076 24.88895 113.2221       7.338295      110.0719       10.13521      116.6933       10.63894  744.3794 35.05987 766.0941 35.75925 -21.71472      50.07912 
1 1 1 -10 8  21 o 526.9572 34.74723 55.51021       7.070973      57.87678       9.865232      53.00989       10.14017  531.1660 48.35380 505.8591 52.37512 25.30692       71.28284 
1 1 1 -10 8  22 o 232.5585 70.71970 11.96751       6.954901      16.79073       9.640427      6.732679       10.04337  269.6004 83.49252 205.6335 82.50542 63.96689       117.3803 
1 1 1 -10 8  23 o 190.7820 76.30035 5.808591       8.559253      12.21922       9.898921      -13.18410      17.03847  235.3126 84.77288 181.8742 86.74989 53.43846       121.2930 
1 1 1 -10 8  24 o 177.6165 70.90030 5.136789       7.375715      -9.437772      10.47107      19.48948       10.39106  143.2993 68.25530 280.3364 86.65980 -137.0372      110.3119 
1 1 1 -10 8  25 o 422.5513 55.75135 39.23670       8.925373      43.93341       14.08406      36.08459       11.53803  410.8162 90.70307 382.3519 80.26060 28.46423       121.1149 
1 1 1 -10 8  26 o 199.0211 78.29449 9.173236       8.873734      14.69620       16.77511      7.027312       10.45650  232.0862 100.6313 191.8883 81.22886 40.19786       129.3243 
1 1 1 -10 8  27 o 402.8037 60.93751 38.78740       9.234624      39.90633       15.63563      38.18801       11.44380  333.7133 106.7417 373.1822 81.26527 -39.46890      134.1560 
1 1 1 -10 8  28 o 113.4179 54.89611 -7.079993      7.420776      -1.162484      10.44098      -13.12056      10.54898  148.9819 70.12042 122.9858 60.73714 25.99615       92.76785 
1 1 1 -10 8  29 f 171.3367 72.18999 8.517899       8.196872      10.51105       10.00070      4.438206       14.30784  179.9656 77.86548 164.8513 78.86839 15.11433       110.8298 
1 1 1 -10 8  30 o 137.8921 64.64175 2.289567       8.722337      3.661069       10.42656      -0.9077910     15.91984  145.9156 69.09787 146.8476 72.89165 -0.9320374     100.4376 
1 1 1 -10 8  31 o 113.8511 54.61353 -1.464043      6.962945      4.729716       10.00690      -7.277359      9.694700  139.9427 66.67548 113.8050 56.55678 26.13767       87.43163 
1 1 1 -10 9  1  o 772.4225 16.09668 116.2921       4.828578      115.5688       5.651923      118.2464       9.290380  769.4640 18.91385 774.9790 30.86850 -5.515015      36.20219 
1 1 1 -10 9  2  o 101.2932 43.75574 -0.2313380     3.147761      1.508999       4.482405      -1.924652      4.421433  133.0841 54.48310 109.6913 49.38126 23.39284       73.53174 
1 1 1 -10 9  3  o 1021.321 14.86318 203.2370       5.895246      208.6217       8.482145      198.2053       8.199320  1032.964 21.14426 1006.904 20.96824 26.06073       29.77829 
1 1 1 -10 9  4  o 345.6022 28.99696 23.65847       3.855885      21.26583       4.646562      28.95002       6.910102  325.3526 37.45859 376.5012 48.37886 -51.14853      61.18546 
1 1 1 -10 9  5  o 301.2889 34.89491 18.19348       4.007365      17.67945       5.134471      18.99463       6.409963  293.4624 46.61049 300.7670 56.96342 -7.304535      73.60278 
1 1 1 -10 9  6  o 630.5403 25.91778 78.03527       6.346563      0.000000       0.000000      78.03527       6.346563  ?        ?        630.5403 25.91778 0.000000       25.91778 
1 1 1 -10 9  7  o 1019.122 15.77947 202.4704       6.245203      212.8718       9.025820      192.9166       8.650249  1042.934 22.28444 992.7949 22.43578 50.13947       31.62215 
1 1 1 -10 9  8  o 839.4776 16.62763 137.4310       5.420852      135.8844       7.718287      138.9366       7.615237  832.8484 23.86310 842.3291 23.27950 -9.480652      33.33741 
1 1 1 -10 9  9  o 150.8926 56.77985 3.598121       4.522637      1.640745       8.790394      4.302783       5.274262  175.6068 74.41454 163.1978 61.33503 12.40900       96.43395 
1 1 1 -10 9  10 o 234.0344 51.93246 11.45381       4.596714      20.68183       8.734541      7.919046       5.405874  308.6723 73.85345 197.0319 62.73649 111.6404       96.90304 
1 1 1 -10 9  11 o 560.5544 22.07979 61.42931       4.806631      57.07446       6.927685      65.47176       6.674582  537.0082 33.38371 576.3336 29.92396 -39.32538      44.83208 
1 1 1 -10 9  12 o 317.5702 38.08123 20.22985       4.602881      20.62557       6.633604      19.86242       6.392029  315.1213 56.27007 309.4548 55.21315 5.666504       78.83408 
1 1 1 -10 9  13 o 309.2805 39.05569 19.21868       4.586415      26.74357       6.664192      12.44737       6.321693  362.7499 48.52134 242.3841 65.57125 120.3658       81.57150 
1 1 1 -10 9  14 o 598.5038 33.77210 70.75172       7.817636      70.75172       7.817636      0.000000       0.000000  598.5038 33.77210 ?        ?        0.000000       33.77210 
1 1 1 -10 9  15 o 896.9699 19.65394 156.9564       6.846293      153.2566       9.713373      160.6089       9.651167  884.1336 28.28943 905.3467 27.44966 -21.21313      39.41796 
1 1 1 -10 9  16 o 687.6396 23.24568 92.42955       6.207707      93.43764       8.714413      91.39101       8.845093  689.1837 32.55930 681.3560 33.42722 7.827698       46.66356 
1 1 1 -10 9  17 o 372.8078 40.55481 27.87661       5.776870      27.48483       8.074973      28.28735       8.267900  363.8585 59.17913 369.0304 59.73179 -5.171936      84.08363 
1 1 1 -10 9  18 o 183.5452 64.99336 6.282306       5.794715      8.390965       8.180278      4.158435       8.209730  211.9754 76.95744 184.7777 74.43314 27.19771       107.0642 
1 1 1 -10 9  19 o 456.5541 36.47561 41.64934       6.413303      48.88352       9.163239      34.70295       8.979124  489.6230 48.84207 407.5263 58.40480 82.09674       76.13585 
1 1 1 -10 9  20 o 664.7964 28.36857 87.17089       7.324097      91.30882       10.24125      82.83901       10.47851  674.5810 39.26205 640.7416 42.34914 33.83936       57.74910 
1 1 1 -10 9  21 o 295.0382 61.08513 18.81008       6.768631      31.00452       9.566510      6.586122       9.578081  377.0413 67.82756 203.4051 80.92060 173.6362       105.5875 
1 1 1 -10 9  22 o 118.9596 57.45782 -10.95813      8.023076      -8.889654      9.370559      -16.63906      15.52922  137.6888 65.28976 167.3702 80.61301 -29.68138      103.7363 
1 1 1 -10 9  23 o 190.0114 76.76267 5.619874       8.758992      -2.380278      10.20055      28.07656       17.09021  163.8921 74.27891 320.8140 111.7693 -156.9219      134.2004 
1 1 1 -10 9  24 o 304.4266 66.92843 21.25142       7.697102      31.16351       11.00499      11.75896       10.76952  358.5140 80.95652 227.9919 87.18578 130.5222       118.9761 
1 1 1 -10 9  25 o 672.7079 36.69469 93.03810       9.550234      111.5984       16.53694      83.75029       11.69821  703.7447 61.11471 625.3428 48.55022 78.40186       78.05211 
1 1 1 -10 9  26 o 199.1976 79.28977 9.494787       9.200507      -7.724068      16.49858      17.26623       11.08397  171.8758 82.86080 243.3884 89.39428 -71.51260      121.8903 
1 1 1 -10 9  27 o 360.4670 58.80087 31.09872       7.947641      21.11718       10.98758      42.05186       11.50993  255.7150 89.58908 393.4388 78.08535 -137.7238      118.8424 
1 1 1 -10 9  28 o 173.2880 69.66776 7.849124       7.176824      7.213632       10.22344      8.466574       10.07727  173.8614 76.87423 178.8078 77.76306 -4.946396      109.3469 
1 1 1 -10 9  29 o 194.9627 76.35766 13.33373       8.406994      11.82956       10.01617      16.91971       15.46530  181.9954 78.33540 189.4399 87.89332 -7.444489      117.7356 
1 1 1 -10 9  30 o 184.3341 75.29191 13.78273       8.535711      6.777812       10.02318      32.27040       16.28340  151.9186 70.57858 207.0723 93.84869 -55.15369      117.4262 
1 1 1 -10 9  31 o 152.6933 65.88390 8.519347       7.120197      2.962327       9.906920      14.45668       10.24031  133.8968 64.46460 168.1419 75.46908 -34.24510      99.25354 
1 1 1 -10 10 1  o 597.4832 22.07100 69.77642       5.121245      66.44103       6.608356      74.79141       8.103185  580.8395 29.39171 614.9023 34.06599 -34.06274      44.99294 
1 1 1 -10 10 2  f 706.7012 16.07364 97.32789       4.411417      104.7849       6.394202      90.55469       6.093990  732.0119 22.49263 680.3711 23.06364 51.64081       32.21568 
1 1 1 -10 10 3  o 134.4869 48.23311 3.133498       3.201144      5.435060       4.519846      0.8170999      4.534391  168.7005 57.53630 128.7184 53.93404 39.98206       78.86258 
1 1 1 -10 10 4  o 126.4840 50.15264 1.860476       3.667918      5.442021       4.345699      -7.010926      6.839440  167.7663 56.42089 119.5535 56.41620 48.21281       79.78787 
1 1 1 -10 10 5  o 1002.627 17.95822 196.1152       6.992471      200.3714       8.665707      188.1723       11.83820  1012.250 22.04389 977.5201 31.18400 34.73010       38.18867 
1 1 1 -10 10 6  o 877.2028 16.05321 149.9774       5.468772      152.3393       7.795203      147.6883       7.674241  882.4210 22.74697 868.8470 22.74386 13.57397       32.16687 
1 1 1 -10 10 7  o 247.7589 39.30989 12.46274       3.656029      16.40289       5.183913      8.563379       5.157003  282.1113 49.09964 202.9362 60.71507 79.17505       78.08389 
1 1 1 -10 10 8  o 514.3591 21.89120 51.71902       4.372843      50.29548       6.201466      53.12676       6.166946  504.3978 31.82184 518.7521 30.74847 -14.35437      44.25040 
1 1 1 -10 10 9  o 299.4236 39.79260 18.07405       4.512579      18.21961       8.000613      18.00613       5.464792  290.9408 71.35303 296.0886 49.25563 -5.147766      86.70278 
1 1 1 -10 10 10 o 333.9342 33.48512 22.18417       4.284010      23.35360       6.173935      21.09828       5.949316  338.5144 48.33565 321.1574 49.27353 17.35706       69.02329 
1 1 1 -10 10 11 o 327.0095 49.31692 21.83852       6.068354      0.000000       0.000000      21.83852       6.068354  ?        ?        327.0095 49.31692 0.000000       49.31692 
1 1 1 -10 10 12 o 224.2225 51.07907 10.45723       4.348521      9.906909       6.419899      10.92377       5.911043  219.1618 68.17712 228.0148 64.08840 -8.852982      93.57052 
1 1 1 -10 10 13 o 525.0061 25.46902 53.93768       5.192836      55.83801       7.548824      52.23066       7.154583  530.7270 36.85368 513.4290 36.11183 17.29797       51.59707 
1 1 1 -10 10 14 o 365.4666 35.45377 26.55287       4.968669      26.89493       7.084804      26.22179       6.970119  363.2424 51.68041 358.6333 51.52484 4.609100       72.97721 
1 1 1 -10 10 15 o 184.4987 60.94734 6.667954       5.075295      14.35757       7.252398      -0.7122245     7.104976  259.8800 70.20227 149.4594 65.14365 110.4206       95.77084 
1 1 1 -10 10 16 o 315.9254 46.89898 20.30982       5.579420      18.73774       7.941212      21.84237       7.840729  296.1046 70.13738 321.8600 64.96714 -25.75537      95.60326 
1 1 1 -10 10 17 o 208.9593 63.70296 9.063548       5.638098      7.274700       8.058431      10.77890       7.891150  204.1983 75.99647 229.3165 76.00835 -25.11818      107.4836 
1 1 1 -10 10 18 o 689.7004 25.72735 93.35159       6.891020      95.40525       9.912305      91.43066       9.586602  692.4407 36.99464 678.0225 36.54257 14.41815       51.99965 
1 1 1 -10 10 19 o 399.3547 41.74245 32.26577       6.378210      32.74063       8.951662      31.77609       9.090236  394.0468 60.42399 387.0035 62.62201 7.043304       87.02055 
1 1 1 -10 10 20 o 202.4567 68.51659 8.435453       6.409118      12.15725       9.441181      5.254381       8.728443  238.6176 83.07677 191.7519 76.92232 46.86572       113.2201 
1 1 1 -10 10 21 o 149.4065 64.04529 0.7829453      6.645394      -1.520848      9.580173      2.919479       9.225851  164.7002 73.52472 181.5621 76.54750 -16.86197      106.1386 
1 1 1 -10 10 22 o 131.2929 61.83487 -6.973369      8.143420      -12.88733      9.664000      7.510408       15.12372  129.8089 62.78524 229.9034 97.52556 -100.0944      115.9880 
1 1 1 -10 10 23 o 257.3479 72.00048 15.34710       7.478587      32.03327       10.59571      -1.217445      10.55703  371.2812 76.04311 169.6251 76.33904 201.6561       107.7507 
1 1 1 -10 10 24 o 139.2181 63.77573 -2.781361      7.782362      6.554096       12.95907      -8.047173      9.732824  207.0639 89.11453 139.0586 66.11340 68.00536       110.9612 
1 1 1 -10 10 25 o 123.4746 59.36845 -8.531684      8.336769      -12.86379      13.56296      -5.900991      10.56915  151.3167 73.46896 147.9627 69.91677 3.354050       101.4201 
1 1 1 -10 10 26 o 158.5029 70.81208 1.784745       8.904441      -4.599705      16.24155      4.528485       10.64725  174.0987 83.48630 177.3309 78.42770 -3.232193      114.5464 
1 1 1 -10 10 27 o 170.1642 69.82246 6.565129       7.382703      4.762677       10.04724      8.680456       10.88437  169.3417 75.46809 186.9030 81.04962 -17.56139      110.7451 
1 1 1 -10 10 28 o 128.1082 59.31803 -0.6462053     6.992233      -4.220473      9.845859      2.990674       9.931722  134.0732 64.47796 154.8978 71.35847 -20.82452      96.17400 
1 1 1 -10 10 29 o 162.4291 70.66742 7.950859       8.328550      19.55730       10.03997      -17.65902      14.91374  216.3306 83.79909 127.8827 64.47322 88.44796       105.7312 
1 1 1 -10 10 30 o 153.0578 68.60917 7.844923       8.434090      4.115446       9.819839      18.33270       16.46729  141.4575 67.00715 169.8641 82.11030 -28.40665      105.9814 
1 1 1 -10 11 1  o 457.6919 22.14966 40.91978       3.937025      40.81811       4.654203      41.17557       7.381973  455.8099 26.40573 453.7044 42.38693 2.105499       49.93910 
1 1 1 -10 11 2  o 584.0298 22.81158 66.66586       5.173903      71.82677       6.772039      59.42936       8.019009  605.0420 28.82080 547.0342 37.98204 58.00781       47.67886 
1 1 1 -10 11 3  o 923.4826 15.62187 166.1180       5.602601      170.1159       8.009737      162.2882       7.839551  933.0670 22.10433 911.3354 22.15058 21.73157       31.29296 
1 1 1 -10 11 4  o 705.0347 19.65787 97.00626       5.382388      95.80854       6.652376      99.27649       9.158686  699.7040 24.48130 709.9454 33.21851 -10.24146      41.26504 
1 1 1 -10 11 5  o 657.6125 20.35485 84.42785       5.198357      85.59781       6.378118      82.11294       8.971673  661.2827 24.83575 643.8911 36.02287 17.39166       43.75456 
1 1 1 -10 11 6  o 577.4049 19.39699 65.05506       4.349535      65.37935       6.183506      64.73747       6.119340  577.4071 27.57558 574.5968 27.42290 2.810303       38.88995 
1 1 1 -10 11 7  o 119.2243 49.05480 1.018776       3.656517      -3.797694      5.263814      5.510228       5.083110  112.4361 51.85182 173.1884 60.92068 -60.75223      79.99963 
1 1 1 -10 11 8  o 521.8239 22.19651 53.20388       4.498178      48.38653       6.584006      57.42064       6.159916  494.3270 34.51293 540.0560 29.48176 -45.72903      45.39071 
1 1 1 -10 11 9  o 736.2883 21.45592 105.8674       6.135119      111.9129       11.47768      103.4491       7.259191  750.9771 39.49368 726.9323 25.71380 24.04486       47.12696 
1 1 1 -10 11 10 o 164.6400 54.70800 5.226813       4.087143      0.6223904      5.779048      9.834568       5.781138  142.4750 60.35360 217.4539 64.09895 -74.97888      88.04108 
1 1 1 -10 11 11 o 377.2874 31.37996 28.14786       4.556116      25.01364       6.572797      31.04673       6.321206  350.6819 49.64975 393.6867 41.99287 -43.00482      65.02690 
1 1 1 -10 11 12 o 266.1386 45.80719 14.45406       4.563673      10.86361       6.710182      17.54417       6.225101  228.7778 69.44083 290.5776 57.20044 -61.79977      89.96621 
1 1 1 -10 11 13 o 589.1430 24.14899 67.84164       5.525196      62.33863       7.968135      72.93806       7.668113  561.1800 36.76492 608.4026 32.57224 -47.22266      49.11833 
1 1 1 -10 11 14 o 310.1041 43.48160 19.42343       5.092551      28.11570       7.387705      11.55354       7.029545  371.3012 52.71375 235.3684 70.99213 135.9328       88.42297 
1 1 1 -10 11 15 o 503.7967 28.68032 49.93115       5.588137      59.50229       8.337283      42.12402       7.529889  547.0769 39.50745 458.8626 42.74689 88.21426       58.20769 
1 1 1 -10 11 16 o 650.9020 24.68022 82.93279       6.238679      78.50509       8.897655      87.21462       8.749851  629.2762 36.56646 664.2681 34.03220 -34.99188      49.95295 
1 1 1 -10 11 17 o 707.3340 24.59921 98.04221       6.757308      99.14501       9.780450      97.03503       9.346843  706.8903 35.74302 700.6729 34.34960 6.217468       49.57276 
1 1 1 -10 11 18 o 298.1665 54.91574 18.64610       6.124623      16.63220       8.651639      20.66922       8.671444  274.2504 77.69339 306.6781 73.71944 -32.42770      107.1019 
1 1 1 -10 11 19 o 132.1719 59.15327 -1.902731      6.243157      -3.084031      8.552484      -0.5551652     9.134547  150.8160 68.21373 166.3617 73.14968 -15.54572      100.0199 
1 1 1 -10 11 20 o 483.9449 38.01194 47.11947       7.086558      40.48073       9.857275      54.22100       10.19507  437.4510 59.57213 511.8710 52.00871 -74.41998      79.08062 
1 1 1 -10 11 21 o 221.6608 72.54121 10.68551       7.196085      11.89936       9.950438      9.354563       10.41935  235.6514 84.97997 221.6382 85.50394 14.01323       120.5509 
1 1 1 -10 11 22 o 183.1331 74.28779 4.875574       8.239599      6.307803       9.510989      0.5670046      16.49628  198.1904 80.01700 211.2193 95.20787 -13.02896      124.3674 
1 1 1 -10 11 23 o 172.9523 69.39429 4.753164       7.105130      9.089056       9.738352      -0.1820164     10.38958  210.8976 82.29697 170.7885 76.38154 40.10919       112.2806 
1 1 1 -10 11 24 o 163.6668 69.88403 2.862182       7.856700      -9.094370      12.63816      10.39367       10.03047  155.8302 74.43411 213.5136 83.46544 -57.68333      111.8343 
1 1 1 -10 11 25 o 167.2495 75.48343 1.196093       10.40726      0.000000       0.000000      1.196093       10.40726  ?        ?        167.2495 75.48343 0.000000       75.48343 
1 1 1 -10 11 26 o 350.3162 66.70514 30.61113       8.743563      13.10523       16.30161      37.68127       10.35982  212.9847 95.43432 382.0128 72.48233 -169.0281      119.8390 
1 1 1 -10 11 27 o 195.3597 72.25151 10.79123       7.261203      7.748390       10.20896      13.90660       10.32989  178.5351 77.94448 207.4512 83.51885 -28.91614      114.2398 
1 1 1 -10 11 28 o 179.5246 69.54238 9.637226       6.914428      4.909595       9.692826      14.53573       9.866442  157.6163 71.81003 199.4494 81.14801 -41.83307      108.3590 
1 1 1 -10 11 29 o 156.1981 71.89803 7.074198       10.05424      1.894997       13.22986      14.15486       15.46895  147.5905 71.86503 172.4111 82.35283 -24.82054      109.3004 
1 1 1 -10 11 30 o 126.7099 60.18341 1.084985       8.026841      6.402398       9.653565      -10.82698      14.44872  145.7146 68.21185 125.3698 63.23849 20.34480       93.01593 
1 1 1 -10 12 1  o 691.8904 17.91930 93.27559       4.814889      94.90540       5.832677      89.78897       8.531011  697.3764 21.53638 676.1835 32.48687 21.19293       38.97708 
1 1 1 -10 12 2  o 570.6777 19.99057 63.51857       4.430413      66.09310       5.344803      57.86492       7.920394  581.6136 23.66297 540.3179 37.98744 41.29572       44.75468 
1 1 1 -10 12 3  o 359.3326 26.40339 25.40288       3.658744      20.96307       5.168703      29.86177       5.179806  322.7504 42.25154 388.0248 34.74141 -65.27441      54.70063 
1 1 1 -10 12 4  o 791.8441 23.58651 122.5325       7.253228      126.3531       10.10718      118.4756       10.41497  801.8166 32.45838 775.7954 34.56869 26.02118       47.41878 
1 1 1 -10 12 5  o 152.0070 53.54557 4.135227       3.928216      1.807941       4.760452      9.101616       6.954144  139.2537 56.47386 214.1617 71.37077 -74.90802      91.01144 
1 1 1 -10 12 6  o 415.0253 24.41407 33.79210       3.917650      28.67535       5.523232      38.97295       5.557716  379.3139 38.00571 444.1526 32.44528 -64.83875      49.97129 
1 1 1 -10 12 7  o 910.7437 16.46347 161.5653       5.822982      166.7965       8.330519      156.5674       8.142579  923.9462 23.21653 895.1170 23.42363 28.82922       32.97990 
1 1 1 -10 12 8  o 429.9838 30.36375 36.45317       5.037729      31.72919       9.091598      38.54625       6.051728  391.6381 61.82771 440.9817 35.64177 -49.34363      71.36527 
1 1 1 -10 12 9  o 467.7954 29.11660 43.06024       5.263393      35.76046       9.334257      46.46332       6.373247  417.2976 59.26289 484.8476 34.06379 -67.54996      68.35519 
1 1 1 -10 12 10 o 273.0813 41.31764 15.06538       4.244882      13.69354       6.183628      16.28800       5.837640  255.1688 62.82062 280.3510 55.58130 -25.18217      83.87914 
1 1 1 -10 12 11 o 114.2512 49.76022 -0.5972812     4.138575      -4.308786      6.149926      2.474651       5.595008  122.0849 56.20885 153.1580 61.53470 -31.07310      83.34240 
1 1 1 -10 12 12 o 402.5746 31.44246 31.99449       4.876754      29.26198       7.118745      34.41090       6.694346  380.2756 49.36805 414.9760 42.12296 -34.70038      64.89644 
1 1 1 -10 12 13 o 911.5340 18.98990 161.9872       6.722389      166.0168       9.820914      158.4347       9.221190  920.7983 27.46372 899.8134 26.38801 20.98499       38.08652 
1 1 1 -10 12 14 o 457.4892 30.41005 41.25495       5.372116      29.16323       7.882326      51.74330       7.341147  377.2464 55.45753 510.7854 37.26529 -133.5389      66.81496 
1 1 1 -10 12 15 f 315.8052 44.97768 20.22923       5.360386      22.03592       7.755355      18.57656       7.417395  323.5676 63.98459 295.8427 66.21213 27.72491       92.07646 
1 1 1 -10 12 16 o 490.1340 31.42267 47.49938       5.949658      58.65075       8.657207      37.51828       8.190363  541.4124 41.48957 429.2611 50.07170 112.1512       65.02737 
1 1 1 -10 12 17 o 906.3743 30.16818 161.9033       10.61903      0.000000       0.000000      161.9033       10.61903  ?        ?        906.3743 30.16818 0.000000       30.16818 
1 1 1 -10 12 18 o 657.1112 26.69989 84.93992       6.813595      93.33459       9.704331      76.77800       9.568853  684.0183 36.66519 618.6071 40.04546 65.41119       54.29526 
1 1 1 -10 12 19 o 825.0066 35.19098 135.4477       11.27501      135.4477       11.27501      0.000000       0.000000  825.0066 35.19098 ?        ?        0.000000       35.19098 
1 1 1 -10 12 20 o 789.8144 26.02081 122.9285       7.981302      123.5152       11.10033      122.3005       11.48398  786.2380 36.35414 781.4433 37.84136 4.794678       52.47468 
1 1 1 -10 12 21 o 678.5978 35.93990 92.52138       9.437717      89.52858       11.00481      100.8425       18.34993  662.7523 42.98864 677.3295 70.80665 -14.57721      82.83481 
1 1 1 -10 12 22 o 269.8183 78.73787 17.29180       8.762307      19.96107       10.14890      9.476217       17.36616  285.9822 85.08639 239.2010 103.0522 46.78113       133.6393 
1 1 1 -10 12 23 o 484.9349 40.31559 48.61735       7.523667      50.97581       10.53662      46.16393       10.74663  482.2607 57.38558 453.9990 62.61877 28.26169       84.93653 
1 1 1 -10 12 24 o 243.7451 94.44482 16.47822       12.75569      16.47822       12.75569      0.000000       0.000000  243.7451 94.44482 ?        ?        0.000000       94.44482 
1 1 1 -10 12 25 o 348.5778 83.55882 33.26594       11.16444      0.000000       0.000000      33.26594       11.16444  ?        ?        348.5778 83.55882 0.000000       83.55882 
1 1 1 -10 12 26 o 151.5590 65.63859 3.220608       7.120413      1.695908       10.37138      4.580009       9.793056  160.7373 73.63003 169.0101 74.95848 -8.272736      105.0721 
1 1 1 -10 12 27 f 147.6871 63.53296 3.915963       6.581058      5.324656       9.921227      2.809097       8.794372  164.6852 74.07065 151.6990 68.83803 12.98613       101.1194 
1 1 1 -10 12 28 o 202.3281 73.65240 13.79453       7.499990      24.00976       13.53066      9.263971       9.010949  217.0895 92.17687 170.6244 73.86783 46.46513       118.1230 
1 1 1 -10 12 29 o 191.1684 75.22153 14.55867       8.192494      15.75141       9.954576      12.05517       14.42191  186.5362 79.12548 164.3288 78.76672 22.20740       111.6469 
1 1 1 -10 13 1  o 1090.964 16.03270 231.6785       6.792742      224.1579       7.912891      252.7446       13.24343  1072.580 18.99667 1135.999 30.01888 -63.41931      35.52473 
1 1 1 -10 13 2  o 302.1962 33.71591 18.14588       3.889417      15.98641       4.670996      23.02844       7.023610  281.0199 44.26459 335.1515 55.93374 -54.13159      71.32977 
1 1 1 -10 13 3  o 664.0829 18.79578 85.93906       4.847420      78.32052       5.654398      107.0626       9.415293  633.4060 22.98668 738.5288 32.82755 -105.1228      40.07537 
1 1 1 -10 13 4  o 763.8627 19.95752 113.7628       5.920385      114.0189       7.164213      113.2113       10.51376  764.0010 24.14608 758.6230 35.68650 5.378052       43.08781 
1 1 1 -10 13 5  o 814.7726 24.21657 129.6896       7.662615      128.2449       10.79551      131.1564       10.87811  807.7356 34.41485 816.8890 34.28960 -9.153442      48.58147 
1 1 1 -10 13 6  o 323.9462 36.09629 20.89973       4.463907      26.52858       7.461780      17.76245       5.570693  360.2015 55.09319 294.7126 50.48867 65.48883       74.72861 
1 1 1 -10 13 7  o 398.9175 27.06570 31.27686       4.168243      30.48716       5.985603      32.02038       5.807981  391.0547 39.97528 401.4233 37.69744 -10.36859      54.94653 
1 1 1 -10 13 8  o 463.6025 28.41411 42.23756       5.091053      41.93232       8.825679      42.38978       6.232517  456.0838 50.68552 463.0445 34.91560 -6.960693      61.54771 
1 1 1 -10 13 9  o 758.1420 22.18710 112.1764       6.532495      118.8383       12.10288      109.4378       7.759899  774.8196 40.36129 747.9800 26.71395 26.83966       48.40112 
1 1 1 -10 13 10 o 479.1621 26.02515 45.02182       4.824716      41.71290       6.974958      48.05760       6.680893  458.1908 39.58710 493.1771 35.11148 -34.98627      52.91460 
1 1 1 -10 13 11 o 294.0255 41.06234 17.39202       4.560796      8.463481       6.568811      25.70228       6.337297  207.8865 69.36932 356.9311 46.85006 -149.0446      83.70801 
1 1 1 -10 13 12 o 580.0443 24.11138 65.73936       5.431391      66.46220       8.045807      65.13417       7.361961  579.9749 35.89819 574.8693 33.11599 5.105652       48.84003 
1 1 1 -10 13 13 o 843.7479 20.14699 138.8758       6.601624      149.7106       9.751388      129.7084       8.969730  873.9675 28.73050 813.5810 28.38903 60.38654       40.39033 
1 1 1 -10 13 14 o 1081.104 18.69760 227.9391       7.850213      231.9681       11.60416      224.5393       10.65964  1087.892 27.46628 1070.974 25.62922 16.91760       37.56665 
1 1 1 -10 13 15 o 587.2382 26.78376 67.63547       6.108207      68.02722       9.152267      67.32082       8.202229  583.8610 40.61660 582.3316 36.45244 1.529419       54.57553 
1 1 1 -10 13 16 o 910.5341 21.25198 162.1363       7.514905      162.5904       10.64743      161.6854       10.60805  908.5417 30.17670 906.0215 30.14872 2.520203       42.65652 
1 1 1 -10 13 17 o 255.5973 59.72412 13.96520       5.821588      14.86008       8.347226      13.11769       8.123279  259.9731 77.12361 245.9184 76.72138 14.05469       108.7852 
1 1 1 -10 13 18 o 271.5579 61.25489 15.87620       6.306149      11.53565       9.043884      19.98365       8.797693  234.3094 81.32507 299.2752 75.65532 -64.96585      111.0743 
1 1 1 -10 13 19 o 524.6108 35.04894 55.03508       7.099594      57.35896       10.24242      52.88597       9.849767  527.5443 50.61512 506.3078 50.77796 21.23648       71.69583 
1 1 1 -10 13 20 o 142.9895 62.95183 -0.6372731     6.783815      15.42746       9.543872      -17.04237      9.644445  259.3966 83.43944 121.1530 59.48707 138.2436       102.4737 
1 1 1 -10 13 21 o 340.4115 66.49957 25.80444       8.475967      22.72644       9.825774      34.75566       16.75614  309.9100 80.80658 358.3571 109.9252 -48.44717      136.4304 
1 1 1 -10 13 22 o 240.2513 71.44871 13.51605       7.157459      6.115743       9.952310      21.44408       10.30105  195.3179 80.70610 292.6871 85.36063 -97.36917      117.4730 
1 1 1 -10 13 23 o 616.3285 48.81464 81.23506       11.58838      0.000000       0.000000      81.23506       11.58838  ?        ?        616.3285 48.81464 0.000000       48.81464 
1 1 1 -10 13 24 o 442.8660 64.87351 46.34503       10.82670      0.000000       0.000000      46.34503       10.82670  ?        ?        442.8660 64.87351 0.000000       64.87351 
1 1 1 -10 13 25 o 266.9525 86.86290 21.53187       10.32350      0.000000       0.000000      21.53187       10.32350  ?        ?        266.9525 86.86290 0.000000       86.86290 
1 1 1 -10 13 26 o 204.8219 74.60536 12.16348       7.697003      30.94895       13.11711      2.298409       9.505545  287.5321 98.01673 156.1330 71.12597 131.3991       121.1040 
1 1 1 -10 13 27 o 188.2287 68.94160 10.52875       6.585752      11.86699       10.01833      9.510365       8.739428  187.4451 79.43726 177.4158 74.63486 10.02930       108.9984 
1 1 1 -10 13 28 o 101.4846 49.37254 -5.619591      6.207230      -2.649928      9.906517      -7.539092      7.964556  130.6201 63.27196 109.6511 53.88389 20.96900       83.10725 
1 1 1 -10 13 29 o 116.6608 56.62383 -3.104167      8.038792      -0.9154869     9.804781      -7.592592      14.04086  128.7780 62.51200 129.6801 64.99560 -0.9021606     90.17859 
1 1 1 -10 14 1  o 314.3969 39.77310 19.74969       4.747570      19.74969       4.747570      0.000000       0.000000  314.3969 39.77310 ?        ?        0.000000       39.77310 
1 1 1 -10 14 2  o 217.6372 55.99317 9.804963       4.759821      9.804963       4.759821      0.000000       0.000000  217.6372 55.99317 ?        ?        0.000000       55.99317 
1 1 1 -10 14 3  o 576.1948 21.00204 64.72485       4.699576      68.99976       5.677376      55.41967       8.376188  594.4792 24.59138 528.6721 41.12090 65.80719       47.91309 
1 1 1 -10 14 4  o 798.3878 21.35497 124.2945       6.621262      124.2945       6.621262      0.000000       0.000000  798.3878 21.35497 ?        ?        0.000000       21.35497 
1 1 1 -10 14 5  o 729.6588 18.01242 103.6949       5.104107      105.0178       7.104302      102.2835       7.337962  733.2777 24.94738 723.4670 26.11732 9.810669       36.11768 
1 1 1 -10 14 6  o 1181.234 16.19676 271.6098       7.430055      268.0287       10.27127      275.5406       10.76122  1172.057 22.56562 1188.174 23.32133 -16.11707      32.45137 
1 1 1 -10 14 7  o 463.8607 28.90802 42.27197       5.181659      52.86554       9.108022      37.20244       6.300665  514.6772 46.05492 433.1849 37.83246 81.49234       59.60160 
1 1 1 -10 14 8  o 121.5080 53.07458 -0.8064230     4.738854      4.577383       8.561520      -3.184390      5.689959  192.7407 76.56020 121.4777 55.21903 71.26306       94.39600 
1 1 1 -10 14 9  o 549.1223 23.10009 58.85555       4.926185      58.94583       6.960527      58.76494       6.972845  547.1326 32.91143 546.2627 33.02379 0.8698730      46.62331 
1 1 1 -10 14 10 o 329.8033 36.42986 21.65096       4.588064      31.45308       6.622430      12.60353       6.362384  396.4159 43.74548 245.2275 65.54803 151.1885       78.80489 
1 1 1 -10 14 11 o 545.0858 25.14574 58.07623       5.323010      62.06680       7.775257      54.55600       7.302692  560.4863 35.90973 525.3108 36.01377 35.17554       50.85765 
1 1 1 -10 14 12 o 106.1909 48.55224 -2.840562      4.480711      -3.966049      6.876178      -2.009976      5.907031  132.2044 60.32939 129.5672 57.79516 2.637192       83.54589 
1 1 1 -10 14 13 o 179.4775 60.03180 6.245258       4.919481      4.138155       7.462675      7.864636       6.542231  180.2956 71.52209 201.8142 69.21848 -21.51854      99.53194 
1 1 1 -10 14 14 o 795.6974 21.58805 123.7310       6.670976      119.2221       9.702199      127.7739       9.187220  778.0568 32.10930 806.4139 29.33581 -28.35718      43.49249 
1 1 1 -10 14 15 o 408.4036 37.05859 33.32417       5.813688      31.48049       8.657907      34.83812       7.845579  388.5881 59.24567 413.0865 49.91772 -24.49838      77.47147 
1 1 1 -10 14 16 o 370.8969 41.37833 27.79588       5.858519      16.56135       8.671633      37.22938       7.946209  273.8508 77.85394 426.8825 48.80917 -153.0317      91.88891 
1 1 1 -10 14 17 o 666.6716 26.90634 87.45875       6.966177      87.51092       9.946049      87.40852       9.759914  661.0714 38.91292 661.0569 38.17964 0.1446533E-01  54.51514 
1 1 1 -10 14 18 o 326.9948 52.20058 22.34101       6.406010      14.45643       9.124622      30.00435       8.995687  254.9989 81.54015 373.8793 64.27153 -118.8804      103.8250 
1 1 1 -10 14 19 o 492.9456 36.99062 48.86880       7.029756      52.41262       10.31124      45.79122       9.609019  501.3064 53.80535 468.2694 53.81734 33.03699       76.10074 
1 1 1 -10 14 20 o 150.3631 67.37448 -1.655410      8.124691      -2.852609      9.687224      1.184081       14.91888  159.0495 72.20216 206.5056 92.00123 -47.45610      116.9503 
1 1 1 -10 14 21 o 574.6794 40.78971 67.69349       9.044274      71.52917       10.76253      58.47441       16.68541  585.1870 47.77466 486.3078 91.71136 98.87915       103.4089 
1 1 1 -10 14 22 o 229.3989 71.84806 12.53397       7.116257      22.63419       10.24955      3.133734       9.888002  297.3106 84.68234 178.4575 77.31905 118.8531       114.6705 
1 1 1 -10 14 23 f 391.7951 56.06889 34.42735       8.287907      55.02308       13.65918      22.42647       10.42659  470.5088 77.44843 286.8331 86.44827 183.6757       116.0671 
1 1 1 -10 14 24 o 258.3721 87.64275 19.70821       10.48694      0.000000       0.000000      19.70821       10.48694  ?        ?        258.3721 87.64275 0.000000       87.64275 
1 1 1 -10 14 25 o 145.0032 65.58615 0.8229284      7.906830      -5.484126      13.38270      4.205230       9.800238  155.1833 74.76632 167.4686 74.59127 -12.28523      105.6118 
1 1 1 -10 14 26 o 138.4902 61.32946 2.170528       6.531521      3.961907       9.365737      0.4743902      9.113365  158.2022 71.48447 144.9576 67.32950 13.24460       98.20026 
1 1 1 -10 14 27 f 170.5370 72.86396 9.036138       8.550864      0.000000       0.000000      9.036138       8.550864  ?        ?        170.5370 72.86396 0.000000       72.86396 
1 1 1 -10 14 28 o 99.05580 48.28978 -5.546449      6.024301      4.812982       9.318852      -12.98414      7.896119  146.2716 67.98784 97.66302 48.91808 48.60856       83.75754 
1 1 1 -10 15 1  o 708.0596 19.99081 97.65356       5.497030      105.0467       6.961958      85.41347       8.957978  733.8116 24.42974 659.1594 35.12048 74.65216       42.78154 
1 1 1 -10 15 2  o 208.5912 49.42696 8.951474       3.942616      9.533576       4.719886      7.607620       7.171469  214.9425 55.98626 204.9773 72.33307 9.965118       91.46876 
1 1 1 -10 15 3  o 821.2972 20.80902 131.4462       6.637125      131.4462       6.637125      0.000000       0.000000  821.2972 20.80902 ?        ?        0.000000       20.80902 
1 1 1 -10 15 4  o 350.9763 37.91018 24.48092       5.085205      24.48092       5.085205      0.000000       0.000000  350.9763 37.91018 ?        ?        0.000000       37.91018 
1 1 1 -10 15 5  o 458.1622 24.76786 41.09444       4.390556      40.30827       6.176076      41.89770       6.242831  451.8106 35.48428 460.7533 35.15402 -8.942657      49.94937 
1 1 1 -10 15 6  o 193.1001 51.32818 7.669561       3.915245      12.00420       5.456505      3.069394       5.621149  240.3339 58.91668 158.3737 62.31126 81.96016       85.75470 
1 1 1 -10 15 7  o 117.0510 51.57890 -1.156951      4.564020      9.268369       7.631385      -6.962227      5.694690  219.5555 74.76274 106.2686 50.53775 113.2869       90.24152 
1 1 1 -10 15 8  o 394.2048 35.60249 30.77320       5.391603      37.16589       9.793426      27.99303       6.458451  426.3014 60.88440 373.4861 45.46530 52.81528       75.98687 
1 1 1 -10 15 9  o 511.8449 29.00397 51.45176       5.741626      43.01815       10.13479      55.43790       6.967624  459.8770 58.03981 530.2668 34.01410 -70.38974      67.27242 
1 1 1 -10 15 10 o 172.9693 57.86533 5.723133       4.570819      3.331897       6.624418      7.896142       6.314911  168.8749 67.26100 201.9434 68.01279 -33.06845      95.65450 
1 1 1 -10 15 11 o 314.0567 42.03782 19.85539       4.998528      16.52012       7.136291      23.06774       7.003551  279.5123 66.67539 334.8375 55.82426 -55.32520      86.95951 
1 1 1 -10 15 12 o 557.8634 26.01841 60.93755       5.636851      54.42434       8.158922      66.88545       7.796821  522.6493 40.51364 581.5931 34.67762 -58.94379      53.32816 
1 1 1 -10 15 13 o 350.2675 39.48891 24.61914       5.277854      27.44446       7.876427      22.31674       7.110262  363.8884 57.65777 327.2711 58.07021 36.61734       81.83256 
1 1 1 -10 15 14 o 477.6353 30.82048 45.11424       5.686435      54.93566       8.435883      36.93519       7.698301  523.4583 41.84720 426.6387 47.25666 96.81952       63.12195 
1 1 1 -10 15 15 o 824.4614 22.20804 133.0691       7.110637      128.0013       10.27045      137.7346       9.854373  804.7343 32.86312 835.8493 30.35799 -31.11499      44.73916 
1 1 1 -10 15 16 o 282.3080 56.33935 16.84865       5.960365      24.33019       8.905479      10.77786       8.022030  334.0611 70.84107 227.1402 76.65575 106.9209       104.3770 
1 1 1 -10 15 17 o 354.4740 46.77338 25.80815       6.281635      27.97645       9.479854      24.11084       8.387290  357.7893 70.73229 333.3403 67.11180 24.44901       97.50410 
1 1 1 -10 15 18 o 164.1965 65.72037 3.571359       6.355696      8.731190       9.188839      -1.161412      8.800364  214.4263 80.88161 159.9826 71.00128 54.44371       107.6244 
1 1 1 -10 15 19 o 196.1335 69.58870 7.801062       6.646268      1.095703       9.589717      13.99893       9.219686  174.5219 75.87879 248.1131 82.15401 -73.59128      111.8341 
1 1 1 -10 15 20 o 621.6384 37.02763 78.27636       8.898546      83.76321       11.08495      68.33240       14.92285  636.8517 45.11146 551.1418 71.39853 85.70990       84.45587 
1 1 1 -10 15 21 o 260.3413 68.75990 15.88711       7.055285      21.52011       10.12085      10.56194       9.840416  291.9441 84.45786 217.8512 83.33247 74.09285       118.6484 
1 1 1 -10 15 22 o 112.5179 54.11578 -7.899474      6.938656      -14.93109      9.860152      -1.001491      9.766007  122.6194 60.19523 158.9806 72.29570 -36.36120      94.07515 
1 1 1 -10 15 23 o 253.9316 74.46765 16.73036       7.820521      2.036789       12.52866      26.11035       10.01019  179.1257 81.62210 311.6028 81.71331 -132.4771      115.4956 
1 1 1 -10 15 24 o 199.8432 81.30876 10.61232       9.905656      0.000000       0.000000      10.61232       9.905656  ?        ?        199.8432 81.30876 0.000000       81.30876 
1 1 1 -10 15 25 o 122.6727 57.20041 -2.143945      6.680469      -2.444097      9.440165      -1.842844      9.455073  140.0543 66.14834 141.8754 66.76109 -1.821152      93.98215 
1 1 1 -10 15 26 f 118.5430 55.53106 -1.776139      6.417097      -5.017511      9.084681      1.451660       9.065640  126.3305 61.04760 144.4881 67.12524 -18.15758      90.73371 
1 1 1 -10 15 27 o 124.3861 57.34471 0.6885864      6.430608      0.3438358      9.349478      0.9981039      8.858850  136.1959 64.76576 136.3265 64.29327 -0.1306763     91.25912 
1 1 1 -10 15 28 o 151.2001 66.74899 7.138851       7.677999      -1.374123      9.231095      26.24877       13.83063  126.6236 61.27317 201.1899 89.16286 -74.56627      108.1870 
1 1 1 -10 16 1  f 933.4382 17.02866 169.5594       6.172969      169.9662       7.376743      168.6091       11.27512  934.1213 20.33450 928.4082 31.27190 5.713135       37.30179 
1 1 1 -10 16 2  f 375.1465 29.87691 27.68835       4.316676      30.77401       5.175811      20.63810       7.823607  394.8875 34.08426 315.2226 66.02413 79.66486       74.30291 
1 1 1 -10 16 3  o 478.3784 29.67636 44.91943       5.486075      44.91943       5.486075      0.000000       0.000000  478.3784 29.67636 ?        ?        0.000000       29.67636 
1 1 1 -10 16 4  o 352.8510 39.33216 24.77642       5.298014      24.77642       5.298014      0.000000       0.000000  352.8510 39.33216 ?        ?        0.000000       39.33216 
1 1 1 -10 16 5  o 552.9497 28.57416 59.94268       6.115058      59.94268       6.115058      0.000000       0.000000  552.9497 28.57416 ?        ?        0.000000       28.57416 
1 1 1 -10 16 6  o 250.7665 46.12363 12.81432       4.326288      18.92730       6.174774      6.919984       6.063339  303.9937 54.29545 192.8846 66.60934 111.1092       85.93486 
1 1 1 -10 16 7  o 293.9637 46.98167 17.52377       5.182919      19.15907       8.791100      16.65253       6.416715  300.5511 75.43491 283.0817 60.21894 17.46948       96.52328 
1 1 1 -10 16 8  o 121.6601 52.15238 -0.7478707E-01 4.406660      1.658261       6.403690      -1.633639      6.073339  156.1470 64.64688 133.8066 59.20300 22.34039       87.65965 
1 1 1 -10 16 9  o 106.9281 48.74990 -2.704430      4.476837      -5.816136      6.434632      0.2149488      6.232606  119.7121 55.92646 145.4944 62.18696 -25.78233      83.63604 
1 1 1 -10 16 10 o 552.1921 28.71569 59.92809       6.136721      57.42412       11.32577      60.96874       7.301416  531.7999 55.66404 555.6477 33.99961 -23.84784      65.22622 
1 1 1 -10 16 11 o 716.9752 25.88887 100.6622       7.208505      115.9397       14.09123      95.24702       8.389320  760.3668 47.96555 696.1492 31.03105 64.21765       57.12810 
1 1 1 -10 16 12 o 213.6092 58.38902 9.581513       4.982196      15.89210       7.465219      4.513340       6.690114  271.9377 70.20586 176.2048 68.36349 95.73293       97.99198 
1 1 1 -10 16 13 o 181.9670 62.22651 6.407271       5.286910      -2.069754      8.038445      12.86967       7.018545  151.5655 67.52789 244.9727 70.17715 -93.40717      97.39018 
1 1 1 -10 16 14 o 454.4853 45.85622 41.85506       7.983034      0.000000       0.000000      41.85506       7.983034  ?        ?        454.4853 45.85622 0.000000       45.85622 
1 1 1 -10 16 15 o 301.0637 52.02956 18.87987       5.863226      15.58229       8.874663      21.43409       7.810593  265.6158 79.68857 315.5415 65.86601 -49.92563      103.3857 
1 1 1 -10 16 16 o 98.21974 47.94835 -10.43208      5.997751      -22.52682      8.866050      -0.2269253     8.144070  104.9133 52.44324 159.3902 69.60079 -54.47690      87.14679 
1 1 1 -10 16 17 o 395.6173 43.55474 31.92718       6.580884      31.26450       9.843853      32.46269       8.848990  378.1670 69.59190 390.8077 60.24030 -12.64066      92.04307 
1 1 1 -10 16 18 f 462.3849 37.47147 43.15161       6.670851      43.68385       9.679566      42.67015       9.206236  455.0337 55.95424 451.1087 53.59893 3.924927       77.48370 
1 1 1 -10 16 19 o 358.5692 58.29456 27.83634       7.838779      33.40292       9.622884      16.85692       13.51452  387.9619 66.24709 264.4588 98.41802 123.5031       118.6372 
1 1 1 -10 16 20 o 610.3346 37.37844 75.97335       8.816977      73.89537       10.77330      80.18837       15.34361  593.6605 47.11584 596.5495 67.41250 -2.888977      82.24565 
1 1 1 -10 16 21 o 141.9940 62.63300 0.2192040      6.746566      0.8338331      10.09012      -0.2777474     9.072911  168.7975 75.39758 157.8602 70.93289 10.93732       103.5194 
1 1 1 -10 16 22 o 153.1269 66.82677 1.825477       7.498044      10.99636       11.62365      -4.710241      9.812587  213.0291 87.53423 145.0305 68.17154 67.99861       110.9486 
1 1 1 -10 16 23 o 157.8017 71.79106 0.7107472      9.643565      0.000000       0.000000      0.7107472      9.643565  ?        ?        157.8017 71.79106 0.000000       71.79106 
1 1 1 -10 16 24 o 234.3013 76.53796 15.96035       8.012239      12.20443       13.95992      17.80537       9.784229  201.5587 89.44019 236.7351 84.38622 -35.17642      122.9658 
1 1 1 -10 16 25 o 216.2158 68.67473 13.46474       6.480752      7.716269       9.191051      19.14891       9.139503  171.9634 74.52486 238.6090 81.81413 -66.64557      110.6685 
1 1 1 -10 16 26 o 222.8571 68.68148 15.20943       6.532510      17.80502       9.176586      12.54276       9.301408  216.6160 81.00298 185.8221 77.50260 30.79396       112.1077 
1 1 1 -10 16 27 o 199.3290 72.76376 14.38751       7.327458      12.81354       8.816068      17.90414       13.17767  179.9335 75.28452 183.8810 83.75818 -3.947556      112.6197 
1 1 1 -10 17 1  o 395.9210 34.48334 30.95146       5.249134      31.30942       7.107580      30.52196       7.785435  395.4049 47.22033 388.8346 52.93293 6.570282       70.93416 
1 1 1 -10 17 2  o 151.8566 54.24389 3.959839       4.044841      4.958025       4.947330      1.947471       7.024559  168.5722 60.01471 164.6099 67.89114 3.962357       90.61441 
1 1 1 -10 17 3  o 535.2486 28.49590 56.16739       5.901997      56.16739       5.901997      0.000000       0.000000  535.2486 28.49590 ?        ?        0.000000       28.49590 
1 1 1 -10 17 4  o 673.6135 20.71957 88.44158       5.420251      92.72951       6.457095      78.21210       9.973331  689.2891 24.12169 628.7256 41.07183 60.56354       47.63142 
1 1 1 -10 17 5  o 539.4235 24.72573 56.81934       5.179729      58.87661       6.166603      51.89000       9.545404  547.7594 29.09297 509.1894 48.87145 38.57004       56.87548 
1 1 1 -10 17 6  o 120.1985 54.63744 -3.120185      5.570681      -3.120185      5.570681      0.000000       0.000000  120.1985 54.63744 ?        ?        0.000000       54.63744 
1 1 1 -10 17 7  o 144.2517 61.45447 0.3377249      6.050725      9.453321       8.758367      -7.985281      8.368944  225.0383 79.88000 134.5153 63.14172 90.52303       101.8219 
1 1 1 -10 17 8  o 470.4521 27.08359 43.46709       4.927327      42.24050       6.921096      44.72772       7.016468  460.9508 39.02925 474.5876 38.39828 -13.63681      54.75135 
1 1 1 -10 17 9  o 239.3983 52.72371 11.91890       4.769276      8.134993       6.798206      15.58613       6.692583  205.3459 70.55218 271.5169 64.43741 -66.17102      95.54993 
1 1 1 -10 17 10 f 864.0685 19.30687 145.6750       6.478703      142.6948       9.198986      148.6080       9.125989  852.9983 27.76923 870.7317 26.98781 -17.73340      38.72301 
1 1 1 -10 17 11 o 545.1937 26.65884 58.28905       5.644430      52.19450       8.185272      63.81480       7.793957  510.7450 41.62897 567.2325 35.56071 -56.48758      54.74975 
1 1 1 -10 17 12 o 162.6101 64.85198 3.245054       6.165918      -20.75766      12.39815      11.13255       7.107164  140.5518 68.68364 229.8870 71.76973 -89.33528      99.33950 
1 1 1 -10 17 13 o 124.4776 55.58331 -1.769297      5.478987      -4.121441      8.118428      0.1981176      7.424855  143.6588 65.55502 155.8540 67.26309 -12.19522      93.92436 
1 1 1 -10 17 14 o 148.0235 61.08965 1.849829       5.692254      10.75912       8.356716      -5.862003      7.774867  228.3585 78.23273 133.3686 62.02713 94.98996       99.83850 
1 1 1 -10 17 15 o 260.6590 61.27365 14.61804       6.098001      14.93925       8.917015      14.33586       8.357867  259.7450 80.27548 255.0105 77.52023 4.734497       111.5954 
1 1 1 -10 17 16 o 284.6790 80.89794 18.45102       9.365046      18.45102       9.365046      0.000000       0.000000  284.6790 80.89794 ?        ?        0.000000       80.89794 
1 1 1 -10 17 17 o 373.2082 47.37100 28.84434       6.711188      27.59079       9.693981      29.99815       9.300358  350.4151 73.57718 369.7649 67.24292 -19.34973      99.67553 
1 1 1 -10 17 18 o 609.1021 30.16861 73.85111       7.136305      84.43089       10.25369      63.91232       9.938223  643.3203 41.25919 555.7863 46.47038 87.53406       62.14352 
1 1 1 -10 17 19 o 381.1309 92.15465 37.01167       13.49016      0.000000       0.000000      37.01167       13.49016  ?        ?        381.1309 92.15465 0.000000       92.15465 
1 1 1 -10 17 20 o 459.6875 45.16550 44.59130       7.958905      58.25379       12.69831      35.75155       10.21413  504.1002 66.48586 390.6968 69.88378 113.4034       96.45783 
1 1 1 -10 17 21 o 172.3652 68.75671 5.662719       6.932086      12.91905       10.01255      -1.017588      9.606924  223.8618 84.43184 156.2817 71.31391 67.58014       110.5188 
1 1 1 -10 17 22 o 256.4381 71.45275 16.96247       7.381028      3.901410       11.61073      25.82050       9.561782  179.3949 80.45123 310.1132 79.13347 -130.7183      112.8473 
1 1 1 -10 17 23 o 134.6220 64.22099 -5.239450      9.344925      0.000000       0.000000      -5.239450      9.344925  ?        ?        134.6220 64.22099 0.000000       64.22099 
1 1 1 -10 17 24 o 380.9583 46.68679 33.27031       6.762600      32.12050       9.341767      34.53630       9.802374  339.2710 73.06097 350.2546 74.36278 -10.98361      104.2484 
1 1 1 -10 17 25 o 170.1978 69.56745 8.417391       7.293624      5.915064       8.658097      14.53326       13.53567  158.5580 70.39436 189.1532 85.66072 -30.59517      110.8744 
1 1 1 -10 17 26 o 175.8784 66.25755 9.776183       6.161902      6.706207       9.017244      12.46560       8.439872  155.6331 70.24937 183.3736 74.88021 -27.74054      102.6743 
1 1 1 -10 18 1  o 1063.344 17.01971 220.1301       7.028358      225.5826       8.539013      208.6768       12.37574  1075.813 20.43821 1032.235 30.87199 43.57800       37.02432 
1 1 1 -10 18 2  o 666.2393 24.57584 86.67336       6.358674      86.67336       6.358674      0.000000       0.000000  666.2393 24.57584 ?        ?        0.000000       24.57584 
1 1 1 -10 18 3  o 471.8824 31.76847 43.84851       5.787924      43.84851       5.787924      0.000000       0.000000  471.8824 31.76847 ?        ?        0.000000       31.76847 
1 1 1 -10 18 4  o 680.6743 21.11848 90.36729       5.582515      89.49286       6.646492      92.46172       10.28634  676.7205 25.29037 683.8366 38.89365 -7.116089      46.39309 
1 1 1 -10 18 5  o 754.4695 20.45307 111.0158       5.992779      110.5132       7.078934      112.2874       11.25859  752.0949 24.23635 753.6281 38.59746 -1.533142      45.57592 
1 1 1 -10 18 6  o 963.1547 35.87437 182.6983       13.41864      0.000000       0.000000      182.6983       13.41864  ?        ?        963.1547 35.87437 0.000000       35.87437 
1 1 1 -10 18 7  o 140.6805 58.45115 1.225410       5.261835      2.998625       9.330235      0.3984293      6.371762  188.6187 78.05713 147.7147 63.00000 40.90395       100.3091 
1 1 1 -10 18 8  o 523.4938 29.76829 53.96891       6.026920      57.02929       7.400351      47.94093       10.38605  536.5568 35.71885 484.5700 56.23633 51.98685       66.62103 
1 1 1 -10 18 9  o 565.5795 25.35641 62.64342       5.569414      73.14487       8.064801      53.06927       7.700503  608.1031 34.28973 516.3192 38.68486 91.78387       51.69434 
1 1 1 -10 18 10 o 486.0196 29.53214 46.59674       5.547709      47.68368       7.924363      45.55194       7.769228  487.7464 42.25266 476.5845 42.42037 11.16187       59.87299 
1 1 1 -10 18 11 o 353.6531 39.80565 25.15134       5.371978      29.20380       7.662385      21.23406       7.533503  376.3746 53.96662 316.3953 63.51817 59.97928       83.34839 
1 1 1 -10 18 12 o 432.3405 33.94896 37.17417       5.654237      50.86587       8.331114      25.48177       7.698855  502.7684 43.08469 348.7224 58.94958 154.0460       73.01604 
1 1 1 -10 18 13 o 402.1616 37.52517 32.41577       5.793022      28.75748       8.413900      35.71294       7.987835  369.4447 60.75607 417.3441 50.29744 -47.89944      78.87415 
1 1 1 -10 18 14 o 180.1305 69.93090 5.043167       7.003846      -5.661520      14.53134      8.282445       7.993606  189.6584 86.97968 208.2254 76.00115 -18.56694      115.5060 
1 1 1 -10 18 15 o 806.7681 34.38696 129.4714       10.77384      129.4714       10.77384      0.000000       0.000000  806.7681 34.38696 ?        ?        0.000000       34.38696 
1 1 1 -10 18 16 o 430.2333 39.22156 37.51648       6.481241      42.83340       9.666796      33.17465       8.735512  450.3133 56.52169 394.3122 58.84670 56.00113       81.59433 
1 1 1 -10 18 17 o 389.5358 44.01356 31.35696       6.541490      40.86848       10.14006      24.57684       8.561190  433.4550 62.00440 330.2870 68.97044 103.1680       92.74409 
1 1 1 -10 18 18 o 1914.646 39.76044 748.2702       29.56431      748.2702       29.56431      0.000000       0.000000  1914.646 39.76044 ?        ?        0.000000       39.76044 
1 1 1 -10 18 19 f 124.2665 59.83697 -9.611779      8.543158      -8.099236      11.51650      -11.46265      12.73957  151.7721 72.08752 152.2828 73.26243 -0.5106354     102.7813 
1 1 1 -10 18 20 o 119.4354 56.08559 -4.572458      6.614188      -20.76057      9.584163      10.14814       9.139425  109.6454 54.76615 207.5081 80.07253 -97.86273      97.01000 
1 1 1 -10 18 21 o 450.1159 45.57503 43.93402       7.856908      44.01829       12.77084      43.88270       9.966222  404.4429 84.05210 433.1096 60.93747 -28.66672      103.8178 
1 1 1 -10 18 22 o 159.6006 71.67931 2.335679       9.252681      0.000000       0.000000      2.335679       9.252681  ?        ?        159.6006 71.67931 0.000000       71.67931 
1 1 1 -10 18 23 o 139.1113 65.61652 -2.313601      9.233602      0.000000       0.000000      -2.313601      9.233602  ?        ?        139.1113 65.61652 0.000000       65.61652 
1 1 1 -10 18 24 o 131.6411 60.61724 0.3079496      7.155869      5.079446       8.442593      -11.86546      13.48511  156.5303 69.50255 135.0838 67.05822 21.44643       96.57851 
1 1 1 -10 18 25 o 240.5087 65.02738 16.85800       6.219323      15.92118       8.711999      17.83160       8.881348  205.9035 78.49296 216.8978 79.96674 -10.99432      112.0528 
1 1 1 -10 19 1  o 628.4419 21.44938 77.04599       5.234893      82.70813       6.437051      65.98761       8.995854  650.5039 25.48057 576.8494 40.41135 73.65448       47.77381 
1 1 1 -10 19 2  o 474.4403 32.48700 44.38888       5.949726      44.38888       5.949726      0.000000       0.000000  474.4403 32.48700 ?        ?        0.000000       32.48700 
1 1 1 -10 19 3  o 916.5841 18.95034 163.7652       6.745549      159.6683       7.863298      175.1815       13.12629  904.3560 22.38914 943.3196 35.83068 -38.96362      42.25057 
1 1 1 -10 19 4  o 365.9982 35.75887 26.62305       5.017723      33.29519       5.989115      10.91143       9.190537  409.0789 38.13849 236.3838 81.98537 172.6952       90.42204 
1 1 1 -10 19 5  o 654.8483 23.13502 83.78937       5.883538      82.60279       6.927568      86.86034       11.14473  649.3679 27.47021 660.1367 43.71929 -10.76880      51.63321 
1 1 1 -10 19 6  o 345.4297 48.26946 24.24634       6.298407      32.04950       8.389409      14.16726       9.534682  395.2078 56.24830 259.7351 83.38362 135.4726       100.5818 
1 1 1 -10 19 7  o 245.2760 55.60339 12.59361       5.174254      9.504121       6.057502      20.93140       9.951216  214.4774 66.14365 309.6761 81.59966 -95.19873      105.0404 
1 1 1 -10 19 8  o 355.9219 36.94697 25.30473       5.032537      24.68065       7.061972      25.94867       7.173502  346.0152 54.34464 355.2100 53.67575 -9.194824      76.38342 
1 1 1 -10 19 9  f 1243.082 18.21470 301.4662       8.793258      310.8244       12.41692      292.0515       12.45425  1259.449 25.38664 1220.428 26.27710 39.02087       36.53720 
1 1 1 -10 19 10 o 218.6486 65.59753 10.05571       6.013610      12.84408       7.531352      5.150644       9.988963  244.9423 73.39305 202.4722 81.91269 42.47012       109.9829 
1 1 1 -10 19 11 f 786.0109 22.07031 120.8984       6.736976      123.7564       9.423816      117.9111       9.634731  792.4222 30.62261 772.9196 32.09795 19.50262       44.36240 
1 1 1 -10 19 12 o 298.4388 50.72931 18.49261       5.669090      16.59785       8.150678      20.26823       7.890269  274.6211 74.52312 305.8452 68.17071 -31.22412      100.9997 
1 1 1 -10 19 13 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -10 19 14 o 215.0428 65.19903 9.968240       5.917848      2.879638       8.450950      16.78872       8.289585  176.3425 73.73930 273.1393 75.58678 -96.79680      105.5976 
1 1 1 -10 19 15 o 723.6884 40.77799 106.0795       11.41385      106.0795       11.41385      0.000000       0.000000  723.6884 40.77799 ?        ?        0.000000       40.77799 
1 1 1 -10 19 16 o 530.7108 41.15052 57.57596       8.414968      48.92776       17.57834      60.14703       9.584552  432.4757 105.5820 539.0145 46.23465 -106.5387      115.2615 
1 1 1 -10 19 17 o 484.1331 39.15059 48.04607       7.297900      41.15272       12.17747      51.90937       9.116358  417.3648 77.99791 497.0676 47.81561 -79.70276      91.48774 
1 1 1 -10 19 18 o 327.4462 64.36152 24.59009       7.892723      14.28012       9.963583      41.95884       12.93216  239.0201 85.16089 409.6896 84.09837 -170.6695      119.6867 
1 1 1 -10 19 19 o 362.3900 50.88326 28.75477       6.963752      43.54905       10.18201      15.75299       9.545266  436.0744 61.85749 244.4366 83.61187 191.6379       104.0062 
1 1 1 -10 19 20 o 240.3473 74.12630 15.02121       7.607720      6.304136       12.31173      20.40557       9.676110  192.2571 84.71684 270.8322 83.60946 -78.57512      119.0272 
1 1 1 -10 19 21 o 134.1578 61.73516 -1.468662      7.405542      -20.81151      12.30660      9.511537       9.272205  125.2640 62.48734 193.7413 78.72802 -68.47732      100.5125 
1 1 1 -10 19 22 o 186.7349 84.78421 8.486311       13.36467      0.000000       0.000000      8.486311       13.36467  ?        ?        186.7349 84.78421 0.000000       84.78421 
1 1 1 -10 19 23 o 161.9810 65.87670 6.603164       6.498964      3.675278       8.980505      9.822491       9.416862  153.8816 69.72285 180.7633 76.82932 -26.88171      103.7498 
1 1 1 -10 19 24 o 108.3736 51.77023 -3.561906      6.116302      -5.409919      8.789500      -1.826920      8.516473  121.4925 59.02413 129.2286 61.55405 -7.736183      85.28041 
1 1 1 -10 19 25 o 198.3712 65.91821 12.35836       5.933732      18.98027       8.454114      5.928866       8.330381  223.9032 78.57681 151.0582 67.91370 72.84506       103.8585 
1 1 1 -10 20 1  f 256.2059 49.46281 13.50001       4.743251      20.83403       5.803386      -1.257718      8.232278  320.2275 48.15609 158.6178 69.60090 161.6097       84.63625 
1 1 1 -10 20 2  o 355.0938 45.43280 25.43065       6.121627      25.43065       6.121627      0.000000       0.000000  355.0938 45.43280 ?        ?        0.000000       45.43280 
1 1 1 -10 20 3  o 333.6206 39.27227 22.28628       4.990797      20.06257       6.004897      27.25352       8.974776  313.0001 51.16920 360.5053 66.55569 -47.50522      83.95205 
1 1 1 -10 20 4  o 445.3257 30.73644 39.12608       5.283145      36.67115       6.256139      45.22896       9.864032  429.2763 37.91657 471.2864 54.92438 -42.01016      66.74094 
1 1 1 -10 20 5  o 224.9628 66.40286 10.58492       6.200455      15.73090       8.380695      4.361636       9.216277  270.6978 76.39044 194.5644 78.69225 76.13338       109.6721 
1 1 1 -10 20 6  o 173.9361 67.34286 4.378386       6.481365      -9.727899      8.825498      20.89333       9.549297  133.2710 63.24347 309.8521 79.08989 -176.5811      101.2667 
1 1 1 -10 20 7  o 518.5751 29.34027 52.99556       5.884631      51.87169       6.951825      55.83654       11.05283  511.3777 35.21966 522.8831 55.26795 -11.50543      65.53603 
1 1 1 -10 20 8  o 248.8303 57.06959 13.04796       5.397475      10.60438       6.416273      18.96264       9.982412  224.5270 67.84776 293.3876 83.57379 -68.86063      107.6471 
1 1 1 -10 20 9  o 306.2659 45.91307 19.17162       5.292589      18.84449       7.492897      19.49735       7.476830  296.3672 66.71081 301.9406 65.63564 -5.573425      93.58616 
1 1 1 -10 20 10 o 753.7122 22.82241 111.2542       6.680287      120.6440       9.737104      102.9044       9.182017  781.6407 32.07707 721.6306 32.76387 60.01007       45.85204 
1 1 1 -10 20 11 o 551.1113 41.57489 61.10507       8.832616      61.10507       8.832616      0.000000       0.000000  551.1113 41.57489 ?        ?        0.000000       41.57489 
1 1 1 -10 20 12 o 546.8198 35.04856 59.69354       7.403718      64.07065       9.214370      51.71964       12.43677  563.0631 42.45086 491.5644 66.88425 71.49872       79.21855 
1 1 1 -10 20 13 o 403.9542 40.48182 33.12346       6.265213      31.64042       9.098440      34.46081       8.640022  383.2430 63.34446 404.1173 56.60601 -20.87430      84.95152 
1 1 1 -10 20 14 o 155.7412 62.69064 3.152071       5.819114      4.960985       8.615908      1.634833       7.890763  186.7028 75.88184 163.7511 69.98062 22.95166       103.2247 
1 1 1 -10 20 15 o 649.7211 31.08296 84.26199       7.842911      79.98480       12.74158      86.87112       9.951566  614.6934 53.91963 653.3112 39.40769 -38.61774      66.78542 
1 1 1 -10 20 16 f 488.9007 37.43299 48.81308       7.053277      49.46095       10.50358      48.28102       9.518670  476.5078 57.95283 475.3252 52.43816 1.182617       78.15556 
1 1 1 -10 20 17 o 310.0999 70.16633 22.78218       8.252705      4.441532       17.05920      28.38594       9.429549  212.5813 96.22763 345.0554 72.66392 -132.4741      120.5811 
1 1 1 -10 20 18 o 361.6623 60.62057 29.93541       8.213037      26.74178       10.27508      35.58612       13.66766  320.6388 82.14731 352.9547 96.80486 -32.31583      126.9620 
1 1 1 -10 20 19 o 135.7603 61.26910 -0.6545571     6.855885      -1.540571      11.60694      -0.1797910     8.496443  163.8076 76.05151 149.9845 67.89995 13.82306       101.9521 
1 1 1 -10 20 20 o 190.2263 71.72897 9.097245       7.225312      19.29621       12.03182      3.344858       9.036023  243.6039 92.39182 163.7598 72.34669 79.84409       117.3469 
1 1 1 -10 20 21 o 255.2553 94.68955 23.99109       12.49022      0.000000       0.000000      23.99109       12.49022  ?        ?        255.2553 94.68955 0.000000       94.68955 
1 1 1 -10 20 22 o 95.14783 47.59612 -14.68713      7.362556      -20.71737      13.02713      -11.85696      8.924592  123.1495 61.84459 112.3825 55.56904 10.76702       83.14248 
1 1 1 -10 20 23 o 176.2442 66.65707 9.158556       6.251554      8.451385       8.846874      9.863863       8.835203  169.1256 73.20562 175.8727 74.56986 -6.747086      104.4975 
1 1 1 -10 20 24 o 104.1150 50.19731 -4.368357      6.057610      -3.197784      8.587760      -5.527546      8.545902  123.8245 59.71716 117.9955 57.52118 5.828926       82.91457 
1 1 1 -10 21 1  o 498.8216 32.92335 49.13918       6.342026      49.13918       6.342026      0.000000       0.000000  498.8216 32.92335 ?        ?        0.000000       32.92335 
1 1 1 -10 21 2  o 292.0133 54.06864 17.63630       5.905812      17.63630       5.905812      0.000000       0.000000  292.0133 54.06864 ?        ?        0.000000       54.06864 
1 1 1 -10 21 3  o 288.9669 45.67333 17.01056       4.955188      26.86374       6.034991      -3.376157      8.680846  365.2708 43.39239 153.4156 69.11714 211.8552       81.60931 
1 1 1 -10 21 4  o 79.69162 39.69880 -12.30306      4.895195      -18.66048      5.785995      3.708024       9.182227  78.86283 39.80899 190.4662 77.97764 -111.6034      87.55151 
1 1 1 -10 21 5  o 555.1060 33.15411 60.93815       7.114634      59.68152       9.308108      62.70391       11.03379  545.4741 44.32325 556.0807 51.68410 -10.60657      68.08669 
1 1 1 -10 21 6  o 684.3563 24.24920 91.70921       6.444773      86.73611       7.586892      104.5983       12.21409  664.2342 29.41133 722.8834 43.71318 -58.64923      52.68651 
1 1 1 -10 21 7  o 432.3301 35.14827 37.20343       5.850206      37.02181       6.903984      37.66592       11.01717  429.0618 41.97101 420.7139 69.88215 8.347839       81.51736 
1 1 1 -10 21 8  o 489.2711 32.75531 47.49078       6.187906      45.40483       7.360668      52.51754       11.42639  475.8078 40.21088 502.8633 59.67482 -27.05542      71.95831 
1 1 1 -10 21 9  o 205.1791 66.96014 8.692361       6.132984      13.49642       7.524923      -0.8125402     10.58453  248.9137 73.06118 177.9078 78.46386 71.00594       107.2125 
1 1 1 -10 21 10 o 507.8746 30.36394 51.14096       5.961400      54.02889       8.391152      48.19794       8.470797  517.2289 42.14079 486.8776 45.32036 30.35138       61.88523 
1 1 1 -10 21 11 o 237.5484 61.15335 12.25546       5.675117      12.23078       8.076941      12.27952       7.975669  236.3307 76.82912 236.6266 76.29380 -0.2958679     108.2749 
1 1 1 -10 21 12 o 181.3209 64.65094 6.431158       5.743299      3.934609       8.168028      8.872513       8.077236  178.8131 73.41504 209.6743 76.41782 -30.86118      105.9691 
1 1 1 -10 21 13 o 223.1810 71.14262 11.11609       6.950110      13.78660       8.631223      6.191411       11.72096  244.7293 79.41486 208.3790 86.96340 36.35031       117.7682 
1 1 1 -10 21 14 o 326.2296 56.34372 23.10620       6.880242      37.53718       11.39003      14.81528       8.633326  402.3811 75.66599 250.0459 79.24689 152.3353       109.5692 
1 1 1 -10 21 15 o 152.8575 63.08428 2.846646       6.069984      -4.930613      8.942493      9.491537       8.265884  142.3665 66.31518 208.1038 77.06358 -65.73732      101.6686 
1 1 1 -10 21 16 o 250.7973 65.82919 14.78635       6.492779      23.40067       9.494542      7.219225       8.898742  305.8927 79.27470 193.0699 77.59209 112.8228       110.9279 
1 1 1 -10 21 17 o 347.3471 60.25524 27.65404       7.833364      21.66554       9.618156      39.45165       13.49987  286.6817 82.15973 378.3707 92.62010 -91.68903      123.8092 
1 1 1 -10 21 18 o 140.4883 63.28064 -0.3014701     7.272480      1.767614       11.41386      -1.715549      9.435836  172.8792 78.43903 150.4239 69.38892 22.45534       104.7258 
1 1 1 -10 21 19 o 146.1017 70.97560 -9.718502      12.70421      0.000000       0.000000      -9.718502      12.70421  ?        ?        146.1017 70.97560 0.000000       70.97560 
1 1 1 -10 21 20 o 106.3786 52.29983 -10.60516      7.530287      -26.24091      12.36133      -1.378801      9.495572  116.2238 58.60824 144.7594 67.72861 -28.53555      89.56612 
1 1 1 -10 21 21 o 226.3761 72.39769 15.20858       7.192993      -0.5707524     11.46930      25.43855       9.234845  151.3397 71.89886 286.2737 79.97959 -134.9340      107.5462 
1 1 1 -10 21 22 o 226.5879 66.15656 14.79839       6.184396      11.04311       8.410926      19.21811       9.124729  184.1513 74.92377 231.7453 81.61131 -47.59404      110.7880 
1 1 1 -10 22 1  f 604.9229 28.72654 71.84859       6.748563      71.84859       6.748563      0.000000       0.000000  604.9229 28.72654 ?        ?        0.000000       28.72654 
1 1 1 -10 22 2  o 483.7312 29.53754 46.15244       5.522304      50.54016       6.551405      35.38330       10.26373  505.1664 33.58565 410.0587 66.74724 95.10767       74.72074 
1 1 1 -10 22 3  o 428.0852 32.80066 36.33688       5.411583      33.80462       6.466653      42.25420       9.885241  410.3707 41.13019 452.7300 57.52225 -42.35928      70.71423 
1 1 1 -10 22 4  o 209.0477 68.10304 8.936021       6.345167      11.44147       8.582547      5.915800       9.423076  235.4817 79.28947 203.0708 80.42848 32.41084       112.9405 
1 1 1 -10 22 5  o 416.4395 43.31090 35.01065       6.902024      41.36522       9.117139      26.47958       10.56372  448.8325 53.35036 346.1446 80.16106 102.6879       96.29151 
1 1 1 -10 22 6  f 319.3215 47.16957 20.92427       5.673403      26.73645       6.768652      7.195829       10.40263  360.7467 49.62801 214.5946 84.65977 146.1521       98.13366 
1 1 1 -10 22 7  f 297.9957 50.58590 18.46244       5.644873      25.37625       6.799913      3.135991       10.12430  350.0471 51.56535 191.3224 80.39988 158.7247       95.51505 
1 1 1 -10 22 8  o 72.71406 36.92836 -20.05440      5.482960      -16.07546      6.689765      -28.19718      9.570033  93.48553 46.54380 103.1091 51.94064 -9.623589      69.74350 
1 1 1 -10 22 9  o 126.5145 56.41502 -1.508358      5.623351      0.8064374      6.698287      -7.034880      10.34984  150.3702 64.37473 152.7186 71.20594 -2.348373      95.99163 
1 1 1 -10 22 10 o 249.3245 65.68453 13.75752       6.448804      5.886148       7.887651      29.62663       11.19950  188.9381 73.97168 357.7295 82.32391 -168.7913      110.6754 
1 1 1 -10 22 11 f 272.3935 56.66710 16.06984       5.799312      27.76239       8.586308      6.261473       7.864125  355.4710 64.57627 189.9321 73.99947 165.5388       98.21413 
1 1 1 -10 22 12 o 228.5499 67.56009 11.80222       6.414326      14.86079       10.69392      10.08347       8.016486  250.7972 88.34724 215.2327 76.41959 35.56448       116.8126 
1 1 1 -10 22 13 o 112.6245 52.94962 -5.004238      5.924730      -7.411516      8.461379      -2.688657      8.298658  131.0773 62.12188 145.4753 66.34309 -14.39804      90.88748 
1 1 1 -10 22 14 o 198.7033 66.36942 8.877789       6.012935      7.683225       8.661911      9.988831       8.353614  196.7114 77.36441 210.6963 77.57347 -13.98494      109.5577 
1 1 1 -10 22 15 o 224.1600 88.01515 12.11075       11.19382      0.000000       0.000000      12.11075       11.19382  ?        ?        224.1600 88.01515 0.000000       88.01515 
1 1 1 -10 22 16 o 106.9504 52.02059 -9.462026      6.881183      -11.57214      11.03475      -8.119347      8.802281  137.2402 66.55013 128.3098 61.51096 8.930389       90.62294 
1 1 1 -10 22 17 o 320.9717 72.99710 26.23722       8.893626      20.79803       11.94035      33.01498       13.32887  259.9054 93.16030 326.0251 97.62562 -66.11966      134.9430 
1 1 1 -10 22 18 o 116.8112 57.12610 -10.80316      8.625999      -4.340748      11.60961      -18.76758      12.88836  151.5703 72.10422 131.4716 65.31484 20.09868       97.28848 
1 1 1 -10 22 19 o 144.1350 69.28017 -5.200297      11.33125      -5.200297      11.33125      0.000000       0.000000  144.1350 69.28017 ?        ?        0.000000       69.28017 
1 1 1 -10 22 20 o 193.9977 71.21001 11.00370       7.031748      -4.633555      10.72323      22.80057       9.313837  138.6208 66.82188 265.4646 82.04208 -126.8438      105.8115 
1 1 1 -10 22 21 o 119.7564 56.09214 -1.636509      6.543760      -9.521499      9.653423      5.067012       8.900867  119.6703 58.90802 156.5755 70.31325 -36.90524      91.72845 
1 1 1 -10 23 1  o 435.8324 45.81741 38.53630       7.638833      38.53630       7.638833      0.000000       0.000000  435.8324 45.81741 ?        ?        0.000000       45.81741 
1 1 1 -10 23 2  f 433.2526 36.66283 37.52828       6.110837      36.55096       7.862257      39.01955       9.711949  422.9386 48.76077 432.1840 59.43724 -9.245392      76.87911 
1 1 1 -10 23 3  o 406.1636 40.24010 33.23991       6.263762      27.84836       7.919004      42.25067       10.23751  364.3917 57.89602 449.1151 60.21207 -84.72342      83.53109 
1 1 1 -10 23 4  o 418.0538 55.94329 36.40642       8.854808      12.68467       14.85810      49.47204       11.02695  258.7329 101.4621 486.1358 59.65977 -227.4029      117.7023 
1 1 1 -10 23 5  o 446.5620 39.47382 40.17692       6.775217      52.27652       8.610846      20.51142       10.97774  507.6340 44.11714 298.2610 88.43637 209.3730       98.82972 
1 1 1 -10 23 6  o 693.6849 24.57241 94.60591       6.619695      90.86414       7.817712      104.0857       12.44347  677.9043 29.69500 716.0667 44.97502 -38.16241      53.89383 
1 1 1 -10 23 7  f 133.4738 57.72020 0.7086363E-01  5.489681      -4.341158      6.617876      9.804855       9.829814  125.1249 57.85614 223.0379 83.75154 -97.91302      101.7922 
1 1 1 -10 23 8  f 208.0963 64.88705 9.367476       5.811386      7.397999       7.028702      13.62286       10.33164  194.7916 71.24099 246.9298 86.85339 -52.13814      112.3334 
1 1 1 -10 23 9  o 323.0269 49.37394 21.93073       5.997215      27.05335       7.344919      11.68431       10.38788  356.4806 54.80981 233.1063 86.37727 123.3743       102.2993 
1 1 1 -10 23 10 o 231.8334 86.96342 11.74606       10.59283      0.000000       0.000000      11.74606       10.59283  ?        ?        231.8334 86.96342 0.000000       86.96342 
1 1 1 -10 23 11 o 103.7325 49.96743 -7.828023      5.970101      -14.87190      10.15864      -4.111716      7.378799  128.0984 62.50507 131.8727 61.01688 -3.774338      87.34955 
1 1 1 -10 23 12 o 195.2995 65.65716 8.435913       5.884947      5.664658       8.474561      11.01691       8.178478  185.0244 75.23466 218.7652 77.23980 -33.74078      107.8251 
1 1 1 -10 23 13 o 190.7986 68.88780 7.953089       6.541584      23.28769       10.86857      -0.7575532     8.191460  297.6848 87.92775 150.0822 67.42131 147.6026       110.8013 
1 1 1 -10 23 14 o 269.2628 66.32031 17.26992       6.889452      15.29376       11.25537      18.45394       8.712247  239.8597 89.70694 268.6355 78.54698 -28.77585      119.2349 
1 1 1 -10 23 15 o 196.9250 71.34185 9.258272       7.024614      13.81167       11.22907      6.330616       9.004011  226.4473 88.36974 183.3152 76.33804 43.13210       116.7763 
1 1 1 -10 23 16 o 514.5618 63.13317 63.09962       12.35138      63.09962       12.35138      0.000000       0.000000  514.5618 63.13317 ?        ?        0.000000       63.13317 
1 1 1 -10 23 17 o 215.3001 77.86228 13.14647       8.362043      17.94640       11.35579      7.460766       12.35926  235.2653 89.63190 187.9834 83.74444 47.28186       122.6663 
1 1 1 -10 23 18 o 181.7711 71.47472 8.709517       7.391921      7.012632       11.84898      9.790686       9.458044  179.6574 80.86270 188.3775 78.32520 -8.720169      112.5771 
1 1 1 -10 23 19 o 115.2724 54.02620 -2.411095      6.087113      -2.888123      8.003812      -1.756650      9.374789  127.8979 60.55823 139.1702 65.78838 -11.27233      89.41705 
1 1 1 -10 23 20 o 122.4251 57.49047 -1.759409      6.950190      6.732843       10.19088      -9.144247      9.503218  165.8111 74.77729 119.7912 58.86528 46.01984       95.16703 
1 1 1 -10 24 1  o 188.8556 59.88438 7.427856       4.929447      13.21759       5.984949      -4.784407      8.692192  246.6988 62.41971 145.4072 66.90128 101.2916       91.49864 
1 1 1 -10 24 2  o 283.1071 50.18555 16.79267       5.315680      15.88155       6.413200      18.79265       9.501652  270.4165 62.34417 286.7579 81.48483 -16.34143      102.5991 
1 1 1 -10 24 3  o 540.5546 42.88826 59.32551       8.929447      61.92141       14.95228      57.88648       11.13265  530.2245 74.68313 526.5042 55.27103 3.720276       92.91102 
1 1 1 -10 24 4  o 267.3799 77.86364 16.27915       8.576786      8.451852       15.05362      20.04122       10.43635  236.0636 98.53883 292.5242 86.09319 -56.46062      130.8508 
1 1 1 -10 24 5  o 112.6530 53.35677 -6.376164      6.223058      -6.296462      7.747319      -6.521111      10.44772  129.8171 60.87719 153.9954 71.71439 -24.17830      94.06905 
1 1 1 -10 24 6  o 200.9738 68.24677 8.538543       6.358952      10.26902       8.134248      5.818954       10.19730  218.9115 77.05869 200.1227 82.08102 18.78880       112.5848 
1 1 1 -10 24 7  o 136.0029 60.54366 -1.161328      6.447131      -4.126314      8.103267      3.952955       10.64244  140.0126 64.48441 192.5301 81.74901 -52.51749      104.1208 
1 1 1 -10 24 8  o 331.9725 55.77876 23.78509       6.936130      26.98762       8.850989      18.68840       11.16578  345.9551 68.30273 275.1646 90.37609 70.79047       113.2833 
1 1 1 -10 24 9  o 205.4494 72.38962 9.209459       7.180055      5.709318       10.11045      12.77075       10.19839  195.1764 81.05257 234.9460 85.83109 -39.76959      118.0529 
1 1 1 -10 24 10 o 269.3693 67.90403 16.86206       7.101428      19.66716       9.220138      12.77128       11.13439  282.8633 80.23053 233.5470 88.80711 49.31636       119.6814 
1 1 1 -10 24 11 o 384.1116 52.29974 31.96660       7.598797      36.68570       9.634967      24.20136       12.35942  402.3054 63.79792 297.7841 94.86533 104.5213       114.3224 
1 1 1 -10 24 12 o 141.5899 61.85496 0.7324741      6.438498      9.623908       10.98567      -3.919604      7.946288  210.5002 85.63366 135.0598 62.77820 75.44041       106.1802 
1 1 1 -10 24 13 o 271.6657 66.49706 17.78938       6.958879      22.41249       11.58233      15.17776       8.705286  279.4193 92.05963 240.9233 79.83196 38.49602       121.8529 
1 1 1 -10 24 14 o 274.8688 79.09709 20.27859       8.898030      13.49036       11.58592      30.04012       13.89350  221.8849 88.76022 305.0234 100.8431 -83.13846      134.3417 
1 1 1 -10 24 15 o 151.1309 67.96317 1.026872       8.348557      11.04024       11.23360      -11.32664      12.47740  204.4484 85.21374 142.4363 69.45075 62.01205       109.9308 
1 1 1 -10 24 16 o 166.3380 70.82087 5.348501       8.026855      -2.358054      11.29362      13.21561       11.41066  152.9629 72.27763 208.6767 86.33701 -55.71371      112.5972 
1 1 1 -10 24 17 o 127.4414 57.22241 0.4339501      5.893016      2.617815       8.059660      -2.074791      8.638370  150.5097 67.29594 136.5410 64.11096 13.96877       92.94600 
1 1 1 -10 24 18 o 174.0187 64.89938 8.091702       5.882864      12.28015       7.834757      2.677976       8.907316  199.9426 74.83129 151.3552 68.91151 48.58739       101.7277 
1 1 1 -10 25 1  o 110.3884 51.58289 -4.491217      5.479049      -11.89424      6.975597      7.432102       8.852695  105.1865 51.42634 202.7316 78.64449 -97.54505      93.96608 
1 1 1 -10 25 2  o 348.4170 40.94070 24.86838       5.434050      20.31319       6.568123      34.75055       9.674183  306.9943 57.19572 398.7676 64.68549 -91.77328      86.34560 
1 1 1 -10 25 3  o 218.6163 68.82767 10.59046       6.521032      6.793831       9.073024      14.64735       9.378842  198.9681 78.88343 251.2229 82.84454 -52.25481      114.3932 
1 1 1 -10 25 4  o 524.7277 29.84548 54.94296       6.056786      64.19541       7.247330      33.51355       11.02946  565.5801 33.14024 380.8162 77.22029 184.7640       84.03123 
1 1 1 -10 25 5  o 551.2017 28.79399 60.56738       6.142293      62.44210       7.250376      55.80133       11.56036  557.0596 33.67262 508.0110 59.73719 49.04861       68.57388 
1 1 1 -10 25 6  o 114.8523 54.78010 -7.318893      6.793000      -22.35264      9.052776      12.05476       10.27671  105.0174 52.56908 231.1722 85.86359 -126.1547      100.6780 
1 1 1 -10 25 7  o 217.0149 74.82873 10.70842       7.650653      14.67769       10.30515      5.834028       11.41982  245.9622 86.71762 200.9055 84.95825 45.05679       121.3996 
1 1 1 -10 25 8  o 481.4764 40.44052 47.86902       7.491664      43.95703       9.504250      54.28785       12.17438  449.7366 55.60092 490.7114 65.52071 -40.97473      85.93268 
1 1 1 -10 25 9  o 246.2386 71.22630 14.54424       7.198515      17.74437       9.054901      9.048325       11.86643  265.5374 80.68085 212.7894 88.04197 52.74809       119.4185 
1 1 1 -10 25 10 o 155.2908 66.74799 2.130892       7.253116      0.8956088E-01  8.972334      5.980665       12.32158  158.1061 70.82587 198.5753 86.17303 -40.46922      111.5441 
1 1 1 -10 25 11 o 310.3864 65.83288 22.88866       7.689516      20.23335       9.460743      28.05721       13.19932  276.2401 82.14270 306.9403 98.06258 -30.70026      127.9206 
1 1 1 -10 25 12 o 170.5159 70.61665 5.133424       7.644232      6.539233       9.415326      2.414577       13.09377  184.8779 77.60447 182.8624 83.37041 2.015488       113.8994 
1 1 1 -10 25 13 o 319.3575 63.15163 24.63152       7.554798      21.09878       9.000341      33.05696       13.89952  277.0926 79.49634 316.7370 100.5706 -39.64441      128.1956 
1 1 1 -10 25 14 o 208.5410 67.18480 11.26574       6.185806      20.16120       8.801849      2.584491       8.695227  266.3442 79.23764 158.0284 70.33278 108.3159       105.9495 
1 1 1 -10 25 15 o 102.2224 50.04353 -9.147673      6.671080      -4.016979      8.323301      -18.36429      11.15561  130.0300 61.62190 119.5255 59.60378 10.50451       85.73138 
1 1 1 -10 25 16 o 352.7689 46.92555 28.45526       6.269271      32.48090       8.705729      24.11871       9.035649  353.3418 65.86595 283.8680 79.04325 69.47388       102.8891 
1 1 1 -10 25 17 o 262.6700 60.78426 17.89143       6.077663      22.74909       8.432553      12.64026       8.767453  275.2014 76.26380 198.9065 77.95665 76.29491       109.0569 
1 1 1 -10 26 1  f 177.2855 63.34920 6.347589       5.517189      10.09935       7.254300      1.200025       8.497259  213.1108 72.89066 164.1767 71.40358 48.93411       102.0368 
1 1 1 -10 26 2  o 222.4515 66.95065 11.24713       6.256948      11.24148       8.456440      11.25396       9.301064  222.7617 78.55317 224.0967 81.95288 -1.335037      113.5204 
1 1 1 -10 26 3  o 405.6302 35.48555 33.46815       5.533731      39.27373       6.677153      20.73524       9.888547  437.1746 39.76332 289.8737 83.37428 147.3009       92.37095 
1 1 1 -10 26 4  o 738.8091 23.80314 108.0164       6.829587      103.4334       7.932035      121.1518       13.42867  720.1353 28.36237 762.5526 45.55384 -42.41724      53.66169 
1 1 1 -10 26 5  o 289.5522 56.18471 18.53457       6.090003      18.80162       7.354163      17.95180       10.86382  284.3140 67.59582 264.1859 89.20573 20.12817       111.9234 
1 1 1 -10 26 6  o 491.3577 65.06953 54.79717       12.11118      0.000000       0.000000      54.79717       12.11118  ?        ?        491.3577 65.06953 0.000000       65.06953 
1 1 1 -10 26 7  f 119.0454 54.55244 -2.472301      5.700548      0.1704384      6.635060      -9.922051      11.14009  140.8302 62.11680 143.9063 69.04363 -3.076004      92.87367 
1 1 1 -10 26 8  o 372.4647 43.16871 29.38328       6.128513      27.30335       7.091055      35.52261       12.18281  351.2854 53.68259 367.5439 86.74709 -16.25858      102.0141 
1 1 1 -10 26 9  o 185.7690 66.12997 7.876890       6.006770      3.802684       6.896518      20.68124       12.22608  160.3908 66.80203 265.5083 94.36366 -105.1175      115.6158 
1 1 1 -10 26 10 o 272.1919 60.68804 17.51328       6.251580      12.73194       7.192405      32.28707       12.64286  223.4347 72.49358 331.2574 93.94669 -107.8226      118.6646 
1 1 1 -10 26 11 o 208.7937 68.18353 11.00494       6.358757      8.827930       7.311809      17.76114       12.88087  190.7302 72.09969 238.3185 94.14650 -47.58826      118.5830 
1 1 1 -10 26 12 f 278.9894 62.44158 19.11184       6.596539      22.27405       7.625805      9.711926       13.14778  296.3178 67.74328 199.5882 87.75957 96.72964       110.8643 
1 1 1 -10 26 13 o 159.4995 65.47131 5.104521       6.494303      0.2800710E-01  7.449052      21.18779       13.25883  138.9677 63.17373 242.3895 95.59301 -103.4218      114.5816 
1 1 1 -10 26 14 o 123.0714 57.25846 -2.104624      6.634784      -8.280806      8.397220      8.157649       10.82424  118.6057 57.63788 182.8117 80.02315 -64.20605      98.61962 
1 1 1 -10 26 15 o 441.8275 44.05093 43.83472       7.457735      45.63233       9.376085      40.73875       12.30476  431.8895 57.31699 356.3256 89.14211 75.56393       105.9790 
1 1 1 -10 27 1  o 141.7576 65.98710 -4.522266      8.830492      0.000000       0.000000      -4.522266      8.830492  ?        ?        141.7576 65.98710 0.000000       65.98710 
1 1 1 -10 27 2  o 183.9641 69.96002 6.905002       6.910320      16.61901       10.46223      -0.6124301     9.203641  253.1734 87.49279 158.1687 71.22168 95.00465       112.8163 
1 1 1 -10 27 3  o 351.7081 43.70547 26.14687       5.840903      27.50564       7.168700      23.46332       10.07448  353.7728 53.87980 301.9352 83.23540 51.83765       99.15223 
1 1 1 -10 27 4  o 291.2548 64.50036 19.83149       7.103227      18.72432       9.663383      21.13289       10.47681  267.3602 83.72265 281.0404 87.03962 -13.68021      120.7699 
1 1 1 -10 27 5  o 136.4497 58.29033 1.430045       5.470798      -1.482682      6.431965      9.050029       10.40329  130.2162 59.00262 204.5828 83.29167 -74.36656      102.0726 
1 1 1 -10 27 6  o 176.1576 63.80597 6.811123       5.618573      1.794871       6.593065      20.11810       10.73834  147.1158 63.43794 268.2887 88.65413 -121.1729      109.0134 
1 1 1 -10 27 7  o 138.8911 59.30161 1.782599       5.656808      -0.9880818E-01 6.635900      6.784723       10.82021  137.0607 61.18872 191.4180 81.87963 -54.35727      102.2171 
1 1 1 -10 27 8  o 266.9024 58.43416 16.71239       5.888934      15.22417       6.827012      21.03905       11.64055  246.0677 68.77408 263.7638 92.22372 -17.69609      115.0439 
1 1 1 -10 27 9  o 404.9857 41.84190 35.22354       6.485943      36.60846       7.566249      31.38576       12.59529  406.0320 48.97212 318.6584 94.78374 87.37360       106.6875 
1 1 1 -10 27 10 o 171.5236 66.16855 6.665445       6.239659      7.403327       7.231179      4.514583       12.34588  178.7969 70.56953 180.5225 81.77563 -1.725677      108.0153 
1 1 1 -10 27 11 o 175.9537 66.50047 7.476708       6.219449      10.47237       7.129072      -2.066645      12.72440  198.4127 71.87194 161.0312 76.27815 37.38153       104.8043 
1 1 1 -10 27 12 o 159.0017 65.06987 5.231547       6.390728      10.12960       7.383209      -9.401813      12.76161  193.3153 72.58555 143.6705 70.09312 49.64488       100.9044 
1 1 1 -10 28 1  o 182.3940 75.15394 6.073958       8.597691      0.000000       0.000000      6.073958       8.597691  ?        ?        182.3940 75.15394 0.000000       75.15394 
1 1 1 -10 28 2  o 126.7461 56.29831 -0.2963496     5.544323      -4.241661      7.006214      6.313649       9.068666  124.1529 58.11600 184.8417 76.76221 -60.68882      96.28035 
1 1 1 -10 28 3  o 351.1364 53.37440 27.54602       7.049230      21.32215       9.721406      34.44731       10.23678  280.8265 83.21194 373.2666 73.23397 -92.44003      110.8487 
1 1 1 -10 28 4  o 386.5543 40.65350 31.64627       6.011446      33.84807       7.440294      27.50653       10.20204  391.9025 50.02730 321.5336 81.57306 70.36887       95.69167 
1 1 1 -10 28 5  o 406.7936 40.37130 35.09181       6.293622      26.78424       7.586397      53.43024       11.27145  338.7332 59.85928 477.1181 62.31998 -138.3849      86.41131 
1 1 1 -10 28 6  o 325.6595 49.19420 23.59723       6.027721      35.35717       7.387183      0.1680530      10.42689  400.1102 48.53468 161.5111 73.92651 238.5991       88.43497 
1 1 1 -10 28 7  o 142.6235 59.74591 2.819203       5.562093      4.391899       6.551538      -1.240135      10.52564  158.4109 65.47058 156.2972 72.51426 2.113617       97.69706 
1 1 1 -10 28 8  o 243.3047 61.89655 14.59567       5.862506      13.26988       6.845659      18.24268       11.35394  224.4382 70.49724 240.4957 90.06860 -16.05753      114.3775 
1 1 1 -10 28 9  o 121.8252 55.93359 -1.572700      6.032444      -2.990118      7.088043      2.151524       11.48934  125.4486 58.63701 168.2549 77.22924 -42.80629      96.96729 
1 1 1 -9  0  1  o 144.7670 58.30983 5.701969       3.195169      5.701969       3.195169      5.701969       3.195169  144.7670 58.30983 144.7670 58.30983 0.000000       0.000000 
1 1 1 -9  0  2  o 398.6751 25.80575 31.32876       3.957036      31.32876       3.957036      31.32876       3.957036  398.6751 25.80575 398.6751 25.80575 -0.000000      0.000000 
1 1 1 -9  0  3  o 113.1221 61.09627 3.584105       3.739707      3.584105       3.739707      3.584105       3.739707  113.1221 61.09627 113.1221 61.09627 -0.000000      0.000000 
1 1 1 -9  0  4  o 363.8067 42.92063 26.93808       5.842431      26.93808       5.842431      26.93808       5.842431  363.8067 42.92063 363.8067 42.92063 0.000000       0.000000 
1 1 1 -9  0  5  o 868.2307 28.52905 147.3654       9.595923      147.3654       9.595923      147.3654       9.595923  868.2307 28.52905 868.2307 28.52905 0.000000       0.000000 
1 1 1 -9  0  6  o 94.29898 61.94547 -0.8420376     5.719098      -0.8420376     5.719098      -0.8420376     5.719098  94.29898 61.94547 94.29898 61.94547 -0.000000      0.000000 
1 1 1 -9  0  7  o 551.9684 25.03427 59.71002       5.341193      59.71002       5.341193      59.71002       5.341193  551.9684 25.03427 551.9684 25.03427 0.000000       0.000000 
1 1 1 -9  0  8  o 228.8800 58.98023 12.13598       4.531145      12.13598       4.531145      12.13598       4.531145  228.8800 58.98023 228.8800 58.98023 -0.000000      0.000000 
1 1 1 -9  0  9  o 822.0917 22.37437 131.9158       7.131340      131.9158       7.131340      131.9158       7.131340  822.0917 22.37437 822.0917 22.37437 0.000000       0.000000 
1 1 1 -9  0  10 o 145.4745 82.30592 5.794954       7.154237      5.794954       7.154237      5.794954       7.154237  145.4745 82.30592 145.4745 82.30592 -0.000000      0.000000 
1 1 1 -9  0  11 o 170.8944 86.47642 8.756567       7.137942      8.756567       7.137942      8.756567       7.137942  170.8944 86.47642 170.8944 86.47642 0.000000       0.000000 
1 1 1 -9  0  12 o 231.9149 69.42707 13.15420       5.446773      13.15420       5.446773      13.15420       5.446773  231.9149 69.42707 231.9149 69.42707 0.000000       0.000000 
1 1 1 -9  0  13 o 95.05353 61.83444 -0.2479064     5.498434      -0.2479064     5.498434      -0.2479064     5.498434  95.05353 61.83444 95.05353 61.83444 0.000000       0.000000 
1 1 1 -9  0  14 o 602.2855 29.83290 71.33640       6.938869      71.33640       6.938869      71.33640       6.938869  602.2855 29.83290 602.2855 29.83290 -0.000000      0.000000 
1 1 1 -9  0  15 o 148.2636 77.51921 6.433692       5.857930      6.433692       5.857930      6.433692       5.857930  148.2636 77.51921 148.2636 77.51921 0.000000       0.000000 
1 1 1 -9  0  16 o 146.5979 79.83527 6.110999       6.434724      6.110999       6.434724      6.110999       6.434724  146.5979 79.83527 146.5979 79.83527 0.000000       0.000000 
1 1 1 -9  0  17 o 95.09342 63.27622 -1.727978      6.282699      -1.727978      6.282699      -1.727978      6.282699  95.09342 63.27622 95.09342 63.27622 -0.000000      0.000000 
1 1 1 -9  0  18 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -9  0  19 o 102.9552 67.84723 -1.237985      6.944319      -1.237985      6.944319      -1.237985      6.944319  102.9552 67.84723 102.9552 67.84723 -0.000000      0.000000 
1 1 1 -9  0  20 o 536.5839 40.65683 57.20255       8.360417      57.20255       8.360417      57.20255       8.360417  536.5839 40.65683 536.5839 40.65683 0.000000       0.000000 
1 1 1 -9  0  21 o 143.6957 84.19299 4.971043       7.885190      4.971043       7.885190      4.971043       7.885190  143.6957 84.19299 143.6957 84.19299 0.000000       0.000000 
1 1 1 -9  0  22 o 87.39492 61.54232 -9.148290      8.212484      -9.148290      8.212484      -9.148290      8.212484  87.39492 61.54232 87.39492 61.54232 0.000000       0.000000 
1 1 1 -9  0  23 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -9  0  24 o 122.5583 79.55407 -0.3684101E-01 9.035472      -0.3684101E-01 9.035472      -0.3684101E-01 9.035472  122.5583 79.55407 122.5583 79.55407 -0.000000      0.000000 
1 1 1 -9  0  25 f 167.9733 102.8195 5.856231       12.81420      5.856231       12.81420      5.856231       12.81420  167.9733 102.8195 167.9733 102.8195 -0.000000      0.000000 
1 1 1 -9  0  26 o 388.5897 110.2550 37.60164       14.41330      37.60164       14.41330      37.60164       14.41330  388.5897 110.2550 388.5897 110.2550 -0.000000      0.000000 
1 1 1 -9  0  27 o 364.2693 79.90257 30.38019       9.894824      30.38019       9.894824      30.38019       9.894824  364.2693 79.90257 364.2693 79.90257 0.000000       0.000000 
1 1 1 -9  0  28 o 100.8637 70.25735 -7.849968      9.887195      -7.849968      9.887195      -7.849968      9.887195  100.8637 70.25735 100.8637 70.25735 -0.000000      0.000000 
1 1 1 -9  0  29 o 194.1505 113.5158 12.46948       14.28041      12.46948       14.28041      12.46948       14.28041  194.1505 113.5158 194.1505 113.5158 -0.000000      0.000000 
1 1 1 -9  0  30 o 186.2127 111.9989 11.70788       14.64770      11.70788       14.64770      11.70788       14.64770  186.2127 111.9989 186.2127 111.9989 0.000000       0.000000 
1 1 1 -9  0  31 o 114.2786 77.75173 -2.750889      10.52935      -2.750889      10.52935      -2.750889      10.52935  114.2786 77.75173 114.2786 77.75173 0.000000       0.000000 
1 1 1 -9  0  32 o 142.9282 89.29751 6.089930       10.15349      6.089930       10.15349      6.089930       10.15349  142.9282 89.29751 142.9282 89.29751 0.000000       0.000000 
1 1 1 -9  0  33 o 108.4779 73.77754 -1.445360      9.462543      -1.445360      9.462543      -1.445360      9.462543  108.4779 73.77754 108.4779 73.77754 0.000000       0.000000 
1 1 1 -9  1  1  o 391.7644 18.29138 29.89398       2.782912      27.56058       3.847057      32.45536       4.030621  374.5967 26.61785 406.8092 25.64375 -32.21252      36.96095 
1 1 1 -9  1  2  o 494.3404 18.47534 47.60458       3.546881      45.37516       5.995064      48.80520       4.399467  479.9796 32.35069 500.1310 22.65104 -20.15146      39.49224 
1 1 1 -9  1  3  o 441.4626 20.24768 37.99577       3.471340      37.20881       5.791342      38.43706       4.336745  433.8532 34.66166 442.8078 25.32371 -8.954590      42.92693 
1 1 1 -9  1  4  f 622.1102 21.97941 75.53011       5.310205      78.31278       7.581070      72.84972       7.440431  631.9200 30.89160 608.5519 31.59139 23.36804       44.18492 
1 1 1 -9  1  5  o 434.9731 26.86282 37.17517       4.515557      39.21818       6.556873      35.33212       6.227755  444.1622 38.38994 421.3967 38.47959 22.76556       54.35500 
1 1 1 -9  1  6  o 258.9087 37.19508 13.49383       3.632507      8.909114       4.531797      21.73343       6.075296  206.7156 55.34847 326.3104 49.49433 -119.5948      74.25053 
1 1 1 -9  1  7  o 265.2451 30.85873 14.01830       3.119315      9.089400       4.352775      19.22186       4.472413  208.4085 53.50604 309.3979 38.02190 -100.9894      65.63963 
1 1 1 -9  1  8  o 600.8954 17.65730 70.44526       4.120513      65.60291       5.802271      75.37202       5.852626  578.3195 25.83463 620.2455 24.29737 -41.92603      35.46534 
1 1 1 -9  1  9  o 317.1136 28.77014 19.95546       3.504544      29.99126       5.153016      11.31895       4.780293  387.6506 34.59235 231.4256 54.14945 156.2250       64.25569 
1 1 1 -9  1  10 o 227.9727 47.70618 10.86983       4.088011      14.77879       5.037098      3.326899       6.997138  265.7700 50.65219 168.8466 68.47007 96.92346       85.16921 
1 1 1 -9  1  11 o 570.6877 28.51029 64.25014       6.318707      64.43243       8.779172      64.05422       9.101546  565.8329 40.21375 563.3202 41.90355 2.512695       58.07799 
1 1 1 -9  1  12 o 208.8500 49.57478 9.219118       3.960693      7.663128       5.779795      10.59668       5.438320  193.7284 65.06824 221.6830 61.17211 -27.95453      89.30791 
1 1 1 -9  1  13 o 573.4351 21.30279 64.42722       4.744044      66.80008       6.772935      62.14177       6.647020  580.5651 30.14358 559.6915 30.69808 20.87354       43.02334 
1 1 1 -9  1  14 o 356.7802 31.26048 25.35689       4.287675      28.66302       6.091233      22.10989       6.036514  375.6693 42.49894 326.9398 49.05729 48.72949       64.90591 
1 1 1 -9  1  15 o 321.8226 35.42127 20.78380       4.353703      22.51882       6.173039      19.06662       6.141214  330.2874 49.66303 301.6384 54.42775 28.64899       73.68037 
1 1 1 -9  1  16 o 590.6505 22.15038 68.26975       5.080890      63.61330       6.962200      73.57539       7.431683  567.0042 31.74540 610.0020 31.47828 -42.99774      44.70629 
1 1 1 -9  1  17 o 508.7140 25.79237 50.86452       5.078907      49.54811       7.336577      52.07598       7.038040  498.5056 38.18655 511.9872 35.61864 -13.48160      52.21973 
1 1 1 -9  1  18 o 828.4402 20.06611 133.9910       6.455835      135.3524       9.253489      132.6999       9.011192  830.2946 28.69758 822.2680 28.21895 8.026550       40.24749 
1 1 1 -9  1  19 o 668.1117 23.23266 87.27046       6.028037      93.42306       8.635713      81.42374       8.418308  689.0820 32.27002 642.0280 33.88313 47.05402       46.79125 
1 1 1 -9  1  20 o 341.6162 42.91432 23.53190       5.567712      24.38371       7.738804      22.61788       8.016399  342.0103 60.47727 327.3744 65.34222 14.63583       89.03429 
1 1 1 -9  1  21 o 460.8697 47.26677 42.93508       8.340122      42.93508       8.340122      0.000000       0.000000  460.8697 47.26677 ?        ?        0.000000       47.26677 
1 1 1 -9  1  22 o 369.2178 42.27998 27.57124       5.953128      31.95442       8.329288      22.99401       8.511663  392.1865 56.30213 326.2029 69.32594 65.98355       89.30855 
1 1 1 -9  1  23 o 503.6752 34.04730 50.56861       6.620691      44.87628       9.262472      56.51512       9.467020  466.3563 52.02927 526.7433 46.76561 -60.38702      69.95761 
1 1 1 -9  1  24 o 466.7549 37.66585 43.84873       6.769400      43.08884       9.378838      44.67511       9.780547  454.3243 54.22789 461.8785 55.64668 -7.554138      77.69953 
1 1 1 -9  1  25 o 290.3385 71.81197 19.01921       8.052156      19.16655       9.937267      18.73749       13.74049  285.9276 83.96901 280.1628 99.98769 5.764709       130.5693 
1 1 1 -9  1  26 o 912.8383 34.29325 167.1663       12.15711      166.3781       17.04107      167.9832       17.34856  894.5002 49.24527 897.9697 49.94525 -3.469482      70.14004 
1 1 1 -9  1  27 o 452.3539 41.81477 42.48066       7.262626      33.48835       10.41336      50.99721       10.13414  376.8570 73.79261 485.2737 54.72989 -108.4166      91.87334 
1 1 1 -9  1  28 o 373.6620 53.06443 30.90463       7.484007      31.16362       10.61170      30.64832       10.55648  349.1994 79.97078 345.9938 80.13867 3.205566       113.2145 
1 1 1 -9  1  29 o 281.8586 85.08489 22.94672       10.09439      30.19353       14.50332      16.13779       14.05832  294.4614 102.9422 228.1339 95.22691 66.32756       140.2329 
1 1 1 -9  1  30 f 222.4330 80.71596 15.24539       8.997290      7.446114       11.12393      30.00006       15.30015  180.9339 80.08555 266.6961 103.4089 -85.76216      130.7941 
1 1 1 -9  1  31 o 133.5715 61.47422 0.5378700      7.346669      2.593176       10.53865      -1.405251      10.24700  153.5285 71.67362 141.4616 67.41888 12.06688       98.39926 
1 1 1 -9  1  32 o 188.2234 71.69019 12.44242       7.263355      22.22780       10.44140      3.267510       10.11046  222.6382 85.67728 145.1848 68.53630 77.45337       109.7170 
1 1 1 -9  1  33 o 168.3509 68.63044 10.67141       7.074871      12.37734       10.26958      9.130402       9.760572  164.8817 74.64632 154.5575 71.03069 10.32422       103.0409 
1 1 1 -9  2  1  o 973.0845 15.58817 184.2880       5.890792      174.7485       9.614311      190.0219       7.453800  945.5903 26.18106 987.4780 19.43669 -41.88770      32.60725 
1 1 1 -9  2  2  o 822.3469 15.86819 131.6343       5.067693      127.5523       8.498093      133.8870       6.313016  807.6107 27.09514 828.8201 19.61321 -21.20947      33.44883 
1 1 1 -9  2  3  o 389.3162 22.18277 29.67229       3.339985      33.65799       5.915271      27.80686       4.046804  411.8059 37.39513 375.9280 27.91846 35.87790       46.66729 
1 1 1 -9  2  4  o 872.6840 16.36960 148.3073       5.547828      142.3152       9.458162      151.4504       6.849998  852.3677 28.57273 881.2557 20.01523 -28.88806      34.88568 
1 1 1 -9  2  5  o 507.9541 20.87835 50.35429       4.118591      54.29728       5.198970      43.71006       6.748806  526.8298 25.41084 469.2602 37.34163 57.56961       45.16756 
1 1 1 -9  2  6  o 286.9581 32.06459 16.39213       3.512231      17.59244       4.421766      14.34027       5.781270  295.6128 39.50455 261.3467 58.42820 34.26611       70.52988 
1 1 1 -9  2  7  o 519.1367 18.85675 52.59188       3.801690      61.18236       5.491119      44.68358       5.268586  558.8253 25.30211 476.1511 28.62487 82.67413       38.20445 
1 1 1 -9  2  8  f 227.4819 38.03389 10.53136       3.241420      10.03708       4.429417      11.10125       4.756120  218.5076 52.78876 229.5826 54.21133 -11.07498      75.66718 
1 1 1 -9  2  9  o 292.8604 31.46920 17.12078       3.522963      18.57477       4.935213      15.61006       5.030601  301.6869 43.37012 274.2712 49.02882 27.41571       65.45832 
1 1 1 -9  2  10 o 589.2758 22.00280 68.03518       5.035289      64.80844       5.997156      75.74468       9.269931  573.8623 26.90975 614.7700 39.02950 -40.90765      47.40714 
1 1 1 -9  2  11 o 89.59402 43.55460 -7.930846      4.806207      -9.158466      6.954831      -6.808665      6.649456  113.1182 54.34670 116.9673 55.32763 -3.849144      77.55457 
1 1 1 -9  2  12 o 409.5855 26.94376 33.18567       4.261867      42.28437       6.721383      27.06783       5.511481  458.5829 38.08556 365.7854 39.42124 92.79752       54.81372 
1 1 1 -9  2  13 o 91.22389 42.74471 -3.583851      3.806427      -6.907257      5.467680      -0.4584173     5.302329  101.9683 48.77619 128.7617 56.19490 -26.79339      74.41091 
1 1 1 -9  2  14 o 629.9174 20.37111 77.64687       4.983405      71.22294       7.015860      84.18839       7.079772  599.8115 30.21580 653.7180 27.88694 -53.90649      41.11783 
1 1 1 -9  2  15 o 205.0932 52.24526 8.869016       4.172881      14.65946       5.942845      3.237538       5.860702  262.1013 59.71674 159.1843 63.30801 102.9170       87.02869 
1 1 1 -9  2  16 o 653.3312 21.64748 83.49042       5.492483      87.24628       7.922312      80.01437       7.621505  665.4347 30.65621 637.2162 30.79824 28.21851       43.45498 
1 1 1 -9  2  17 o 777.4474 20.23893 118.0558       6.110639      118.1230       8.518451      117.9845       8.770559  775.5106 28.28426 774.7828 29.14871 0.7277832      40.61584 
1 1 1 -9  2  18 o 475.1966 39.47911 45.04636       7.219691      0.000000       0.000000      45.04636       7.219691  ?        ?        475.1966 39.47911 0.000000       39.47911 
1 1 1 -9  2  19 o 831.7848 20.73565 135.0753       6.698175      128.2269       9.077223      143.2622       9.924710  808.3616 28.91474 854.1245 29.92049 -45.76288      41.60887 
1 1 1 -9  2  20 o 495.2488 29.69776 48.33350       5.685458      52.52359       7.842863      43.69286       8.253770  513.4832 39.63645 465.8923 46.22862 47.59082       60.89444 
1 1 1 -9  2  21 o 409.0626 36.49540 33.35132       5.736813      28.67220       7.994120      38.31971       8.237511  372.0575 57.15446 434.1590 49.75428 -62.10147      75.77679 
1 1 1 -9  2  22 o 182.3476 65.42949 6.153687       5.891296      7.948795       8.227706      4.265004       8.439429  208.0898 76.91975 186.1643 75.29996 21.92552       107.6417 
1 1 1 -9  2  23 o 439.6595 37.82702 38.83093       6.395836      43.15023       8.861605      34.13444       9.240440  457.7982 50.69470 401.4203 61.21104 56.37790       79.47795 
1 1 1 -9  2  24 o 641.7133 29.40243 81.45508       7.327440      75.83586       10.41529      86.96192       10.31063  610.7806 44.20837 656.4764 40.64238 -45.69580      60.05150 
1 1 1 -9  2  25 o 396.7439 55.12760 33.27462       8.264368      14.66921       9.824826      78.29270       15.28265  253.3879 84.83638 601.1644 66.57813 -347.7765      107.8418 
1 1 1 -9  2  26 o 304.5653 71.10771 21.24257       8.257794      30.16941       14.01855      16.49903       10.21893  340.9569 99.61953 262.0605 86.47805 78.89642       131.9185 
1 1 1 -9  2  27 o 331.6732 58.63199 24.44677       7.275942      24.61617       10.30200      24.27816       10.27751  313.1442 83.27105 310.7910 83.40959 2.353180       117.8611 
1 1 1 -9  2  28 o 240.4789 72.24367 14.43656       7.290303      0.9915751      10.34571      27.69775       10.27475  168.1323 75.62819 326.3273 81.35824 -158.1949      111.0801 
1 1 1 -9  2  29 o 128.2979 61.26921 -6.319698      8.552954      -0.2386794     14.36017      -9.662849      10.64755  175.8497 82.59743 135.1445 65.49565 40.70520       105.4136 
1 1 1 -9  2  30 o 198.4286 77.09968 11.39928       8.518963      3.342223       10.22457      29.68948       15.40516  163.1364 74.10373 263.3065 103.2952 -100.1700      127.1270 
1 1 1 -9  2  31 o 123.9680 58.53357 -2.155962      7.382030      -5.224160      10.05348      1.433696       10.87430  131.0505 63.54258 150.8159 71.15891 -19.76538      95.40047 
1 1 1 -9  2  32 o 141.3318 62.97388 4.337005       6.992438      -4.777167      9.868875      13.52516       9.908848  124.7981 61.04713 181.1797 77.94968 -56.38157      99.00962 
1 1 1 -9  2  33 o 197.2505 71.55390 14.91003       7.069801      16.68209       10.08986      13.20092       9.909011  182.3050 78.54530 168.6950 75.08067 13.61000       108.6576 
1 1 1 -9  3  1  o 522.7805 18.30462 53.24514       3.716277      55.91210       6.244504      51.78255       4.624356  533.3448 30.27300 515.0419 23.11962 18.30286       38.09162 
1 1 1 -9  3  2  o 624.7719 16.95407 76.01710       4.113612      68.92537       6.737004      80.23291       5.194352  593.2068 29.24372 641.3823 20.85386 -48.17542      35.91767 
1 1 1 -9  3  3  o 304.7853 27.23613 18.32102       3.189836      13.08544       5.530860      20.93045       3.904654  250.4086 58.01189 325.1721 31.30701 -74.76352      65.92047 
1 1 1 -9  3  4  o 972.6936 14.15716 184.1320       5.347861      192.8993       7.757536      176.1921       7.382433  994.4475 20.08695 950.4255 20.00108 44.02203       28.34658 
1 1 1 -9  3  5  o 911.0361 16.54142 161.7009       5.852431      160.5270       7.145486      164.0931       10.20053  906.9653 20.28678 914.7003 28.71546 -7.734985      35.15866 
1 1 1 -9  3  6  o 257.3781 35.54580 13.31156       3.458118      11.11035       4.282650      17.43585       5.862147  231.4172 49.16950 289.8960 54.05853 -58.47878      73.07506 
1 1 1 -9  3  7  o 554.4646 25.63038 60.26634       5.518956      60.26634       5.518956      0.000000       0.000000  554.4646 25.63038 ?        ?        0.000000       25.63038 
1 1 1 -9  3  8  o 251.1300 33.83126 12.68180       3.215515      5.333197       4.541899      20.06627       4.552971  167.3329 57.65756 315.7474 37.88670 -148.4145      68.99128 
1 1 1 -9  3  9  o 1024.431 17.66771 204.8978       7.028954      202.3076       8.471829      210.6194       12.59147  1016.619 21.45808 1032.578 31.39973 -15.95813      38.03146 
1 1 1 -9  3  10 o 155.5631 54.31837 4.548008       4.037491      4.804584       5.088249      4.111825       6.634291  165.0479 60.57630 171.0078 67.56281 -5.959885      90.74261 
1 1 1 -9  3  11 o 291.6250 48.52719 17.67070       5.302753      17.67326       7.463440      17.66810       7.535530  283.7309 68.50921 283.4664 69.08268 0.2644958      97.29300 
1 1 1 -9  3  12 o 175.2002 52.26838 6.395427       3.825940      4.793207       5.479148      7.920007       5.344748  167.3256 62.58764 194.9654 62.41282 -27.63972      88.38876 
1 1 1 -9  3  13 o 301.8961 34.89833 18.33649       4.016162      20.10193       5.855103      16.76780       5.519192  310.8933 50.20557 282.6423 52.20485 28.25107       72.42890 
1 1 1 -9  3  14 o 262.2451 42.44967 14.10462       4.175497      19.05877       5.990777      9.424244       5.822890  301.8780 53.03569 211.0318 64.81184 90.84612       83.74581 
1 1 1 -9  3  15 o 293.8014 40.12583 17.50089       4.458612      19.37192       6.418629      15.75625       6.198017  303.6649 56.50724 271.9567 60.26908 31.70816       82.61617 
1 1 1 -9  3  16 o 440.4696 28.75468 38.30387       4.891737      41.35543       6.982424      35.36246       6.855250  454.3634 39.97781 418.9645 42.73070 35.39893       58.51613 
1 1 1 -9  3  17 o 130.3667 53.90198 1.186537       4.443397      7.665984       6.281833      -5.301498      6.285994  198.1936 67.82909 119.1562 55.53567 79.03749       87.66412 
1 1 1 -9  3  18 o 783.0415 20.33547 119.7072       6.183965      123.7412       8.707667      115.6024       8.783724  794.1382 28.23434 767.2194 29.48024 26.91882       40.81989 
1 1 1 -9  3  19 o 458.3174 31.22437 41.47138       5.524496      34.29156       7.598832      49.52101       8.045961  411.6285 48.46342 497.8619 42.00645 -86.23340      64.13459 
1 1 1 -9  3  20 o 393.0353 37.28015 30.79257       5.622251      23.83825       7.781912      38.38622       8.131748  337.6154 61.62278 435.4518 48.93299 -97.83640      78.68803 
1 1 1 -9  3  21 o 818.5765 32.47129 132.0868       10.32255      0.000000       0.000000      132.0868       10.32255  ?        ?        818.5765 32.47129 0.000000       32.47129 
1 1 1 -9  3  22 o 611.9238 27.01855 73.61131       6.420774      78.60218       9.096107      68.65487       9.064665  627.7495 37.48248 585.4076 40.11366 42.34186       54.90029 
1 1 1 -9  3  23 o 963.4073 31.00639 183.6176       11.60083      0.000000       0.000000      183.6176       11.60083  ?        ?        963.4073 31.00639 0.000000       31.00639 
1 1 1 -9  3  24 o 180.5815 67.47188 5.842018       6.364264      8.460113       9.078887      3.312507       8.923971  212.0884 80.30075 181.7122 75.86177 30.37625       110.4682 
1 1 1 -9  3  25 o 254.8753 76.57532 14.82010       8.190483      13.76166       9.895053      17.12335       14.59669  246.9202 85.10204 271.5496 102.0404 -24.62936      132.8706 
1 1 1 -9  3  26 o 384.3639 57.69888 31.94009       8.346728      30.70776       14.29715      32.57727       10.28055  342.0089 100.7985 377.4866 72.76543 -35.47775      124.3187 
1 1 1 -9  3  27 o 116.4250 55.55630 -7.166113      7.004035      -22.80287      10.19013      6.836308       9.642908  113.0229 56.45582 195.3269 79.93205 -82.30402      97.85905 
1 1 1 -9  3  28 f 240.9762 72.41009 14.57636       7.323294      12.57338       10.60827      16.40001       10.12222  221.4906 86.04298 245.2797 85.98569 -23.78912      121.6426 
1 1 1 -9  3  29 o 174.5659 73.83083 5.848504       8.626348      -0.3637558     15.14290      8.832993       10.49589  177.5241 83.82509 193.6657 81.64823 -16.14154      117.0174 
1 1 1 -9  3  30 o 241.5088 80.08193 17.96979       8.759327      22.38147       10.74777      9.243308       15.11597  256.3694 88.67408 190.1233 87.74494 66.24605       124.7488 
1 1 1 -9  3  31 o 183.4671 72.43211 10.51961       7.619815      7.042055       10.28419      14.75232       11.34597  166.0822 74.98891 195.5425 83.74989 -29.46031      112.4161 
1 1 1 -9  3  32 o 134.1207 61.03349 2.821088       6.975822      5.881884       9.980670      -0.1021659     9.753845  151.6125 70.43385 134.4044 64.51672 17.20819       95.51614 
1 1 1 -9  3  33 o 123.1762 57.72625 1.288350       6.947198      -1.113969      9.758597      3.757004       9.892411  126.2978 61.54614 138.0736 65.92507 -11.77581      90.18893 
1 1 1 -9  4  1  o 341.1469 20.22879 22.77524       2.668069      21.46560       3.607704      24.35621       3.963829  329.8826 28.43860 351.3801 29.31521 -21.49750      40.84281 
1 1 1 -9  4  2  o 380.9146 20.09263 28.37576       2.961784      25.13866       4.124444      31.82239       4.255834  356.8343 30.04210 402.2745 27.40498 -45.44016      40.66399 
1 1 1 -9  4  3  o 478.8043 17.72038 44.67411       3.295028      51.47975       4.677423      37.96967       4.642520  513.2976 23.46440 439.5171 27.33421 73.78049       36.02412 
1 1 1 -9  4  4  o 396.4004 20.16346 30.73969       3.093801      31.80558       4.366336      29.66499       4.384309  401.8404 28.15711 387.7791 29.33000 14.06125       40.65799 
1 1 1 -9  4  5  o 170.3054 43.35583 5.986522       2.874960      7.014345       4.014024      4.903894       4.119649  184.4664 53.13804 161.1753 54.93028 23.29109       76.42635 
1 1 1 -9  4  6  o 373.4050 25.29277 27.43816       3.646159      25.66204       4.566467      30.56229       6.056314  359.3436 33.09410 390.3161 40.54603 -30.97250      52.33736 
1 1 1 -9  4  7  o 1008.222 29.05121 199.9236       11.37492      0.000000       0.000000      199.9236       11.37492  ?        ?        1008.222 29.05121 0.000000       29.05121 
1 1 1 -9  4  8  o 195.8445 57.90641 8.023678       4.711693      8.023678       4.711693      0.000000       0.000000  195.8445 57.90641 ?        ?        0.000000       57.90641 
1 1 1 -9  4  9  o 831.1145 18.68034 134.9697       6.029393      135.1957       7.451421      134.5412       10.26126  830.4393 23.10485 824.8181 32.03424 5.621216       39.49718 
1 1 1 -9  4  10 f 485.2192 24.58891 46.35712       4.618322      49.89650       5.748617      39.91463       7.755799  501.9081 29.62378 442.5636 45.78777 59.34448       54.53520 
1 1 1 -9  4  11 o 111.7710 49.12992 -0.7441720     4.117582      -1.339433      7.144558      -0.4481243     5.038516  144.4096 64.03749 125.6662 54.81329 18.74341       84.29292 
1 1 1 -9  4  12 o 167.9062 52.81488 5.765950       3.840715      -3.451795      5.612585      13.88366       5.267049  117.4039 53.92149 255.7115 54.69319 -138.3076      76.80412 
1 1 1 -9  4  13 f 262.2679 41.04730 14.07523       4.043676      17.13083       5.701340      10.98230       5.736061  285.4826 53.38711 225.8569 63.00985 59.62578       82.58585 
1 1 1 -9  4  14 o 589.0291 21.61862 67.92325       4.945301      74.80573       7.062672      61.30315       6.926732  615.9882 29.52355 555.9550 32.22010 60.03326       43.70098 
1 1 1 -9  4  15 o 246.4607 46.33675 12.56131       4.272271      12.83523       6.082262      12.29455       6.002337  244.7745 63.45681 239.6546 63.48182 5.119904       89.75917 
1 1 1 -9  4  16 o 543.3198 24.47127 57.82825       5.163450      48.22256       7.074302      68.77992       7.553691  491.9756 37.30407 589.5031 33.12908 -97.52750      49.89117 
1 1 1 -9  4  17 o 619.3359 23.25885 75.03661       5.594259      62.72584       7.843666      87.78249       7.981077  562.2378 36.11392 668.0267 30.76378 -105.7889      47.44076 
1 1 1 -9  4  18 o 689.3792 22.51267 92.88090       6.027165      89.11324       8.465210      96.75452       8.583418  672.9321 32.39206 701.4402 31.50951 -28.50818      45.18954 
1 1 1 -9  4  19 o 311.1956 46.11991 19.68312       5.405056      16.77808       7.549769      22.73770       7.741650  280.3293 69.65591 329.4030 62.80959 -49.07373      93.79227 
1 1 1 -9  4  20 o 865.1973 20.81449 146.1763       6.993732      149.9932       9.858603      142.3094       9.922974  874.0969 29.04209 851.0956 30.02172 23.00128       41.77016 
1 1 1 -9  4  21 o 356.6805 43.19939 25.71895       5.861882      29.54528       7.978210      21.23011       8.641351  377.8997 56.06262 313.1599 72.48689 64.73984       91.63715 
1 1 1 -9  4  22 o 1001.614 29.02990 197.6583       11.29207      197.6583       11.29207      0.000000       0.000000  1001.614 29.02990 ?        ?        0.000000       29.02990 
1 1 1 -9  4  23 o 156.0119 63.90622 2.493407       6.171430      -2.277096      8.436581      7.984358       9.051241  152.7235 68.52805 210.2251 80.03849 -57.50157      105.3672 
1 1 1 -9  4  24 o 654.3348 34.08542 85.47255       8.631608      78.53165       10.21942      102.7494       16.12320  622.4152 42.53307 698.3215 60.03588 -75.90631      73.57560 
1 1 1 -9  4  25 o 269.3374 77.05598 16.70893       8.467205      18.61216       10.06684      12.10660       15.65443  280.6610 85.02380 250.0761 102.0336 30.58492       132.8153 
1 1 1 -9  4  26 o 237.9552 75.66766 13.14739       7.866022      13.70486       13.84417      12.88163       9.558879  246.8217 97.57237 236.1383 83.49019 10.68347       128.4172 
1 1 1 -9  4  27 o 216.1310 72.79213 10.99500       7.233608      7.677741       10.96462      13.55143       9.625442  203.5903 84.46526 234.2682 83.67825 -30.67790      118.8967 
1 1 1 -9  4  28 o 177.7386 72.88898 5.913519       8.039724      9.616810       14.38613      4.231647       9.694976  212.1237 92.56979 176.5746 76.53194 35.54913       120.1096 
1 1 1 -9  4  29 f 170.2937 73.54453 4.941140       8.888441      5.495942       14.64649      4.617694       11.18317  189.5278 87.06853 177.1489 79.23423 12.37888       117.7242 
1 1 1 -9  4  30 o 241.6562 98.83084 24.89451       14.73059      0.000000       0.000000      24.89451       14.73059  ?        ?        241.6562 98.83084 0.000000       98.83084 
1 1 1 -9  4  31 o 259.1127 72.90166 20.61725       7.644606      19.68377       10.28588      21.76913       11.42599  223.4979 85.26776 226.3111 88.90296 -2.813187      123.1841 
1 1 1 -9  4  32 o 93.68102 46.88559 -12.33471      7.185378      -15.10400      10.13318      -9.534061      10.19038  108.0387 54.29520 116.6062 57.95498 -8.567513      79.41504 
1 1 1 -9  5  1  o 809.6725 13.99571 127.5831       4.400808      128.6451       6.121809      126.4474       6.330818  812.1935 19.40851 805.0730 20.24867 7.120544       28.04816 
1 1 1 -9  5  2  o 362.0959 20.36742 25.66359       2.852464      28.31367       3.999919      22.92123       4.068954  379.2285 27.34296 340.2599 31.13769 38.96863       41.43903 
1 1 1 -9  5  3  o 479.7780 17.81443 44.87099       3.319253      48.21796       4.644358      41.37659       4.745542  496.5536 24.08416 458.8440 26.74730 37.70956       35.99257 
1 1 1 -9  5  4  o 439.4372 19.10545 37.67341       3.260484      40.14965       4.649944      35.27839       4.573058  451.8909 26.61385 423.2080 27.98226 28.68289       38.61740 
1 1 1 -9  5  5  o 562.2236 16.69769 61.61457       3.645806      64.99579       5.152336      58.22385       5.159569  576.4513 23.01513 545.3570 24.36153 31.09430       33.51389 
1 1 1 -9  5  6  o 97.86167 43.44792 -1.041436      3.298382      -4.808955      4.081464      6.051124       5.600023  90.53401 42.97602 180.4862 63.89413 -89.95218      77.00259 
1 1 1 -9  5  7  o 205.9189 46.03124 8.828203       3.588603      13.86782       4.471549      -0.2912906     6.015126  259.3442 46.08543 138.7281 60.20544 120.6161       75.81927 
1 1 1 -9  5  8  o 335.9016 31.45989 22.46764       4.056100      21.54907       4.964742      24.31135       7.033726  326.4211 40.00143 341.4412 54.90540 -15.02014      67.93171 
1 1 1 -9  5  9  o 1342.751 18.03007 352.1871       9.402011      348.5674       11.48050      359.5591       16.38385  1333.812 22.16350 1348.713 31.28011 -14.90125      38.33622 
1 1 1 -9  5  10 o 701.6212 20.17344 96.33003       5.496809      95.05299       6.808417      98.72079       9.315584  695.4525 25.20871 705.2873 34.01073 -9.834839      42.33449 
1 1 1 -9  5  11 o 405.6122 30.44462 32.68911       4.760686      37.26801       8.798512      30.79363       5.660933  423.1174 54.83484 391.2374 37.72558 31.88000       66.55884 
1 1 1 -9  5  12 o 325.1137 32.15078 21.11651       4.006137      20.90285       5.626508      21.33621       5.705383  318.5797 46.87873 321.8705 47.03104 -3.290802      66.40433 
1 1 1 -9  5  13 o 174.2478 63.55206 5.464697       5.587856      0.000000       0.000000      5.464697       5.587856  ?        ?        174.2478 63.55206 0.000000       63.55206 
1 1 1 -9  5  14 o 160.3615 54.48641 4.948774       4.053219      3.382448       5.791348      6.452621       5.674668  159.7682 63.12400 183.7062 64.38219 -23.93799      90.16488 
1 1 1 -9  5  15 o 370.7956 32.15456 27.31439       4.584415      33.81773       6.631322      21.36080       6.344846  409.7394 42.28165 321.2337 52.68660 88.50571       67.55453 
1 1 1 -9  5  16 o 157.3861 57.88738 4.169296       4.650074      9.337612       6.637736      -0.8117027     6.516339  213.8198 69.65532 141.9803 62.12123 71.83952       93.33226 
1 1 1 -9  5  17 o 226.9873 54.56943 10.79366       4.751043      8.743818       6.610081      12.98440       6.833465  209.0829 69.57825 247.0131 68.72459 -37.93015      97.79674 
1 1 1 -9  5  18 o 316.2837 44.11514 20.24743       5.271150      15.63231       7.417519      24.95583       7.492105  270.5781 70.04308 347.3553 57.55461 -76.77716      90.65631 
1 1 1 -9  5  19 o 650.3998 23.69635 82.71344       5.985353      87.61709       8.670650      78.24978       8.272512  666.2589 33.61897 629.4371 33.96785 36.82184       47.79173 
1 1 1 -9  5  20 o 317.3392 46.00124 20.48058       5.503911      28.56008       7.491214      11.00332       8.113370  373.2710 53.18106 232.1201 77.07754 141.1509       93.64386 
1 1 1 -9  5  21 o 490.8736 31.95390 47.71099       6.058267      48.19580       8.382835      47.18093       8.765324  488.9496 44.63901 482.6255 47.37669 6.324036       65.09371 
1 1 1 -9  5  22 f 195.3231 66.30733 7.650820       6.002650      9.370084       8.085246      5.539386       8.960056  216.8326 76.77239 196.2821 78.20979 20.55048       109.5937 
1 1 1 -9  5  23 o 221.6234 81.44942 9.710331       9.203336      0.000000       0.000000      9.710331       9.203336  ?        ?        221.6234 81.44942 0.000000       81.44942 
1 1 1 -9  5  24 o 625.2124 36.46847 78.39555       8.816253      74.00293       10.36315      89.90340       16.77365  602.6746 44.59386 645.5390 67.92703 -42.86444      81.25697 
1 1 1 -9  5  25 f 296.0233 74.15742 20.07188       8.507357      13.99701       10.06317      35.28943       15.92717  247.6498 85.79520 368.3557 105.7727 -120.7059      136.1935 
1 1 1 -9  5  26 o 201.3504 75.35358 8.352572       7.944267      -3.045322      13.47761      14.42115       9.834316  181.4991 83.43257 245.6347 84.83009 -64.13556      118.9838 
1 1 1 -9  5  27 o 235.3825 77.23658 13.66410       8.155793      8.079585       13.96384      16.55552       10.04771  213.4175 92.17452 252.6446 85.78731 -39.22711      125.9190 
1 1 1 -9  5  28 o 449.5580 53.16375 45.11795       9.102023      27.20346       16.13459      53.48043       11.02360  280.5796 106.8531 481.2036 60.31336 -200.6240      122.7000 
1 1 1 -9  5  29 o 132.2384 61.00853 -1.671154      7.297992      -9.795451      9.970960      7.703018       10.71052  128.8312 62.65329 186.6268 80.66466 -57.79565      102.1383 
1 1 1 -9  5  30 o 148.0223 67.55388 1.668605       8.624150      6.764607       10.51511      -8.803982      15.07392  173.1584 77.18449 150.3227 73.92232 22.83565       106.8735 
1 1 1 -9  5  31 f 119.7301 58.06867 -5.345495      8.410583      -0.7903269     10.33710      -14.26694      14.46653  140.2768 67.09171 132.5714 66.37534 7.705444       94.37682 
1 1 1 -9  5  32 o 154.1379 66.94550 7.366553       7.448952      10.90716       10.45879      3.721661       10.61170  165.8485 75.18513 144.3999 68.76096 21.44861       101.8866 
1 1 1 -9  6  1  o 449.5712 18.20034 39.40791       3.177649      45.48088       4.546241      33.60690       4.443277  481.5809 24.38786 413.1175 27.85770 68.46344       37.02457 
1 1 1 -9  6  2  o 310.9174 23.86897 19.01638       2.860089      19.16867       3.823683      18.82295       4.309269  310.5489 32.17136 306.5932 36.93545 3.955719       48.98188 
1 1 1 -9  6  3  o 262.6685 27.94607 13.68391       2.806952      15.05812       3.911809      12.22535       4.030091  273.4449 37.85171 244.3014 44.10047 29.14352       58.11715 
1 1 1 -9  6  4  o 431.8398 19.64897 36.40638       3.295266      37.89040       4.526534      34.73313       4.806473  438.7752 26.69097 419.3463 29.70609 19.42896       39.93570 
1 1 1 -9  6  5  o 668.0306 15.70506 86.97136       4.074401      90.43627       5.824493      83.65109       5.701619  680.0041 22.05559 653.9125 22.45177 26.09155       31.47270 
1 1 1 -9  6  6  o 132.6391 50.67501 2.572316       3.636144      4.392544       4.524538      -0.7472079     6.110113  158.1089 57.25953 137.3876 60.13167 20.72128       83.03296 
1 1 1 -9  6  7  o 360.0495 35.81554 25.95065       4.941507      25.95065       4.941507      0.000000       0.000000  360.0495 35.81554 ?        ?        0.000000       35.81554 
1 1 1 -9  6  8  o 190.3600 50.40699 7.614680       3.785291      12.25682       4.750285      -0.4606315     6.265274  241.2334 52.21959 140.0954 61.11459 101.1380       80.38582 
1 1 1 -9  6  9  o 372.1922 30.21421 27.52349       4.329538      28.71038       5.350224      25.27164       7.369451  378.1225 36.90485 346.8968 56.65878 31.22571       67.61794 
1 1 1 -9  6  10 o 98.66599 44.59769 -1.740693      3.648926      -3.794387      5.425680      -0.4475151E-01 4.930509  113.6169 52.48267 126.9468 54.79984 -13.32988      75.87788 
1 1 1 -9  6  11 o 678.4335 21.31679 90.13537       5.616387      92.35067       10.04482      89.12781       6.774255  679.4091 38.22532 673.2758 25.90840 6.133362       46.17813 
1 1 1 -9  6  12 o 397.2785 27.12466 31.19514       4.159910      44.49926       6.109092      19.69314       5.680287  472.8049 33.48772 308.4826 49.05714 164.3223       59.39722 
1 1 1 -9  6  13 o 412.5485 27.18614 33.60421       4.331214      35.86168       6.220452      31.47981       6.034311  422.8929 38.29125 395.4886 39.83061 27.40433       55.25122 
1 1 1 -9  6  14 o 387.9250 30.35156 29.81870       4.536082      22.86868       6.188861      37.88619       6.667865  333.6930 49.23606 434.5714 39.95670 -100.8784      63.40921 
1 1 1 -9  6  15 o 342.1276 34.98888 23.36040       4.583445      20.34549       6.475951      26.38653       6.488004  312.7345 55.34645 359.9471 47.57971 -47.21265      72.98670 
1 1 1 -9  6  16 o 565.3467 23.92281 62.54315       5.252367      77.37726       7.754743      49.97016       7.139303  626.1494 31.99736 501.3993 36.92418 124.7500       48.85925 
1 1 1 -9  6  17 o 433.7155 30.91245 37.15015       5.172669      36.08178       7.166157      38.31230       7.474073  423.7115 44.20066 436.5708 44.71424 -12.85928      62.87338 
1 1 1 -9  6  18 o 1170.157 18.15636 266.9475       8.250890      260.8299       11.55802      273.3048       11.78225  1154.328 25.78257 1181.649 25.67508 -27.32153      36.38614 
1 1 1 -9  6  19 o 704.3216 23.63103 96.99469       6.463707      104.4588       9.192512      89.69543       9.090466  728.6857 32.48373 673.7125 34.86367 54.97314       47.65153 
1 1 1 -9  6  20 o 205.5933 61.77747 8.767883       5.330526      5.182628       7.036716      13.59581       8.165636  183.4928 70.40199 252.4949 76.59416 -69.00215      104.0342 
1 1 1 -9  6  21 o 664.0056 26.08657 86.54338       6.726928      99.45770       9.404115      73.01131       9.626406  709.1125 34.14875 603.7274 41.30591 105.3851       53.59399 
1 1 1 -9  6  22 o 204.8484 66.44880 8.727222       6.043191      13.87845       8.442933      3.315605       8.653690  251.5215 78.17490 181.5249 75.15194 69.99658       108.4395 
1 1 1 -9  6  23 o 364.4268 49.74197 27.51709       6.855955      33.47848       9.581515      21.26259       9.814241  394.6460 64.76433 305.0823 81.34653 89.56363       103.9792 
1 1 1 -9  6  24 f 197.6425 74.85400 7.164743       7.890537      9.004073       9.547554      3.201536       14.01476  216.6141 82.26741 211.2176 91.78143 5.396515       123.2548 
1 1 1 -9  6  25 o 415.3813 70.66245 38.56734       10.99071      38.56734       10.99071      0.000000       0.000000  415.3813 70.66245 ?        ?        0.000000       70.66245 
1 1 1 -9  6  26 o 324.1862 69.43661 24.24011       8.478606      38.07996       15.13287      17.90787       10.23609  376.0238 101.3369 267.6924 86.44435 108.3314       133.1983 
1 1 1 -9  6  27 o 387.3024 103.4590 43.61258       15.85635      43.61258       15.85635      0.000000       0.000000  387.3024 103.4590 ?        ?        0.000000       103.4590 
1 1 1 -9  6  28 o 130.4603 62.21137 -6.602486      8.751351      -21.58787      15.01433      1.108090       10.76999  142.5859 70.77829 167.4935 76.07199 -24.90764      103.9063 
1 1 1 -9  6  29 o 91.33408 45.98135 -18.79542      7.438179      -11.07429      10.30388      -27.19734      10.74855  127.6752 62.43830 106.1344 53.65606 21.54075       82.32566 
1 1 1 -9  6  30 o 215.2159 78.40797 14.86887       8.502278      7.797445       10.37649      29.31614       14.83166  175.0631 77.42444 252.6288 100.6357 -77.56575      126.9727 
1 1 1 -9  6  31 o 208.7287 77.34695 15.71732       8.329559      18.28146       10.25425      10.74349       14.28164  210.2861 83.70610 172.8694 81.55959 37.41675       116.8703 
1 1 1 -9  6  32 o 119.7075 56.77797 -0.7025052     7.095514      1.447325       10.02198      -2.863178      10.04722  136.3825 65.44801 126.7573 61.91887 9.625259       90.09654 
1 1 1 -9  7  1  o 393.5765 19.98438 30.31785       3.044532      30.57074       4.164292      30.02746       4.462384  393.8629 27.39553 389.8288 29.69921 4.034088       40.40493 
1 1 1 -9  7  2  o 259.7349 28.98476 13.41079       2.873807      12.27293       4.001562      14.62275       4.129827  244.7676 43.69990 268.4742 40.90217 -23.70660      59.85540 
1 1 1 -9  7  3  o 504.8285 17.40384 49.70208       3.412061      53.59552       4.920616      46.09612       4.735475  523.1667 24.21873 484.3681 25.26197 38.79855       34.99591 
1 1 1 -9  7  4  o 762.8984 15.01392 113.3967       4.448246      115.0628       6.240413      111.6756       6.342365  767.2588 20.94322 755.7210 21.61035 11.53778       30.09362 
1 1 1 -9  7  5  o 597.1829 19.56931 69.66679       4.538485      71.09883       5.610774      66.95642       7.718989  602.3829 23.98403 580.8716 34.37076 21.51129       41.91161 
1 1 1 -9  7  6  o 362.5444 33.43968 26.20212       4.655097      26.20212       4.655097      0.000000       0.000000  362.5444 33.43968 ?        ?        0.000000       33.43968 
1 1 1 -9  7  7  o 447.9954 30.13033 39.75458       5.211625      39.75458       5.211625      0.000000       0.000000  447.9954 30.13033 ?        ?        0.000000       30.13033 
1 1 1 -9  7  8  o 329.5414 32.04343 21.66658       4.049018      20.62144       4.987836      23.68623       6.933660  318.6367 41.27784 336.5957 54.93823 -17.95908      68.71732 
1 1 1 -9  7  9  f 178.9725 53.64337 6.654070       4.022944      6.205041       5.012976      7.466414       6.742623  177.6760 60.59379 196.6969 70.05894 -19.02098      92.62755 
1 1 1 -9  7  10 o 306.1328 37.62599 18.92576       4.379111      16.38852       7.917282      20.04411       5.256343  272.5027 73.23967 312.8783 44.51464 -40.37558      85.70649 
1 1 1 -9  7  11 o 445.8929 27.46721 39.27037       4.733196      35.50677       8.383808      41.03117       5.734500  414.3097 53.34525 454.2308 32.72734 -39.92114      62.58430 
1 1 1 -9  7  12 o 668.6522 19.12342 87.35615       4.965853      83.14931       7.024406      91.55909       7.021147  650.1117 27.82234 682.6128 26.48535 -32.50110      38.41297 
1 1 1 -9  7  13 o 144.7761 53.90112 3.403860       4.054506      -0.7582702     5.617732      7.929113       5.857666  131.6122 57.62954 198.0600 65.47901 -66.44785      87.22765 
1 1 1 -9  7  14 o 291.8884 39.12450 17.19475       4.323388      25.39521       6.277358      9.794735       5.963126  353.1764 46.92949 216.2186 65.42394 136.9578       80.51503 
1 1 1 -9  7  15 o 448.2899 27.64657 39.57711       4.789651      38.09584       6.764030      41.06678       6.783189  436.3395 40.37420 453.6344 38.87917 -17.29489      56.05057 
1 1 1 -9  7  16 o 428.0545 30.79299 36.19302       5.084726      33.62854       7.154561      38.81026       7.227775  408.2829 45.91934 439.9566 42.84628 -31.67368      62.80437 
1 1 1 -9  7  17 o 506.5961 27.44649 50.43446       5.379641      48.31299       7.573399      52.59510       7.643001  492.5153 39.93922 514.4409 38.53606 -21.92554      55.49927 
1 1 1 -9  7  18 o 176.5445 61.10629 5.826930       5.104265      4.148643       7.196994      7.525449       7.240243  178.4097 70.40704 202.6708 72.55432 -24.26111      101.1003 
1 1 1 -9  7  19 o 211.8666 62.97734 9.320242       5.561803      6.378684       7.677017      12.56965       8.068749  196.5150 73.97090 244.7880 76.47895 -48.27304      106.3989 
1 1 1 -9  7  20 f 815.3162 22.68075 130.0242       7.181440      138.4588       10.28977      122.0141       10.02748  838.4773 31.59996 786.6757 32.82225 51.80157       45.56158 
1 1 1 -9  7  21 o 323.9032 49.47561 21.62232       6.026058      19.04947       8.575711      24.13187       8.469545  294.3108 74.85590 335.0912 67.41832 -40.78043      100.7404 
1 1 1 -9  7  22 o 234.8832 65.77090 11.96102       6.237703      18.86638       8.928799      5.378059       8.717873  290.1720 77.68873 193.1530 77.08810 97.01900       109.4446 
1 1 1 -9  7  23 o 437.7495 40.74805 38.80144       6.847680      30.05594       9.268872      49.31066       10.16061  372.2812 66.55304 486.3647 54.74524 -114.0835      86.17626 
1 1 1 -9  7  24 o 163.9288 70.39197 1.274970       8.052604      -7.907198      9.425432      26.08967       15.49470  141.1015 66.47571 320.4178 106.5227 -179.3163      125.5631 
1 1 1 -9  7  25 o 389.2886 49.13159 31.78879       7.262387      29.88297       10.22619      33.72807       10.31553  360.0755 75.53976 386.3216 71.38618 -26.24612      103.9338 
1 1 1 -9  7  26 o 312.0441 67.56051 22.48212       7.949993      41.27114       12.92277      11.04125       10.08400  409.5442 84.06718 221.4009 84.43658 188.1433       119.1504 
1 1 1 -9  7  27 o 157.9216 72.76127 -2.188788      10.33075      0.000000       0.000000      -2.188788      10.33075  ?        ?        157.9216 72.76127 0.000000       72.76127 
1 1 1 -9  7  28 f 173.1991 73.84553 5.125214       8.749358      -23.30777      15.70671      17.91739       10.53528  142.8296 71.14466 246.5065 87.59753 -103.6769      112.8490 
1 1 1 -9  7  29 o 127.8247 59.57571 -2.321563      7.233768      -8.008011      10.44404      2.921675       10.02878  134.0262 64.93254 162.6569 73.69109 -28.63071      98.21716 
1 1 1 -9  7  30 o 193.0125 75.43359 11.69340       8.191423      14.75120       10.14981      5.981247       13.87246  204.2736 82.59475 171.6984 80.81639 32.57524       115.5560 
1 1 1 -9  7  31 o 169.2055 72.01883 9.417591       8.295906      20.92131       10.32660      -11.51792      13.93092  220.9627 85.15643 131.3923 65.68813 89.57043       107.5479 
1 1 1 -9  7  32 o 246.1758 72.28932 20.92591       7.365333      19.38810       10.38130      22.48455       10.45136  197.4349 82.07243 212.5686 84.54078 -15.13377      117.8263 
1 1 1 -9  8  1  o 311.3885 27.75176 19.18177       3.320819      18.13816       4.030911      21.38633       5.858633  301.0407 35.13989 323.3721 48.11768 -22.33133      59.58291 
1 1 1 -9  8  2  o 538.3936 19.35085 56.59663       4.046019      61.82418       5.002081      46.70403       6.881082  562.0880 22.91492 484.2812 36.86422 77.80679       43.40581 
1 1 1 -9  8  3  o 634.1545 18.26101 78.48518       4.497258      81.03201       5.474139      73.19710       7.887962  643.6493 21.89972 607.9070 33.54157 35.74231       40.05789 
1 1 1 -9  8  4  o 586.8909 19.08256 67.26698       4.349326      68.09809       5.337749      65.62499       7.502612  589.6771 23.30858 575.2687 33.73001 14.40833       41.00005 
1 1 1 -9  8  5  o 139.6122 49.46811 3.493554       3.357460      9.626201       4.087304      -9.229410      5.887178  214.2497 50.03049 100.5120 48.70908 113.7377       69.82567 
1 1 1 -9  8  6  o 373.9144 33.82112 27.88642       4.858047      27.88642       4.858047      0.000000       0.000000  373.9144 33.82112 ?        ?        0.000000       33.82112 
1 1 1 -9  8  7  o 629.7308 20.52310 77.56795       5.019101      77.32134       6.081285      78.09483       8.888986  627.6377 24.94930 625.8643 36.73258 1.773438       44.40439 
1 1 1 -9  8  8  o 493.5302 20.68770 47.65427       3.965099      41.97642       5.358372      54.52621       5.894949  460.3241 30.14017 525.2489 29.01175 -64.92480      41.83433 
1 1 1 -9  8  9  o 376.9576 25.89549 28.04645       3.767928      21.49360       5.437684      34.09888       5.225931  324.4316 44.31725 413.9116 32.77894 -89.47998      55.12239 
1 1 1 -9  8  10 o 112.6087 49.15310 -0.5326957     4.058145      -2.532247      7.265073      0.3741398      4.892581  140.9039 63.37859 129.4495 55.20743 11.45441       84.05180 
1 1 1 -9  8  11 o 397.7904 31.53102 31.42105       4.831120      49.19260       9.884866      25.84383       5.537544  489.6128 52.82315 357.8391 40.56416 131.7736       66.60132 
1 1 1 -9  8  12 o 399.3253 27.12338 31.46314       4.181345      36.91218       6.012072      26.35799       5.819271  430.0922 36.33442 361.1071 42.29712 68.98502       55.76052 
1 1 1 -9  8  13 o 691.3954 19.21533 93.32790       5.159437      89.04673       7.095675      98.13065       7.515501  673.5410 27.12699 706.9929 27.37253 -33.45184      38.53737 
1 1 1 -9  8  14 o 395.7372 29.93988 30.95378       4.567298      34.25251       6.403952      27.53886       6.515769  413.5420 40.39063 368.4800 46.57273 45.06198       61.64756 
1 1 1 -9  8  15 o 1042.774 17.80171 212.0112       7.209079      209.2420       10.10658      214.8796       10.28615  1033.829 25.17256 1047.627 25.28240 -13.79724      35.67712 
1 1 1 -9  8  16 o 258.7139 50.46871 13.82340       4.888638      18.77099       6.911014      8.868452       6.916143  299.1508 61.54073 211.7793 71.17761 87.37158       94.09312 
1 1 1 -9  8  17 o 392.7144 35.72318 30.63442       5.388647      32.39436       7.648436      28.89979       7.593258  399.6590 50.39886 376.1512 53.48675 23.50778       73.49067 
1 1 1 -9  8  18 o 728.2368 23.39404 103.6548       6.616158      107.2536       9.474708      100.2299       9.242916  738.3757 33.04155 713.7035 33.34750 24.67218       46.94464 
1 1 1 -9  8  19 o 158.2697 62.20837 3.256017       5.597377      -7.781492      7.577879      16.50876       8.303575  125.8018 59.37053 276.7224 75.27125 -150.9206      95.86772 
1 1 1 -9  8  20 o 754.9832 24.09791 111.6528       7.065527      101.6709       9.642450      123.2266       10.38292  717.1307 34.62271 789.8102 33.85077 -72.67950      48.42115 
1 1 1 -9  8  21 o 473.6931 34.85476 44.71932       6.366867      44.52535       8.494612      44.96797       9.617862  467.6352 47.43069 466.8315 54.05039 0.8037415      71.91047 
1 1 1 -9  8  22 o 426.0030 40.38065 36.65761       6.600789      26.27493       9.073646      48.32866       9.620158  346.7740 69.79242 483.8703 52.01125 -137.0963      87.04109 
1 1 1 -9  8  23 o 831.1069 29.79090 136.6927       9.615426      119.4680       11.04219      190.7255       19.55723  773.1867 36.77417 961.6479 52.56677 -188.4612      64.15298 
1 1 1 -9  8  24 o 329.8967 65.69572 23.97555       8.120961      20.72866       9.218346      35.22915       17.16189  299.3313 78.37605 364.8135 111.1247 -65.48221      135.9835 
1 1 1 -9  8  25 o 236.6622 71.92435 12.88772       7.195438      20.32950       9.886982      4.507792       10.49169  289.2975 83.41396 192.4807 81.41619 96.81674       116.5611 
1 1 1 -9  8  26 o 169.0483 71.81599 3.230611       8.220873      -1.980877      13.03768      6.670186       10.59185  178.0313 81.92023 197.8807 82.63273 -19.84941      116.3576 
1 1 1 -9  8  27 o 332.9397 81.96786 29.06087       10.52746      0.000000       0.000000      29.06087       10.52746  ?        ?        332.9397 81.96786 0.000000       81.96786 
1 1 1 -9  8  28 o 103.0040 50.70860 -11.49917      7.158536      -18.38678      10.07124      -4.466156      10.17699  114.5564 57.04644 144.4559 68.36598 -29.89954      89.04047 
1 1 1 -9  8  29 o 127.3379 59.27888 -1.950875      7.128290      0.8506101      9.820173      -5.071003      10.36361  152.8561 70.60789 138.9754 66.65567 13.88069       97.10022 
1 1 1 -9  8  30 o 128.6726 61.33060 -2.809329      8.484793      -5.819496      10.14368      4.203286       15.48246  130.1792 63.28219 166.9071 80.41560 -36.72784      102.3294 
1 1 1 -9  8  31 o 93.64780 47.22780 -16.79420      8.036119      -18.65491      9.566851      -12.33468      14.81061  101.1613 51.07971 131.5033 66.02621 -30.34198      83.47813 
1 1 1 -9  8  32 o 161.0750 69.61612 9.694819       7.976422      21.44101       13.90279      3.931227       9.738677  182.3521 84.15551 140.0166 66.44175 42.33549       107.2225 
1 1 1 -9  9  1  o 527.1506 19.43860 54.26107       3.979491      53.97369       4.877825      54.83302       6.881511  525.0022 23.92418 525.9202 33.87287 -0.9180298     41.46972 
1 1 1 -9  9  2  o 114.1422 46.09710 1.246791       3.157522      5.928690       3.951196      -7.026556      5.252405  171.1485 53.52601 99.24908 47.56246 71.89947       71.60462 
1 1 1 -9  9  3  o 273.4070 32.85035 14.95928       3.418183      14.98297       4.226280      14.91447       5.812307  271.3224 41.42233 265.6074 57.97559 5.715088       71.25292 
1 1 1 -9  9  4  o 462.3119 21.62121 41.81283       3.881889      36.13737       4.598906      55.87725       7.239600  427.8808 27.82730 530.0386 35.37371 -102.1579      45.00731 
1 1 1 -9  9  5  o 467.4331 22.84335 42.79020       4.146745      44.36024       5.018783      39.41242       7.361381  474.2973 27.36326 441.7901 43.46856 32.50723       51.36403 
1 1 1 -9  9  6  o 687.2919 19.04587 92.28132       5.083585      91.29497       6.051013      94.64766       9.372415  682.7100 22.82253 690.2405 35.07954 -7.530457      41.85023 
1 1 1 -9  9  7  o 352.6190 26.29003 24.55702       3.574309      28.04551       5.182604      21.39252       4.936076  374.3151 36.09950 325.3288 39.90565 48.98636       53.81110 
1 1 1 -9  9  8  o 228.7534 39.03386 10.69067       3.343226      9.885269       4.724841      11.49825       4.731237  215.9920 55.89721 233.4736 53.34727 -17.48163      77.26855 
1 1 1 -9  9  9  o 110.4972 46.51862 0.4593837      3.399233      -5.211307      4.851803      5.926420       4.763884  100.1939 47.35272 174.2626 59.07092 -74.06867      75.70769 
1 1 1 -9  9  10 o 126.6485 52.43295 1.115044       4.212404      -2.959147      7.912881      2.726251       4.976108  146.2138 65.91996 147.5668 58.44617 -1.352997      88.09879 
1 1 1 -9  9  11 o 691.9396 18.92282 93.47961       5.084896      91.02602       7.395218      95.67988       7.003055  680.5935 27.97919 698.3908 25.82028 -17.79730      38.07259 
1 1 1 -9  9  12 o 250.8231 43.26348 12.87228       4.061983      10.16403       5.880013      15.34452       5.617966  219.7815 64.60497 270.7662 55.29613 -50.98473      85.03802 
1 1 1 -9  9  13 o 530.8710 23.52772 55.13344       4.850615      58.45855       6.898730      51.88234       6.821532  543.7926 32.82071 511.6877 34.53003 32.10492       47.63950 
1 1 1 -9  9  14 o 79.33540 39.13411 -9.268785      4.334818      -10.33236      6.140748      -8.212379      6.120021  101.0751 49.15804 107.0968 51.32786 -6.021683      71.07082 
1 1 1 -9  9  15 o 187.6657 58.25518 7.130869       4.690088      15.99332       6.730897      -1.233056      6.538845  275.0836 64.17994 140.6531 61.86667 134.4305       89.14342 
1 1 1 -9  9  16 o 481.1609 28.70453 45.53954       5.339330      44.60186       7.520550      46.49252       7.581727  472.9178 41.36437 483.0765 40.79483 -10.15875      58.09673 
1 1 1 -9  9  17 o 1108.250 18.64707 239.4531       8.025573      242.7726       11.21204      235.9651       11.49292  1113.822 25.92034 1097.748 26.95875 16.07385       37.39837 
1 1 1 -9  9  18 o 1049.710 27.66373 215.9712       11.27737      215.9712       11.27737      0.000000       0.000000  1049.710 27.66373 ?        ?        0.000000       27.66373 
1 1 1 -9  9  19 o 324.3499 47.31818 21.45548       5.784840      20.14573       8.000840      22.89021       8.373903  306.7948 68.84394 327.7751 68.01286 -20.98032      96.77415 
1 1 1 -9  9  20 o 635.6489 27.59261 79.41699       6.811425      74.30587       9.556460      84.69477       9.711018  609.3336 40.61717 651.6409 38.54466 -42.30725      55.99504 
1 1 1 -9  9  21 o 285.6130 58.26049 17.33801       6.243261      16.29296       8.699575      18.44782       8.965015  270.6997 78.30090 287.4165 78.22493 -16.71680      110.6805 
1 1 1 -9  9  22 o 247.7196 67.42606 13.45080       6.660337      13.14163       9.051012      13.81592       9.836178  245.1272 81.41026 250.9090 84.88103 -5.781799      117.6113 
1 1 1 -9  9  23 o 206.1661 74.88568 8.435680       7.747161      6.970812       8.855806      13.21213       15.99121  201.4588 78.51661 259.0685 104.0503 -57.60971      130.3508 
1 1 1 -9  9  24 o 174.7262 75.77543 1.444081       9.515462      1.444081       9.515462      0.000000       0.000000  174.7262 75.77543 ?        ?        0.000000       75.77543 
1 1 1 -9  9  25 o 431.1400 44.43266 38.71001       7.332987      45.09868       10.23828      31.98055       10.50779  454.2182 59.46935 368.8639 75.88490 85.35431       96.41122 
1 1 1 -9  9  26 o 167.9458 71.04857 3.540727       7.991628      -3.711917      12.51073      8.540047       10.38700  168.4278 78.44901 204.2666 83.20185 -35.83884      114.3538 
1 1 1 -9  9  27 f 423.0795 70.69226 43.81015       11.20524      0.000000       0.000000      43.81015       11.20524  ?        ?        423.0795 70.69226 0.000000       70.69226 
1 1 1 -9  9  28 o 365.9391 56.06974 31.36166       7.714358      23.95897       10.84188      38.95268       10.97892  277.5615 88.89597 381.7708 76.71262 -104.2093      117.4194 
1 1 1 -9  9  29 o 143.4171 63.42051 2.471003       6.960171      -7.781563      9.704774      13.32998       9.987657  127.3054 61.88813 203.1525 82.00561 -75.84710      102.7378 
1 1 1 -9  9  30 o 103.8453 51.78796 -13.37113      8.427675      -8.398530      10.14712      -24.42941      15.13194  123.3866 60.67130 124.6574 63.09523 -1.270790      87.53294 
1 1 1 -9  9  31 o 129.1897 62.64724 -2.149590      9.779380      17.32689       12.84599      -28.99555      15.08175  183.4746 83.23418 115.3492 58.83012 68.12543       101.9260 
1 1 1 -9  10 1  o 85.69255 39.33942 -2.072029      2.982841      -2.150593      3.620731      -1.906086      5.262155  96.23242 43.86121 121.3137 54.29954 -25.08124      69.80148 
1 1 1 -9  10 2  o 1187.802 14.62456 274.8347       6.746133      284.2381       9.737369      266.1552       9.355058  1205.993 20.79069 1167.054 20.64084 38.93848       29.29671 
1 1 1 -9  10 3  f 188.2267 42.48798 7.335938       3.032178      10.18076       4.390648      4.742085       4.192506  220.2553 52.13908 159.3932 55.36843 60.86209       76.05358 
1 1 1 -9  10 4  o 653.8719 16.37295 83.36739       4.157648      85.78649       5.835371      80.87318       5.925263  662.0212 22.69701 642.5414 23.74535 19.47974       32.84807 
1 1 1 -9  10 5  f 812.6970 17.81338 128.8950       5.622156      135.1645       6.933190      116.8558       9.607593  831.2836 21.47613 769.4744 32.15085 61.80920       38.66395 
1 1 1 -9  10 6  o 896.9321 17.82519 157.0050       6.209002      159.8404       7.665221      151.5947       10.58836  903.8538 21.83728 876.8363 31.09441 27.01752       37.99644 
1 1 1 -9  10 7  f 444.6815 29.98726 39.11597       5.148374      39.11597       5.148374      0.000000       0.000000  444.6815 29.98726 ?        ?        0.000000       29.98726 
1 1 1 -9  10 8  o 107.8568 45.24306 0.4900007      3.196555      2.657256       4.723235      -1.341525      4.342011  144.6028 57.04640 111.8084 49.73485 32.79437       75.68254 
1 1 1 -9  10 9  o 193.1926 47.30036 7.779905       3.520325      1.791717       5.054550      13.42075       4.905766  141.5472 57.89125 253.6609 51.55690 -112.1137      77.52103 
1 1 1 -9  10 10 o 463.2776 27.63299 42.28447       4.948984      41.29747       8.936986      42.72100       5.943488  449.6942 52.14112 464.2078 33.18749 -14.51358      61.80701 
1 1 1 -9  10 11 o 772.5975 17.79853 116.4149       5.340299      106.5150       7.450508      126.8752       7.658432  737.1843 26.02446 804.9880 24.49754 -67.80365      35.74076 
1 1 1 -9  10 12 o 442.2354 26.52079 38.45892       4.533754      36.53242       6.626072      40.15481       6.216866  427.4273 40.39665 449.6059 35.90452 -22.17856      54.04650 
1 1 1 -9  10 13 o 249.1758 46.30575 12.74417       4.315991      10.87865       6.215961      14.48079       5.997372  227.7921 66.27278 262.3704 60.14484 -34.57831      89.49572 
1 1 1 -9  10 14 o 649.1469 21.58171 82.27660       5.440726      79.17666       7.672130      85.41270       7.716762  634.9222 31.11483 659.6874 30.12097 -24.76520      43.30595 
1 1 1 -9  10 15 o 959.7582 18.72067 179.5766       6.977683      185.7712       10.02041      173.7451       9.722210  974.2365 26.48459 942.1501 26.57155 32.08636       37.51641 
1 1 1 -9  10 16 o 317.7382 42.29360 20.32536       5.089183      20.60952       7.177385      20.03805       7.217165  314.4805 60.96933 309.6154 62.18217 4.865143       87.08548 
1 1 1 -9  10 17 o 776.9226 21.92107 117.8662       6.614052      109.2113       9.050776      127.7850       9.689189  745.7043 31.25296 806.7216 30.92685 -61.01727      43.96837 
1 1 1 -9  10 18 o 119.6374 54.32383 -2.886360      5.488023      7.037831       7.585170      -13.78862      7.950162  200.4861 73.90359 113.4399 55.33984 87.04613       92.32681 
1 1 1 -9  10 19 o 647.7375 26.79424 82.34071       6.740134      103.8480       9.665134      61.97902       9.404199  724.9739 34.32872 555.4471 43.95551 169.5268       55.77228 
1 1 1 -9  10 20 o 729.6179 25.77893 104.5379       7.304465      112.2022       10.23267      96.57478       10.43031  752.3409 35.02243 695.3903 38.77688 56.95068       52.25148 
1 1 1 -9  10 21 f 200.9842 68.04655 8.223729       6.321508      16.64124       8.630877      -1.517663      9.284825  272.9963 77.69156 163.7424 72.78722 109.2539       106.4611 
1 1 1 -9  10 22 o 311.3433 58.73409 20.69804       6.841228      22.01517       9.004617      18.89981       10.52142  313.4184 74.98492 286.0975 86.97850 27.32092       114.8390 
1 1 1 -9  10 23 o 171.6137 71.85529 2.781967       8.039384      1.634381       9.273358      6.253798       16.12960  175.0808 75.36691 231.0823 99.43575 -56.00148      124.7703 
1 1 1 -9  10 24 o 188.6616 70.57917 6.874763       6.968217      22.20057       9.989062      -7.652446      9.725325  304.3960 82.45767 142.9284 67.39378 161.4676       106.4950 
1 1 1 -9  10 25 f 527.7377 37.96393 57.06463       7.728690      58.71249       10.30964      54.95039       11.67781  524.3522 51.28477 497.3641 61.79019 26.98807       80.30040 
1 1 1 -9  10 26 o 177.0061 77.69319 3.134635       10.26470      0.000000       0.000000      3.134635       10.26470  ?        ?        177.0061 77.69319 0.000000       77.69319 
1 1 1 -9  10 27 o 227.0246 87.88302 14.72287       11.03670      0.000000       0.000000      14.72287       11.03670  ?        ?        227.0246 87.88302 0.000000       87.88302 
1 1 1 -9  10 28 o 241.8237 70.29311 15.78137       6.995751      4.542700       9.383327      29.84628       10.49707  167.1742 73.79614 318.0947 83.80287 -150.9205      111.6637 
1 1 1 -9  10 29 o 110.9162 54.40042 -9.281449      7.995308      6.310052       13.73935      -17.26484      9.831418  173.8669 81.38604 109.5956 54.84945 64.27134       98.14352 
1 1 1 -9  10 30 o 232.6150 77.34791 18.84745       8.169365      17.43725       9.903231      21.85090       14.45264  207.5800 82.37686 202.7336 90.41939 4.846359       122.3177 
1 1 1 -9  10 31 o 128.1071 60.88182 0.2439550      8.237091      1.102956       9.790718      -1.836947      15.23855  135.5047 64.93702 141.7573 70.52306 -6.252579      95.86615 
1 1 1 -9  11 1  o 474.4237 24.11247 44.16410       4.427973      46.22253       6.031483      41.75771       6.521369  483.4143 32.31362 458.0552 36.97517 25.35913       49.10533 
1 1 1 -9  11 2  o 477.8690 20.37313 44.60120       3.780894      44.02783       4.501699      45.97412       6.965923  473.5449 24.56300 480.4314 37.63622 -6.886444      44.94247 
1 1 1 -9  11 3  o 490.1755 19.05640 46.89896       3.627610      50.01435       5.152148      43.83607       5.108560  504.3236 26.39755 471.6763 28.01432 32.64731       38.49198 
1 1 1 -9  11 4  o 111.3228 45.47761 1.001650       3.114778      1.776678       4.431390      0.2448398      4.379000  134.6701 54.53176 122.6753 52.27176 11.99480       75.53840 
1 1 1 -9  11 5  o 146.5933 50.63595 3.983978       3.504066      4.202223       4.198306      3.482843       6.361790  154.0800 55.23941 166.0568 65.98486 -11.97682      86.05460 
1 1 1 -9  11 6  o 605.9695 19.84761 71.71288       4.670754      73.56883       5.797943      68.28165       7.883451  612.8715 24.35996 586.8588 34.74506 26.01263       42.43379 
1 1 1 -9  11 7  o 601.8566 18.32915 70.67679       4.284137      66.00651       5.916409      75.82497       6.211744  580.1658 26.25900 621.9448 25.71779 -41.77899      36.75513 
1 1 1 -9  11 8  o 566.9739 19.59514 62.75909       4.314589      64.32655       6.077810      61.16671       6.125975  572.5496 27.33418 557.3836 28.39449 15.16595       39.41325 
1 1 1 -9  11 9  o 302.9604 38.55713 18.45534       4.433677      24.70443       8.325191      15.98126       5.238330  342.1419 65.03286 278.2540 50.32824 63.88788       82.23263 
1 1 1 -9  11 10 o 768.9575 20.51182 115.4443       6.125401      112.4379       10.81735      116.8633       7.431675  754.2928 36.92777 772.7071 24.76531 -18.41431      44.46325 
1 1 1 -9  11 11 o 536.5270 22.64276 56.25472       4.717903      62.30386       6.831780      50.73978       6.523158  562.1375 31.41992 506.6179 33.34133 55.51965       45.81327 
1 1 1 -9  11 12 o 142.1629 53.43280 3.099087       4.002891      4.723266       5.872939      1.689943       5.470361  172.2577 64.72594 146.0798 60.04039 26.17787       88.28532 
1 1 1 -9  11 13 o 301.3067 40.70815 18.26811       4.641462      17.16504       6.571617      19.36610       6.556447  286.3018 60.97276 305.6108 57.34872 -19.30902      83.70516 
1 1 1 -9  11 14 o 457.9452 28.71269 41.24928       5.080579      41.23078       7.308816      41.26657       7.067316  454.6044 41.86913 455.2195 40.39627 -0.6151123     58.17974 
1 1 1 -9  11 15 o 589.4030 24.22287 67.88738       5.544545      64.34985       7.820345      71.46284       7.862163  570.7213 35.45907 602.0156 33.76468 -31.29431      48.96324 
1 1 1 -9  11 16 o 394.7407 35.62982 30.92708       5.403147      35.05201       7.680327      26.88515       7.602674  416.8575 48.33934 362.0198 55.87468 54.83771       73.88282 
1 1 1 -9  11 17 o 663.9705 24.65919 86.23941       6.358514      92.36742       8.899520      79.84904       9.088037  685.0396 33.45207 634.9500 37.01604 50.08960       49.89217 
1 1 1 -9  11 18 o 250.9759 58.91785 13.29833       5.644242      13.73285       7.949158      12.85651       8.015583  253.2623 75.29175 246.1531 76.11561 7.109116       107.0628 
1 1 1 -9  11 19 o 446.2475 37.08926 39.76994       6.369407      53.13277       9.115400      27.02049       8.903732  512.5223 46.29659 355.7893 66.89497 156.7329       81.35300 
1 1 1 -9  11 20 o 759.6626 25.28506 113.3410       7.459551      121.6455       10.43482      104.6614       10.66784  783.2808 34.30357 723.8948 38.08050 59.38593       51.25290 
1 1 1 -9  11 21 o 437.8956 39.71994 38.66726       6.681217      30.26392       9.093225      48.52621       9.849341  375.6092 64.67146 484.2084 53.25800 -108.5992      83.77835 
1 1 1 -9  11 22 o 306.7484 68.95671 20.80196       8.014872      11.84950       9.237606      48.06362       16.11997  235.0016 82.15598 449.7530 95.25587 -214.7513      125.7906 
1 1 1 -9  11 23 o 390.1203 47.60250 31.61761       7.062437      40.04276       10.37533      24.34333       9.640676  429.0370 64.24678 324.8256 77.50475 104.2114       100.6709 
1 1 1 -9  11 24 o 432.3760 44.57143 38.86710       7.376911      44.55792       10.15332      32.50425       10.73611  452.4444 59.20535 372.1267 76.83504 80.31766       96.99947 
1 1 1 -9  11 25 o 251.7739 69.93249 15.16341       7.081975      14.23881       10.02516      16.08443       10.00572  238.0723 85.35969 250.3159 85.60488 -12.24361      120.8903 
1 1 1 -9  11 26 o 487.9435 59.43359 54.38886       11.02969      0.000000       0.000000      54.38886       11.02969  ?        ?        487.9435 59.43359 0.000000       59.43359 
1 1 1 -9  11 27 o 199.1758 75.46168 10.25933       8.020982      7.335135       13.20278      11.96997       10.09814  193.0755 86.24394 209.0444 83.11229 -15.96887      119.7734 
1 1 1 -9  11 28 o 124.0741 59.17831 -4.778946      7.927424      -18.52304      13.57147      2.339307       9.766874  131.9437 65.78764 157.5701 71.90311 -25.62637      97.45805 
1 1 1 -9  11 29 o 208.1027 70.56065 13.17031       6.797355      9.649839       10.08211      16.10403       9.203658  177.4015 77.45392 213.1653 80.81655 -35.76378      111.9394 
1 1 1 -9  11 30 o 176.9888 72.69084 10.98296       8.011082      16.38231       9.932940      0.9349021      13.55028  197.3062 80.97771 148.2028 72.28721 49.10336       108.5487 
1 1 1 -9  12 1  o 458.7432 20.87733 41.08377       3.719398      39.28107       4.517548      44.87707       6.553151  447.1448 26.12886 475.7267 35.73130 -28.58194      44.26559 
1 1 1 -9  12 2  o 305.4392 35.43866 18.63790       4.125567      16.24085       5.429058      21.91374       6.346692  280.4363 51.75639 326.8503 51.72150 -46.41403      73.16992 
1 1 1 -9  12 3  f 546.4418 19.66660 58.27071       4.173507      53.75871       4.935525      69.59298       7.818359  524.1829 24.24502 593.2960 34.07553 -69.11316      41.82060 
1 1 1 -9  12 4  o 672.6641 16.99121 88.19193       4.438646      80.04140       6.021244      97.89233       6.568828  639.5849 24.24153 707.3917 23.91112 -67.80682      34.04987 
1 1 1 -9  12 5  o 362.4084 29.09187 25.94660       4.059963      22.80495       4.853682      33.26607       7.408532  337.5981 37.66253 405.2533 48.00685 -67.65521      61.01740 
1 1 1 -9  12 6  o 774.1308 18.80488 116.9016       5.653441      120.2035       6.894321      110.1236       9.877710  784.1812 22.63847 747.4705 34.02783 36.71063       40.87045 
1 1 1 -9  12 7  o 545.2670 20.08566 58.02925       4.253273      64.14026       6.087322      52.20013       5.945268  571.9987 27.40332 514.7253 29.87029 57.27332       40.53611 
1 1 1 -9  12 8  o 396.0434 25.68705 30.83304       3.929481      34.21909       5.559389      27.45250       5.554865  415.2776 34.79215 370.5207 39.19931 44.75684       52.41259 
1 1 1 -9  12 9  o 1542.747 19.29817 464.2344       11.56216      468.8125       20.31723      462.0416       14.06107  1543.142 33.90242 1537.416 23.55045 5.726318       41.27951 
1 1 1 -9  12 10 o 656.7811 22.37154 84.25145       5.706166      86.13432       10.39003      83.43828       6.828062  658.4318 40.83434 652.7492 26.93538 5.682617       48.91787 
1 1 1 -9  12 11 o 183.2543 52.89993 6.885966       3.974375      7.014707       5.687256      6.763087       5.556262  190.8305 64.54302 187.8898 63.79417 2.940689       90.74964 
1 1 1 -9  12 12 o 581.3772 21.79302 65.97269       4.920433      69.06020       7.011795      62.97722       6.906487  592.5815 30.57282 565.5706 31.57032 27.01093       43.94749 
1 1 1 -9  12 13 o 585.4107 23.29978 66.92939       5.297129      71.13548       7.775652      63.28690       7.235971  600.8004 33.45839 566.6935 33.02225 34.10681       47.00993 
1 1 1 -9  12 14 o 111.8757 50.55430 -2.338182      4.684910      -0.9116747     6.666823      -3.729831      6.584865  144.1703 62.96329 129.9471 59.19774 14.22325       86.42192 
1 1 1 -9  12 15 o 554.0824 25.63213 60.04001       5.515528      58.79330       7.999468      61.16976       7.614996  544.7142 38.05412 556.3989 35.42593 -11.68469      51.99146 
1 1 1 -9  12 16 o 502.7895 41.68253 50.40635       8.065549      0.000000       0.000000      50.40635       8.065549  ?        ?        502.7895 41.68253 0.000000       41.68253 
1 1 1 -9  12 17 o 362.5059 40.60595 26.37549       5.618336      32.61954       8.186895      20.81710       7.724319  398.9509 54.24784 313.4636 65.55990 85.48730       85.09364 
1 1 1 -9  12 18 o 1008.111 20.54579 198.5998       8.043760      202.4821       11.39186      194.7396       11.35940  1014.769 28.90678 994.9651 29.39811 19.80347       41.22925 
1 1 1 -9  12 19 o 363.7718 45.45505 26.96026       6.281375      30.27749       8.628865      23.22090       9.161451  379.3836 60.60596 325.3820 74.15240 54.00159       95.76878 
1 1 1 -9  12 20 f 409.1225 42.98372 33.94842       6.727344      16.13782       9.159964      54.80491       9.912315  268.8362 81.02814 517.2848 49.96402 -248.4486      95.19434 
1 1 1 -9  12 21 f 122.6886 56.91950 -4.665211      6.484377      -1.421382      9.113782      -7.990763      9.227872  162.0244 72.06435 140.0513 65.91833 21.97302       97.66523 
1 1 1 -9  12 22 o 209.4290 77.62243 8.631200       8.389852      4.055435       9.702766      22.19041       16.70248  189.7375 79.14818 299.5506 109.7800 -109.8131      135.3369 
1 1 1 -9  12 23 o 379.6411 50.42194 30.36777       7.250068      41.32343       10.00406      18.24877       10.52181  436.6151 60.63662 274.3789 87.54211 162.2361       106.4914 
1 1 1 -9  12 24 o 148.2626 64.29231 0.9450604      6.848657      0.1137207      9.953252      1.692586       9.438189  167.9706 74.96675 171.0056 74.79306 -3.034988      105.8962 
1 1 1 -9  12 25 o 170.7648 72.75165 3.723299       8.480225      -9.839661      16.54571      8.555536       9.876028  174.2380 83.74132 201.4665 81.46848 -27.22853      116.8320 
1 1 1 -9  12 26 o 141.3752 66.99615 -5.558265      9.836762      0.000000       0.000000      -5.558265      9.836762  ?        ?        141.3752 66.99615 0.000000       66.99615 
1 1 1 -9  12 27 o 213.3863 75.69093 12.69270       7.862520      24.67475       13.40811      6.413178       9.706558  261.6555 97.90038 177.6152 76.78030 84.04024       124.4174 
1 1 1 -9  12 28 o 158.6228 66.17985 5.579412       6.785279      0.1685897      9.943657      10.29424       9.282129  148.4381 69.40479 186.9680 77.65408 -38.52991      104.1498 
1 1 1 -9  12 29 o 233.1100 69.15250 16.39683       6.711009      16.46445       10.03503      16.34213       9.026481  205.3035 82.43649 210.7605 80.00372 -5.456940      114.8755 
1 1 1 -9  12 30 o 167.9250 70.36259 9.710699       7.717622      0.9041217      9.128194      31.78500       14.45189  134.9156 64.10960 225.6737 95.51070 -90.75806      115.0319 
1 1 1 -9  13 1  o 868.1051 15.79158 146.7286       5.323850      143.0956       6.289061      155.9153       10.00069  856.7913 18.90091 892.0576 28.86749 -35.26636      34.50473 
1 1 1 -9  13 2  o 540.4904 19.71686 56.97050       4.138603      51.12195       4.877132      72.01530       7.822288  511.3889 24.55756 604.3470 33.45915 -92.95813      41.50408 
1 1 1 -9  13 3  f 1002.555 15.68853 195.7149       6.108270      190.9635       7.103426      209.1987       11.96634  989.7770 18.48002 1032.763 29.83544 -42.98639      35.09508 
1 1 1 -9  13 4  o 323.4931 33.34569 20.78784       4.129161      11.73557       7.087991      25.43811       5.080233  237.0771 71.23701 357.2989 37.15548 -120.2217      80.34452 
1 1 1 -9  13 5  o 593.8478 38.15275 69.89468       8.752341      0.000000       0.000000      69.89468       8.752341  ?        ?        593.8478 38.15275 0.000000       38.15275 
1 1 1 -9  13 6  o 88.79494 41.24619 -2.933339      3.421064      -0.5782843     4.735217      -5.504831      4.948026  122.5358 53.29801 101.0474 47.77568 21.48835       71.57648 
1 1 1 -9  13 7  o 641.3171 18.44700 80.16819       4.594377      77.05926       6.326693      83.63694       6.682779  627.5879 25.95818 653.7552 26.32170 -26.16730      36.96835 
1 1 1 -9  13 8  o 483.8739 22.48427 45.71771       4.225119      43.09873       5.843915      48.58605       6.115794  467.3337 32.39951 496.4401 31.89055 -29.10638      45.46136 
1 1 1 -9  13 9  o 271.0620 47.21124 15.00301       4.789236      18.24360       8.784649      13.63247       5.712914  292.0571 76.52888 255.4084 58.81163 36.64871       96.51672 
1 1 1 -9  13 10 o 152.1665 54.47494 4.012256       4.081515      1.175879       5.746386      6.900044       5.798231  146.0001 60.90739 190.6376 65.16631 -44.63747      89.19842 
1 1 1 -9  13 11 o 311.2047 36.03381 19.30114       4.274396      16.65220       6.084389      21.88241       6.006188  283.3908 57.25498 328.4566 48.54918 -45.06577      75.06767 
1 1 1 -9  13 12 o 607.1503 22.02101 71.93069       5.192320      66.47188       7.581720      76.75244       7.125586  580.8013 33.75902 625.9928 29.31050 -45.19147      44.70768 
1 1 1 -9  13 13 o 924.6039 18.40273 166.5732       6.607937      169.2891       9.512017      164.0399       9.186548  930.4396 26.32428 916.0217 25.82371 14.41797       36.87589 
1 1 1 -9  13 14 o 553.7432 25.78644 59.95893       5.545335      69.09591       8.205207      52.27687       7.523623  591.4695 35.89120 513.6264 37.98774 77.84308       52.26133 
1 1 1 -9  13 15 o 217.1364 60.67550 9.823095       5.314404      14.42807       7.672343      5.575887       7.368281  260.7446 72.91887 189.6086 72.20892 71.13597       102.6221 
1 1 1 -9  13 16 o 781.1279 22.23386 119.2270       6.744738      132.0299       9.762187      107.5338       9.329516  819.6820 30.66717 739.2056 32.49870 80.47644       44.68378 
1 1 1 -9  13 17 o 743.0230 33.10778 108.9053       9.553452      108.9053       9.553452      0.000000       0.000000  743.0230 33.10778 ?        ?        0.000000       33.10778 
1 1 1 -9  13 18 o 635.9298 26.97916 79.45506       6.662936      70.74046       9.455693      88.04951       9.390276  594.1179 41.23732 665.2957 36.48344 -71.17773      55.05959 
1 1 1 -9  13 19 o 550.8523 31.78509 60.17161       6.770765      69.77036       9.593646      50.64589       9.557076  588.7496 42.23973 497.4817 50.15169 91.26791       65.56970 
1 1 1 -9  13 20 o 148.1033 62.58342 1.176629       6.189481      3.731227       8.748976      -1.382965      8.757526  183.9197 75.80091 159.5329 70.81371 24.38676       103.7322 
1 1 1 -9  13 21 o 604.3896 38.78637 73.52884       9.055764      65.17294       10.43582      99.00292       18.22130  563.5076 48.14911 675.8762 70.45562 -112.3685      85.33657 
1 1 1 -9  13 22 o 393.3926 56.47066 32.98298       8.379950      26.93039       9.706786      50.69410       16.60459  343.6046 74.85973 454.2067 97.07780 -110.6021      122.5891 
1 1 1 -9  13 23 o 259.9214 68.54008 15.57736       7.017461      23.28719       9.812306      7.505585       10.03999  310.3761 80.66538 204.0312 82.26937 106.3449       115.2178 
1 1 1 -9  13 24 o 156.2318 65.91317 2.646627       6.848056      -0.2943556     9.641564      5.640728       9.728245  162.4247 73.03986 188.5638 79.00375 -26.13911      107.5937 
1 1 1 -9  13 25 o 387.0194 72.54482 36.73909       10.50292      0.000000       0.000000      36.73909       10.50292  ?        ?        387.0194 72.54482 0.000000       72.54482 
1 1 1 -9  13 26 o 91.57569 46.19542 -20.88608      7.717526      -17.99782      12.53663      -22.64851      9.793065  131.8539 65.31533 106.2774 53.40544 25.57652       84.36962 
1 1 1 -9  13 27 o 141.7764 62.26907 2.148472       6.602803      6.390035       10.02317      -1.103316      8.776137  174.6736 76.71899 141.6613 65.88936 33.01227       101.1297 
1 1 1 -9  13 28 o 113.1444 53.78671 -3.561688      6.438246      -5.554470      10.02907      -2.164745      8.396917  131.2389 63.59365 131.0319 62.03794 0.2070313      88.84176 
1 1 1 -9  13 29 o 94.58365 46.58081 -8.035150      6.059503      -11.63339      8.708496      -4.657909      8.436823  107.3184 53.37742 120.0189 58.19738 -12.70053      78.96888 
1 1 1 -9  14 1  o 147.9604 49.83686 4.091913       3.390689      3.433233       4.060670      5.608794       6.162211  146.4471 54.05684 182.3434 66.70276 -35.89627      85.85686 
1 1 1 -9  14 2  o 590.0473 19.23401 67.84716       4.407422      66.12120       5.200343      72.24812       8.304058  582.0447 23.00635 605.2814 35.48190 -23.23676      42.28779 
1 1 1 -9  14 3  o 273.5984 36.02882 14.96589       3.735067      10.85444       4.425266      25.14967       6.964606  229.1826 51.03055 351.5375 52.63399 -122.3549      73.31067 
1 1 1 -9  14 4  o 411.1390 30.77496 33.31425       4.878119      33.31425       4.878119      0.000000       0.000000  411.1390 30.77496 ?        ?        0.000000       30.77496 
1 1 1 -9  14 5  f 370.8273 38.28309 27.37084       5.433909      21.70801       7.656774      33.11707       7.712951  322.8440 63.33207 405.0443 50.10171 -82.20038      80.75352 
1 1 1 -9  14 6  o 611.4788 22.07025 72.96010       5.241029      68.08392       8.764061      75.67472       6.539142  586.5147 38.69416 621.9853 27.07152 -35.47058      47.22399 
1 1 1 -9  14 7  o 312.8017 32.11334 19.39150       3.845707      19.98229       5.372900      18.77088       5.506878  314.5425 45.29042 303.8934 48.27562 10.64914       66.19485 
1 1 1 -9  14 8  f 505.6135 26.36157 50.11643       5.158356      65.72708       9.253240      43.07777       6.213385  575.4171 41.69056 467.0207 34.50245 108.3964       54.11582 
1 1 1 -9  14 9  o 427.9120 30.95225 36.07088       5.108976      32.93671       8.767599      37.68224       6.286582  401.6093 57.88642 435.9868 37.49375 -34.37753      68.96825 
1 1 1 -9  14 10 o 578.5730 22.34632 65.31370       5.021023      70.24533       7.259086      60.78993       6.952434  597.8281 31.37601 555.8044 32.34962 42.02362       45.06609 
1 1 1 -9  14 11 f 641.7172 20.98834 80.30189       5.230578      81.28127       7.596272      79.41886       7.212917  644.1313 30.36674 636.9276 29.16036 7.203735       42.10066 
1 1 1 -9  14 12 o 578.1793 22.86241 65.24584       5.133489      68.73794       7.395854      61.99931       7.131082  591.0826 32.34162 561.1512 32.86597 29.93146       46.11022 
1 1 1 -9  14 13 o 1070.146 17.77241 223.0980       7.386136      225.6212       10.60629      220.7222       10.29195  1074.359 25.42061 1062.764 24.93636 11.59521       35.60940 
1 1 1 -9  14 14 o 588.9829 24.70595 67.81801       5.651090      62.27499       8.211349      72.80555       7.789058  560.6172 37.93885 607.7541 33.12616 -47.13690      50.36565 
1 1 1 -9  14 15 o 832.4735 20.60754 135.2812       6.662307      144.0532       9.893337      128.0023       9.012056  856.5954 29.73987 807.7593 28.72857 48.83612       41.34961 
1 1 1 -9  14 16 o 346.3306 42.12727 24.19366       5.549371      28.16048       7.911117      20.35095       7.786362  368.7405 57.08946 308.9238 66.84303 59.81671       87.90447 
1 1 1 -9  14 17 o 333.2141 46.02705 22.64821       5.797119      15.77959       8.240159      29.37924       8.157199  268.8832 75.70129 375.6116 57.77184 -106.7283      95.22747 
1 1 1 -9  14 18 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -9  14 19 o 418.0509 41.01119 35.29779       6.572510      33.55941       9.287701      37.04160       9.302182  397.9729 62.12291 420.3094 58.58112 -22.33649      85.38737 
1 1 1 -9  14 20 o 192.4016 68.64635 7.214213       6.476104      11.49751       9.107946      2.834297       9.210097  233.0660 81.57185 181.8736 76.56992 51.19240       111.8790 
1 1 1 -9  14 21 o 686.8088 33.76510 94.09602       9.005999      92.81421       10.49648      97.67263       17.53346  677.4056 40.07775 670.4522 68.29331 6.953369       79.18461 
1 1 1 -9  14 22 o 207.9358 70.07394 9.478480       6.703503      14.26217       9.420720      4.572077       9.540789  246.3995 83.07050 187.9630 78.45287 58.43645       114.2609 
1 1 1 -9  14 23 o 473.0639 44.81298 46.86777       8.134708      58.63704       12.73939      38.76513       10.57029  509.3649 65.94918 410.8160 68.67842 98.54895       95.21564 
1 1 1 -9  14 24 f 220.2806 73.50356 11.88166       7.375125      10.22641       10.43705      13.53244       10.42297  211.1031 84.31633 229.7462 86.24712 -18.64313      120.6143 
1 1 1 -9  14 25 o 210.4742 82.88902 11.43475       9.955744      0.000000       0.000000      11.43475       9.955744  ?        ?        210.4742 82.88902 0.000000       82.88902 
1 1 1 -9  14 26 o 197.6979 73.46725 10.41791       7.525427      17.09115       12.03399      6.132370       9.643704  228.5275 90.77027 176.2913 76.36921 52.23624       118.6233 
1 1 1 -9  14 27 o 145.1712 62.66991 3.394621       6.449025      -1.053949      9.659285      6.972439       8.662513  143.7859 67.60271 170.4550 73.09656 -26.66911      99.56522 
1 1 1 -9  14 28 o 109.2718 53.65562 -8.507260      7.848917      -5.717800      9.598146      -14.13807      13.63680  126.2619 61.41932 130.5607 65.23003 -4.298737      89.59515 
1 1 1 -9  14 29 o 82.24173 41.37161 -13.28876      5.957093      -11.95628      8.696136      -14.46690      8.177011  105.5315 52.62528 98.06666 49.21332 7.464828       72.05117 
1 1 1 -9  15 1  o 834.7167 19.77140 135.7375       6.409211      135.7375       6.409211      0.000000       0.000000  834.7167 19.77140 ?        ?        0.000000       19.77140 
1 1 1 -9  15 2  o 750.6423 17.82862 109.7118       5.197309      103.6071       5.977730      128.6198       10.52025  729.0582 21.11281 809.9704 33.44481 -80.91217      39.55132 
1 1 1 -9  15 3  o 430.1723 24.71793 36.24266       4.112005      33.56730       4.892032      42.68350       7.590483  412.9507 30.72437 463.2824 42.66818 -50.33173      52.57908 
1 1 1 -9  15 4  o 653.5656 22.69520 83.32342       5.760381      83.32342       5.760381      0.000000       0.000000  653.5656 22.69520 ?        ?        0.000000       22.69520 
1 1 1 -9  15 5  o 1033.012 22.43823 208.1466       9.001649      208.1466       9.001649      0.000000       0.000000  1033.012 22.43823 ?        ?        0.000000       22.43823 
1 1 1 -9  15 6  o 127.5342 50.87968 1.705956       3.796387      -1.878049      5.313288      5.444046       5.426301  123.1682 54.88650 176.0698 62.83475 -52.90168      83.43102 
1 1 1 -9  15 7  o 360.3147 33.46555 25.67610       4.629337      33.28510       7.724834      21.41206       5.782771  406.6264 49.96919 325.6714 47.08958 80.95508       68.66112 
1 1 1 -9  15 8  o 476.8639 28.72381 44.64109       5.294598      41.04528       9.332638      46.34768       6.429407  450.8017 54.40793 484.8066 34.37152 -34.00497      64.35545 
1 1 1 -9  15 9  f 613.9790 20.62460 73.48158       4.917757      82.19466       7.134745      65.59543       6.787740  648.2546 28.34033 578.0292 30.34369 70.22540       41.52004 
1 1 1 -9  15 10 o 804.1124 18.61693 125.9572       5.813703      134.1099       8.472504      118.7027       7.992144  828.4027 26.33554 779.3526 26.40592 49.05011       37.29388 
1 1 1 -9  15 11 o 463.2364 27.70420 42.12154       4.961125      56.50312       7.242443      29.40718       6.809715  535.1832 35.03957 382.4911 46.82132 152.6920       58.48083 
1 1 1 -9  15 12 o 377.2621 32.76595 28.14135       4.752905      36.11060       7.004320      21.34030       6.470607  425.2125 43.00756 322.9444 53.46326 102.2681       68.61465 
1 1 1 -9  15 13 o 646.5693 22.48606 81.63055       5.646201      94.27858       8.577341      71.95911       7.500442  692.9124 31.87472 604.5042 32.06381 88.40820       45.21157 
1 1 1 -9  15 14 o 112.6976 51.21268 -2.680953      4.889612      4.848220       7.339487      -8.689336      6.556482  183.9627 71.53999 111.1008 53.21509 72.86189       89.16174 
1 1 1 -9  15 15 f 421.7735 35.49318 35.37938       5.759651      40.87413       8.334384      30.35627       7.968670  449.1766 48.55039 384.0461 54.99907 65.13046       73.36237 
1 1 1 -9  15 16 o 354.4281 42.38563 25.38531       5.718377      24.22479       8.258766      26.45406       7.925535  337.5350 65.36567 355.5675 59.49782 -18.03253      88.38926 
1 1 1 -9  15 17 o 169.6631 63.75692 4.762392       5.698662      15.50127       8.177638      -5.375761      7.945620  265.9465 75.60286 137.0434 63.37687 128.9031       98.65303 
1 1 1 -9  15 18 o 988.6235 21.57449 191.3717       8.283224      202.4301       11.94712      181.1353       11.49448  1012.667 30.37867 957.6490 30.90687 55.01770       43.33703 
1 1 1 -9  15 19 o 296.3406 78.63516 19.82290       9.199473      19.82290       9.199473      0.000000       0.000000  296.3406 78.63516 ?        ?        0.000000       78.63516 
1 1 1 -9  15 20 o 232.6742 74.92510 11.93060       7.693909      3.013148       9.428903      29.69955       13.30981  183.1615 77.31232 349.7303 95.36751 -166.5688      122.7687 
1 1 1 -9  15 21 o 323.1934 66.52004 23.32287       8.070825      23.54634       9.836448      22.86247       14.11863  316.0237 80.05611 298.4749 101.6901 17.54886       129.4212 
1 1 1 -9  15 22 o 497.3874 41.71481 51.09396       7.983323      63.39010       12.73679      43.13726       10.24572  535.6699 62.39499 441.9915 61.34373 93.67834       87.49965 
1 1 1 -9  15 23 o 270.8335 66.70228 17.31763       6.969421      27.19636       9.787416      7.156014       9.926558  331.8949 77.36332 195.9625 80.75002 135.9324       111.8287 
1 1 1 -9  15 24 f 314.6699 74.63122 25.02886       8.982134      37.21905       17.27398      20.51148       10.51553  326.2176 112.4411 269.8693 87.65995 56.34833       142.5737 
1 1 1 -9  15 25 f 226.9008 74.68242 13.90325       7.623139      16.26349       12.65489      12.55900       9.550362  228.3519 92.26250 212.7141 81.91702 15.63789       123.3806 
1 1 1 -9  15 26 o 255.2961 71.94627 18.10797       7.439180      40.20601       12.54632      6.126490       9.238361  356.5314 90.46595 171.1447 74.44323 185.3867       117.1575 
1 1 1 -9  15 27 o 135.7717 62.65791 0.4286348      7.706721      -1.743270      9.608837      4.345212       12.90339  138.5219 65.80941 165.0458 77.76332 -26.52396      101.8725 
1 1 1 -9  15 28 o 171.4468 65.32307 8.805920       6.031783      17.45529       9.270674      2.456732       7.942884  211.7642 80.91260 139.5057 64.09961 72.25850       103.2260 
1 1 1 -9  16 1  o 246.5815 40.14939 12.24638       3.712445      16.92820       4.478581      1.964074       6.637098  290.7222 40.79003 161.1910 66.17893 129.5312       77.73981 
1 1 1 -9  16 2  o 987.0631 16.29397 189.5737       6.245969      186.7074       7.296767      197.4313       12.08141  979.1850 19.18835 1004.629 30.96592 -25.44391      36.42912 
1 1 1 -9  16 3  o 578.5020 24.63984 65.29553       5.535676      65.29553       5.535676      0.000000       0.000000  578.5020 24.63984 ?        ?        0.000000       24.63984 
1 1 1 -9  16 4  o 365.4076 35.32095 26.42247       4.949801      26.42247       4.949801      0.000000       0.000000  365.4076 35.32095 ?        ?        0.000000       35.32095 
1 1 1 -9  16 5  o 671.2353 20.36697 87.78403       5.309200      84.42486       6.163721      97.44221       10.45138  657.8196 24.12727 703.1584 38.41844 -45.33887      45.36630 
1 1 1 -9  16 6  f 803.0217 17.70459 125.5400       5.521297      124.7432       7.715465      126.3762       7.904556  799.4628 24.85054 804.6042 25.29689 -5.141418      35.46100 
1 1 1 -9  16 7  o 228.8112 47.59480 10.73008       4.091489      12.93978       5.734792      8.439263       5.839098  249.5478 59.92872 205.7649 65.16847 43.78284       88.53463 
1 1 1 -9  16 8  o 610.5617 24.50249 72.76532       5.809887      73.92928       9.900948      72.15404       7.175083  610.9807 41.98216 606.3636 30.56788 4.617004       51.93166 
1 1 1 -9  16 9  o 826.0627 21.64860 133.0642       6.944978      127.4233       11.91960      135.9633       8.545334  804.7991 38.13697 834.1604 26.37858 -29.36127      46.37087 
1 1 1 -9  16 10 o 541.6456 24.37209 57.29005       5.126678      47.11549       7.058213      68.65228       7.458794  487.9382 37.53590 590.7397 32.63866 -102.8015      49.74159 
1 1 1 -9  16 11 o 282.6090 44.23921 16.17321       4.696086      12.37887       6.697534      19.84267       6.586399  243.1135 68.17906 310.1722 56.77068 -67.05867      88.72031 
1 1 1 -9  16 12 o 265.7908 49.82633 14.52320       4.954162      10.79641       6.979115      18.30850       7.033689  228.8280 71.06811 295.3514 63.22995 -66.52347      95.12467 
1 1 1 -9  16 13 o 215.5259 70.87680 9.352379       6.866574      0.000000       0.000000      9.352379       6.866574  ?        ?        215.5259 70.87680 0.000000       70.87680 
1 1 1 -9  16 14 o 1175.823 18.53713 269.7292       8.464719      282.4688       12.52029      259.0036       11.48805  1200.173 26.86226 1149.708 25.72947 50.46484       37.19659 
1 1 1 -9  16 15 o 522.7273 28.98670 53.88589       5.861345      57.26807       8.511393      50.83520       8.083534  534.7886 41.30180 503.5309 41.71342 31.25766       58.70134 
1 1 1 -9  16 16 o 246.8840 60.05262 12.99124       5.702549      17.81262       8.542082      9.114998       7.659205  284.6978 75.88198 214.3489 74.81571 70.34894       106.5620 
1 1 1 -9  16 17 o 95.83817 46.80724 -10.14184      5.734221      -5.880755      8.422527      -13.82336      7.828810  139.8950 64.89101 111.1888 54.38622 28.70618       84.66821 
1 1 1 -9  16 18 o 668.4038 27.18402 87.98959       7.056357      90.38357       10.10026      85.70704       9.862384  671.4833 38.89858 653.7593 39.02306 17.72400       55.09899 
1 1 1 -9  16 19 o 126.3659 57.87778 -3.457429      6.405556      -17.57175      9.226267      9.676827       8.900180  116.5254 57.40442 219.1625 80.16444 -102.6371      98.59821 
1 1 1 -9  16 20 o 475.0030 51.30649 47.23957       9.314156      53.96814       12.47883      38.77581       13.99570  496.5752 66.36912 399.2068 92.14430 97.36838       113.5581 
1 1 1 -9  16 21 o 291.3795 60.60277 18.88672       6.634255      21.52135       9.716017      16.58538       9.080682  297.3385 81.64788 261.9049 81.01971 35.43359       115.0242 
1 1 1 -9  16 22 o 287.9595 64.25926 19.12766       7.003797      33.46718       9.922656      4.890524       9.887169  378.2582 70.13024 186.1682 78.90693 192.0900       105.5678 
1 1 1 -9  16 23 o 355.2754 53.82922 28.08852       7.194307      33.57053       10.13867      22.52879       10.21029  370.3250 73.09187 288.9185 85.19080 81.40646       112.2492 
1 1 1 -9  16 24 o 141.8072 65.46259 -1.944377      8.421296      -22.54506      15.98865      5.964750       9.906843  145.3027 72.27892 181.4778 78.00644 -36.17506      106.3449 
1 1 1 -9  16 25 o 441.2162 57.14629 46.24780       9.561867      64.19152       13.05236      25.46381       14.04745  500.8749 68.92760 259.2144 99.46750 241.6605       121.0157 
1 1 1 -9  16 26 f 100.7049 49.67271 -10.31806      6.980872      -4.956860      11.46902      -13.47320      8.798433  141.7816 68.53304 109.0625 54.14503 32.71913       87.34106 
1 1 1 -9  16 27 o 143.7793 62.05734 4.193142       6.321166      -8.569846      9.171160      15.74325       8.724511  117.6860 57.83017 209.8774 78.88433 -92.19138      97.81138 
1 1 1 -9  16 28 o 195.4819 67.43892 12.23269       6.214559      -1.916785      9.009619      25.07479       8.583300  128.4251 61.74093 270.2519 77.66154 -141.8268      99.21320 
1 1 1 -9  17 1  o 348.5292 29.82276 23.90797       3.997721      21.30759       4.782875      29.93610       7.282189  327.3745 38.34622 386.2322 49.70291 -58.85770      62.77588 
1 1 1 -9  17 2  o 586.7178 20.64218 67.05283       4.703409      69.27592       5.682671      62.21743       8.380885  595.9782 24.55241 561.6837 38.65649 34.29449       45.79460 
1 1 1 -9  17 3  f 1226.540 19.52272 292.9625       9.299298      292.9625       9.299298      0.000000       0.000000  1226.540 19.52272 ?        ?        0.000000       19.52272 
1 1 1 -9  17 4  o 1270.020 19.60158 314.1339       9.667841      314.1339       9.667841      0.000000       0.000000  1270.020 19.60158 ?        ?        0.000000       19.60158 
1 1 1 -9  17 5  o 594.5910 25.71182 69.01294       5.937166      69.01294       5.937166      0.000000       0.000000  594.5910 25.71182 ?        ?        0.000000       25.71182 
1 1 1 -9  17 6  o 919.9126 18.22598 164.7735       6.511267      169.4606       7.734790      153.3729       12.06315  932.4257 21.36025 884.2222 35.12944 48.20349       41.11372 
1 1 1 -9  17 7  o 562.1579 25.95042 61.72204       5.665403      62.07826       9.700292      61.53762       6.979491  558.8029 45.08275 559.5302 32.25648 -0.7273560     55.43406 
1 1 1 -9  17 8  o 148.0583 55.48781 3.347015       4.310631      3.103844       6.146946      3.582311       6.046599  163.4777 64.89233 165.9905 64.82725 -2.512848      91.72560 
1 1 1 -9  17 9  o 171.9403 56.75344 5.694751       4.401170      -0.8515362     6.226130      12.23291       6.222261  139.7286 60.93982 241.8737 64.89453 -102.1451      89.02225 
1 1 1 -9  17 10 o 221.5950 60.11759 10.23044       5.304970      1.335612       9.469934      14.29832       6.404156  182.1115 77.20781 260.8137 63.76171 -78.70219      100.1329 
1 1 1 -9  17 11 o 595.3848 27.44692 69.43262       6.346281      82.94878       12.42583      64.66273       7.381634  642.5038 50.19778 572.4615 33.34751 70.04236       60.26503 
1 1 1 -9  17 12 o 840.8185 19.92571 137.9680       6.506451      137.4388       9.417410      138.4514       8.999811  836.8765 28.97625 840.3701 27.57623 -3.493530      40.00089 
1 1 1 -9  17 13 o 524.1813 27.47040 54.04966       5.572638      46.51556       8.063315      60.93857       7.710330  481.3716 43.60590 554.1740 36.02160 -72.80240      56.55997 
1 1 1 -9  17 14 o 445.3934 33.94976 39.39444       5.828074      64.49033       9.063692      21.70357       7.609891  567.7201 41.39480 320.0583 63.46573 247.6617       75.77222 
1 1 1 -9  17 15 o 588.0175 27.68137 67.95763       6.321291      72.85609       9.413341      63.93447       8.530963  603.5109 40.39667 565.7359 39.06841 37.77496       56.19814 
1 1 1 -9  17 16 o 146.8254 61.55758 1.318138       5.912575      -11.03857      8.691483      11.96223       8.066714  127.1750 61.00810 236.9348 76.76305 -109.7598      98.05383 
1 1 1 -9  17 17 o 415.6741 40.01841 34.85634       6.380296      44.44711       9.414523      26.70982       8.676763  463.5865 53.25977 352.1816 65.86127 111.4049       84.70130 
1 1 1 -9  17 18 o 516.3344 33.31362 53.20935       6.644426      52.65720       9.608998      53.71526       9.197762  505.4875 49.58698 512.1965 46.75539 -6.709076      68.15376 
1 1 1 -9  17 19 o 627.6824 38.30859 79.62074       9.293516      80.74155       12.41630      78.19286       14.01437  622.1641 51.86017 604.8638 60.47097 17.30029       79.66314 
1 1 1 -9  17 20 o 404.6476 54.81748 35.13424       8.392627      36.48523       10.35877      32.55318       14.31797  402.1121 68.80711 351.2755 100.0999 50.83655       121.4677 
1 1 1 -9  17 21 o 195.8881 70.84882 8.361673       6.923703      13.60933       10.14991      3.794749       9.468729  236.0615 85.71983 179.7381 76.73205 56.32336       115.0465 
1 1 1 -9  17 22 o 265.0304 66.51856 16.77475       6.835795      13.69245       9.629637      19.90572       9.705358  231.1186 83.55985 274.5106 83.55548 -43.39195      118.1684 
1 1 1 -9  17 23 f 160.2780 70.09323 2.579309       8.287236      13.10547       16.00784      -1.274764      9.686295  222.4698 97.35107 153.6098 70.65605 68.86005       120.2893 
1 1 1 -9  17 24 o 224.3658 81.90391 14.74688       9.283967      22.50491       12.75311      6.000197       13.54134  255.7995 95.52439 186.8835 85.04077 68.91606       127.8939 
1 1 1 -9  17 25 o 230.3703 72.37639 15.24071       7.215032      16.49656       11.76604      14.48391       9.133860  215.8763 88.31232 213.7031 80.63194 2.173203       119.5850 
1 1 1 -9  17 26 o 225.7786 67.43541 14.73249       6.365767      11.74215       9.245718      17.42770       8.777620  188.1728 77.77386 225.1010 79.96075 -36.92821      111.5459 
1 1 1 -9  17 27 o 108.1223 51.81868 -3.731487      6.237153      -8.441813      8.903002      0.8085340      8.740574  114.6939 56.48036 136.8099 64.31792 -22.11603      85.59688 
1 1 1 -9  18 1  o 182.5101 52.23976 6.761027       3.890672      4.947968       4.683739      10.79699       6.988120  166.7632 58.48873 230.9067 71.01533 -64.14349      92.00059 
1 1 1 -9  18 2  o 339.1320 31.59259 22.69397       4.112970      19.54193       4.878825      30.43698       7.646702  312.6167 41.18891 388.6821 51.95898 -76.06546      66.30431 
1 1 1 -9  18 3  o 384.2686 36.53150 29.22867       5.386095      29.22867       5.386095      0.000000       0.000000  384.2686 36.53150 ?        ?        0.000000       36.53150 
1 1 1 -9  18 4  o 218.6086 50.95317 9.845969       4.245853      10.97966       5.057000      7.137598       7.816281  230.2949 56.87904 205.0994 75.10884 25.19548       94.21551 
1 1 1 -9  18 5  o 534.2864 24.04132 55.70563       4.988390      57.94761       5.933770      50.30260       9.211571  543.7130 28.19854 501.9201 47.83644 41.79285       55.52912 
1 1 1 -9  18 6  o 683.6481 25.22975 91.27647       6.698438      91.27647       6.698438      0.000000       0.000000  683.6481 25.22975 ?        ?        0.000000       25.22975 
1 1 1 -9  18 7  o 694.1197 42.44186 95.51675       11.38584      95.51675       11.38584      0.000000       0.000000  694.1197 42.44186 ?        ?        0.000000       42.44186 
1 1 1 -9  18 8  o 1018.474 17.55121 202.0590       6.942005      194.1967       9.500819      211.0644       10.16807  996.9528 24.53909 1039.174 25.19544 -42.22144      35.17069 
1 1 1 -9  18 9  o 508.7108 25.89030 50.75281       5.097990      48.72179       7.066721      52.95687       7.361609  495.8496 36.96336 517.0770 36.90207 -21.22739      52.23076 
1 1 1 -9  18 10 o 766.7986 20.57571 114.7507       6.127230      111.4095       8.667312      118.0887       8.663113  753.5190 29.61844 776.0118 28.74601 -22.49280      41.27451 
1 1 1 -9  18 11 o 498.4097 39.12907 49.46978       7.512928      0.000000       0.000000      49.46978       7.512928  ?        ?        498.4097 39.12907 0.000000       39.12907 
1 1 1 -9  18 12 o 520.8117 32.99223 53.66536       6.638517      55.83913       13.11429      52.91643       7.697607  517.0464 66.87844 515.3474 38.74519 1.698975       77.29111 
1 1 1 -9  18 13 o 297.1318 49.04338 18.16520       5.461770      10.48187       7.908269      25.17230       7.552243  226.5668 76.11200 347.5485 57.99813 -120.9817      95.69127 
1 1 1 -9  18 14 o 357.2209 58.92565 26.69484       7.889582      0.000000       0.000000      26.69484       7.889582  ?        ?        357.2209 58.92565 0.000000       58.92565 
1 1 1 -9  18 15 o 201.1235 65.38268 8.312800       5.849531      11.64424       8.745762      5.616132       7.868568  235.9798 80.03699 190.3647 74.06141 45.61504       109.0459 
1 1 1 -9  18 16 o 448.7852 36.91062 40.36210       6.376041      35.26117       9.445968      44.63146       8.641772  408.2704 61.48289 467.0739 48.34163 -58.80341      78.21163 
1 1 1 -9  18 17 o 233.8375 69.23415 12.00967       6.731714      30.11000       11.39483      2.305770       8.343300  362.3154 82.79260 172.3869 72.74286 189.9285       110.2095 
1 1 1 -9  18 18 o 605.5097 31.02676 73.09957       7.271506      60.14586       10.47577      85.14391       10.10137  537.3949 50.79784 647.9011 40.34630 -110.5062      64.87099 
1 1 1 -9  18 19 o 390.0471 52.81767 32.41969       7.794849      43.52537       9.643802      11.49196       13.23843  450.0495 56.41701 235.2990 94.61251 214.7505       110.1563 
1 1 1 -9  18 20 o 386.2044 46.65847 31.52234       6.856179      45.37097       10.10511      19.70900       9.333052  454.2105 58.65748 281.7568 80.98671 172.4538       99.99773 
1 1 1 -9  18 21 o 587.9661 32.48294 70.26906       7.388358      71.47750       10.83117      69.21740       10.10411  577.2584 48.77094 571.0281 45.95205 6.230286       67.00891 
1 1 1 -9  18 22 o 138.7893 63.66412 -1.897974      7.790741      -19.23449      9.735570      28.97281       12.99135  112.3725 55.97995 308.5750 97.14725 -196.2025      112.1220 
1 1 1 -9  18 23 o 160.9126 69.78379 3.624177       8.069941      -25.38605      15.04936      15.33258       9.560737  135.2344 67.70727 229.5080 83.21695 -94.27361      107.2816 
1 1 1 -9  18 24 o 121.1554 57.39318 -3.992942      7.205961      -1.016006      11.65740      -5.833858      9.167140  155.7863 73.55679 130.1357 62.48855 25.65060       96.51642 
1 1 1 -9  18 25 o 118.4678 56.17222 -3.265241      6.934209      6.797983       11.37019      -9.224411      8.749679  170.7367 77.78304 116.0945 56.93391 54.64220       96.39332 
1 1 1 -9  18 26 o 144.6030 61.45966 4.609911       6.025944      -6.045439      8.682590      14.51173       8.369950  119.6887 58.26589 202.7901 77.02468 -83.10139      96.58009 
1 1 1 -9  19 1  o 1000.121 19.03892 194.8258       7.394743      186.8043       9.247532      209.0511       12.31486  978.3588 24.33883 1033.445 30.68416 -55.08643      39.16499 
1 1 1 -9  19 2  o 868.6052 24.13256 147.2500       8.140552      147.2500       8.140552      0.000000       0.000000  868.6052 24.13256 ?        ?        0.000000       24.13256 
1 1 1 -9  19 3  o 698.5609 27.35673 95.39891       7.421582      95.39891       7.421582      0.000000       0.000000  698.5609 27.35673 ?        ?        0.000000       27.35673 
1 1 1 -9  19 4  o 1100.735 17.43265 235.9427       7.452027      238.7738       8.809890      228.8227       13.97112  1106.715 20.49777 1079.917 33.31292 26.79810       39.11406 
1 1 1 -9  19 5  o 361.5772 34.41674 25.90665       4.774487      28.23176       5.637616      20.00892       8.978739  376.5331 39.12483 306.6341 75.82452 69.89905       85.32356 
1 1 1 -9  19 6  o 175.9713 63.82074 5.329239       5.623800      4.202143       7.395247      6.874897       8.660218  181.0520 71.39548 207.1674 78.42982 -26.11534      106.0592 
1 1 1 -9  19 7  o 504.0961 33.56007 50.16490       6.532433      53.81438       8.624222      45.25289       10.00539  519.4840 43.13865 471.8714 55.67061 47.61264       70.42840 
1 1 1 -9  19 8  o 602.7563 26.67738 71.13165       6.244720      67.58249       7.371685      80.15107       11.75150  585.4830 32.54937 632.2876 48.22117 -46.80463      58.17855 
1 1 1 -9  19 9  o 586.3931 24.40194 67.26025       5.557010      68.15923       7.664980      66.26424       8.068106  587.4201 33.74125 578.4645 36.09442 8.955627       49.40931 
1 1 1 -9  19 10 o 631.9753 24.16759 78.14651       5.931459      73.97595       8.491262      82.12084       8.289090  611.0738 35.93907 644.8577 33.21179 -33.78394      48.93506 
1 1 1 -9  19 11 o 281.9256 69.46263 17.06865       7.555851      17.06865       7.555851      0.000000       0.000000  281.9256 69.46263 ?        ?        0.000000       69.46263 
1 1 1 -9  19 12 o 399.0763 36.27667 31.76477       5.560859      36.19411       8.139442      27.88764       7.615193  421.1575 50.78971 367.3883 55.07067 53.76913       74.91578 
1 1 1 -9  19 13 o 112.8947 52.36834 -4.263647      5.486028      -6.267892      8.010683      -2.493386      7.528573  134.8594 62.80053 144.3496 64.75545 -9.490234      90.20628 
1 1 1 -9  19 14 o 349.3846 52.69155 25.29650       6.927225      0.1987763      13.74655      33.83914       8.019963  203.9893 89.71426 405.2484 52.17081 -201.2591      103.7807 
1 1 1 -9  19 15 o 229.6453 66.51967 11.40765       6.274651      4.212620       10.10145      15.92794       8.006641  195.6885 81.12022 267.9880 74.33002 -72.29958      110.0247 
1 1 1 -9  19 16 o 211.1404 69.22083 9.479312       6.551323      19.45828       10.48718      3.092660       8.389816  289.0816 86.60309 176.7105 73.64651 112.3711       113.6833 
1 1 1 -9  19 17 o 629.2207 28.85656 78.50862       7.051403      88.94736       10.64697      70.35223       9.411331  661.2075 41.67623 587.9025 41.48720 73.30505       58.80558 
1 1 1 -9  19 18 o 333.6356 62.91467 24.70359       7.852830      28.16137       9.834209      18.61906       13.04531  348.0758 74.96580 271.8676 97.38313 76.20822       122.8957 
1 1 1 -9  19 19 o 210.9884 74.57199 10.09343       7.625197      11.07850       9.241506      7.992482       13.49636  220.1242 81.49067 215.9175 91.87901 4.206726       122.8108 
1 1 1 -9  19 20 o 149.9891 63.84027 2.125066       6.518801      -2.687188      9.465173      6.467284       8.991042  151.5839 69.76891 188.2607 77.12814 -36.67673      104.0022 
1 1 1 -9  19 21 o 295.5522 69.13397 21.42051       7.793823      26.33730       9.791769      12.92005       12.87482  317.7913 79.53011 222.8902 91.91840 94.90106       121.5485 
1 1 1 -9  19 22 o 321.2408 66.16994 25.48655       7.980249      19.08140       14.73905      28.14298       9.491910  238.5821 98.36406 326.1072 76.30341 -87.52510      124.4898 
1 1 1 -9  19 23 o 272.3808 71.00971 20.04061       7.588475      16.59117       12.80120      21.90948       9.422532  219.9008 91.25157 269.0220 82.41664 -49.12115      122.9608 
1 1 1 -9  19 24 o 107.5578 52.22526 -6.989353      6.855731      2.386859       12.08486      -11.43886      8.324993  161.3442 75.78017 109.2628 53.95925 52.08144       93.02814 
1 1 1 -9  19 25 o 89.20334 44.69259 -13.65380      6.611281      -15.38657      10.96044      -12.66276      8.289030  116.8708 58.40380 104.5205 52.00049 12.35033       78.19881 
1 1 1 -9  20 1  o 827.1271 21.35651 133.4290       6.860102      133.8707       8.740051      132.7202       11.07151  827.3677 27.20116 821.9832 34.68295 5.384460       44.07732 
1 1 1 -9  20 2  o 395.5404 37.19892 31.05551       5.646989      31.05551       5.646989      0.000000       0.000000  395.5404 37.19892 ?        ?        0.000000       37.19892 
1 1 1 -9  20 3  o 194.4257 56.22301 7.751992       4.485861      5.848701       5.339290      12.31961       8.271344  178.7299 62.46121 244.8368 77.56475 -66.10689      99.58762 
1 1 1 -9  20 4  o 761.9672 21.80493 113.3062       6.452365      129.8961       8.209153      86.49086       10.43682  814.9974 25.93667 660.3718 40.89724 154.6255       48.42824 
1 1 1 -9  20 5  o 294.4972 44.04362 17.55269       4.882542      19.71184       5.831719      12.49136       8.928691  310.7691 50.01751 247.1146 80.80029 63.65450       95.02862 
1 1 1 -9  20 6  o 295.1840 54.64784 18.00267       6.033887      14.48322       7.931065      22.83906       9.297259  261.1326 74.53085 326.6842 74.88303 -65.55161      105.6519 
1 1 1 -9  20 7  o 616.4383 25.12802 74.34796       6.015557      78.74767       7.159930      63.78852       11.09220  633.6006 29.09814 562.1683 51.37481 71.43231       59.04298 
1 1 1 -9  20 8  o 308.9332 45.93235 19.40268       5.343059      14.05418       6.206883      34.70674       10.49931  257.8354 62.61231 406.0737 69.04958 -148.2383      93.21022 
1 1 1 -9  20 9  o 908.7654 26.93472 161.9001       9.505877      161.9001       9.505877      0.000000       0.000000  908.7654 26.93472 ?        ?        0.000000       26.93472 
1 1 1 -9  20 10 o 331.1193 49.71974 22.45436       6.196038      18.42824       7.587676      30.51226       10.73437  293.4340 67.92603 375.9456 76.13358 -82.51169      102.0307 
1 1 1 -9  20 11 o 167.0539 61.21012 4.814892       5.192186      8.189287       7.743199      2.058098       6.998816  208.5621 74.99298 162.5246 67.45996 46.03743       100.8702 
1 1 1 -9  20 12 o 535.7213 29.29733 56.65815       6.072200      66.56680       8.708040      47.28025       8.471615  577.2363 39.07550 483.4814 45.65948 93.75497       60.09728 
1 1 1 -9  20 13 o 190.6371 63.75705 7.312855       5.548969      5.680815       8.295854      8.634235       7.464651  193.1350 75.79042 209.1651 73.79832 -16.03015      105.7846 
1 1 1 -9  20 14 o 264.5543 62.71480 15.16576       6.345221      24.30903       10.67046      10.16384       7.892239  325.9221 83.82738 220.9667 76.01184 104.9554       113.1584 
1 1 1 -9  20 15 f 157.5417 67.10991 1.345469       7.214371      -7.420698      14.95012      4.006481       8.236887  184.6612 85.92545 180.2266 73.82803 4.434601       113.2862 
1 1 1 -9  20 16 o 180.7805 72.23693 5.016748       7.664474      28.15993       16.41302      -1.437421      8.667568  325.2758 109.6477 155.7948 69.71413 169.4810       129.9333 
1 1 1 -9  20 17 o 378.5447 45.71986 29.92302       6.585108      34.18271       9.740522      26.33729       8.936798  390.7455 66.57565 339.5628 70.09284 51.18265       96.67120 
1 1 1 -9  20 18 o 110.7680 53.81450 -10.41103      7.306943      -8.390587      9.279185      -13.70873      11.85476  134.7536 64.20378 142.5805 69.10170 -7.826828      94.32481 
1 1 1 -9  20 19 o 396.3723 52.43298 34.30339       7.873040      27.88070       9.807384      45.94400       13.20330  336.1090 76.81313 427.9270 82.43847 -91.81799      112.6781 
1 1 1 -9  20 20 o 457.7666 38.99808 43.88170       6.866810      53.13869       9.659155      34.42273       9.763968  491.4399 51.36972 377.6460 69.12263 113.7939       86.12077 
1 1 1 -9  20 21 o 179.8384 67.96968 7.522303       6.497364      9.196178       9.358015      5.964344       9.028179  194.9843 79.14336 177.5337 75.33291 17.45067       109.2644 
1 1 1 -9  20 22 o 285.3166 79.03548 23.35897       9.058519      0.000000       0.000000      23.35897       9.058519  ?        ?        285.3166 79.03548 0.000000       79.03548 
1 1 1 -9  20 23 o 128.0752 59.41035 -1.192513      7.060749      -4.516028      11.90850      0.6092940      8.768241  145.4350 70.18546 144.6550 66.78430 0.7799988      96.88210 
1 1 1 -9  20 24 o 167.9826 68.94269 7.772912       7.199829      10.23081       11.99897      6.390077       9.000102  179.2753 80.96785 162.8502 72.06079 16.42516       108.3907 
1 1 1 -9  21 1  o 147.1123 62.91154 0.2009562      6.384738      0.2009562      6.384738      0.000000       0.000000  147.1123 62.91154 ?        ?        0.000000       62.91154 
1 1 1 -9  21 2  o 163.5889 62.19910 4.000123       5.461501      4.000123       5.461501      0.000000       0.000000  163.5889 62.19910 ?        ?        0.000000       62.19910 
1 1 1 -9  21 3  o 1153.075 19.80448 259.2937       8.868473      284.4018       11.47691      222.0832       13.97175  1206.232 24.49999 1062.735 33.85305 143.4972       41.78850 
1 1 1 -9  21 4  o 1177.680 17.96799 270.3028       8.217788      263.5710       9.507024      290.1970       16.34340  1162.124 21.06512 1214.199 34.65970 -52.07446      40.55902 
1 1 1 -9  21 5  o 728.6014 26.08154 103.9104       7.379912      96.45764       9.508140      115.2036       11.70437  698.8745 35.14436 762.2123 39.67778 -63.33783      53.00426 
1 1 1 -9  21 6  o 780.4069 21.37867 118.9261       6.479324      121.7900       7.765869      112.3657       11.75366  788.8524 25.34932 752.1738 40.38484 36.67865       47.68148 
1 1 1 -9  21 7  o 499.7004 29.70557 49.20409       5.738729      49.54206       6.847883      48.40683       10.51772  499.8708 35.50626 486.4344 56.74254 13.43634       66.93587 
1 1 1 -9  21 8  o 97.37871 46.93842 -7.795660      5.289219      -5.107814      6.331779      -14.00211      9.621551  120.5631 56.03955 130.0289 62.83257 -9.465858      84.19241 
1 1 1 -9  21 9  o 773.1193 22.74678 116.9290       6.829586      119.8225       8.113359      109.8936       12.65123  781.5234 26.73195 740.7234 44.18039 40.79999       51.63821 
1 1 1 -9  21 10 o 285.7012 50.21704 16.89440       5.368383      24.66308       7.645262      9.338331       7.539916  342.9158 59.57013 216.0476 74.29718 126.8682       95.22958 
1 1 1 -9  21 11 o 312.4759 47.93164 20.08846       5.630908      18.74325       8.076524      21.36080       7.854721  292.9142 71.60175 315.1943 66.27151 -22.28012      97.56394 
1 1 1 -9  21 12 o 364.2049 58.09279 27.91546       7.940601      27.35237       11.13261      28.49863       11.32939  347.3561 83.54768 354.6684 83.61691 -7.312317      118.2032 
1 1 1 -9  21 13 o 170.7255 64.96119 4.856366       5.960133      2.014436       8.758360      7.307567       8.134026  174.2999 74.08858 200.7673 76.00910 -26.46738      106.1438 
1 1 1 -9  21 14 o 172.2371 64.81773 5.236690       5.894009      4.965144       8.503932      5.487726       8.176482  186.7705 75.57245 187.8711 74.75791 -1.100540      106.3012 
1 1 1 -9  21 15 f 572.7443 30.48151 65.48499       6.755527      59.87140       9.571219      71.05781       9.536391  538.1245 46.24845 589.6545 41.91763 -51.53009      62.41800 
1 1 1 -9  21 16 o 481.9111 36.37338 47.18848       6.757200      53.27231       9.914376      41.91090       9.234096  501.3173 51.66450 441.7594 55.01671 59.55789       75.47224 
1 1 1 -9  21 17 o 181.0904 78.94862 2.829738       10.44077      -3.713721      16.79052      6.954957       13.33165  193.1622 90.27448 210.4941 90.48519 -17.33191      127.8165 
1 1 1 -9  21 18 o 353.8956 75.23316 30.59452       10.02136      30.59452       10.02136      0.000000       0.000000  353.8956 75.23316 ?        ?        0.000000       75.23316 
1 1 1 -9  21 19 o 388.0548 43.90001 32.22332       6.499491      37.20149       9.188909      27.23917       9.194431  401.3433 60.86433 330.2617 73.57153 71.08157       95.48422 
1 1 1 -9  21 20 o 314.2678 51.98207 22.40131       6.122477      22.23070       8.206424      22.61549       9.194568  293.2056 72.48182 287.3047 79.64126 5.900970       107.6863 
1 1 1 -9  21 21 o 120.6379 56.97216 -3.968615      6.999544      -0.9904510     11.05040      -5.964180      9.045583  155.5317 72.86239 130.4216 62.47886 25.11014       95.98195 
1 1 1 -9  21 22 o 228.8451 73.25142 15.31732       7.362406      -1.743308      12.60894      24.14313       9.068978  154.9873 74.11936 282.6619 79.35986 -127.6747      108.5894 
1 1 1 -9  21 23 o 196.2726 71.52438 11.73385       7.075582      20.52165       12.49832      7.589013       8.583525  220.3524 90.68187 168.8909 72.60338 51.46153       116.1656 
1 1 1 -9  22 1  o 733.1748 26.40758 105.2071       7.519070      102.8622       8.430912      114.3222       16.62259  724.1356 29.97965 751.4032 57.39781 -27.26758      64.75560 
1 1 1 -9  22 2  o 424.0699 31.31213 35.50501       5.120301      43.13443       6.188434      18.94567       9.117096  466.8940 34.37154 296.5768 78.08430 170.3173       85.31448 
1 1 1 -9  22 3  o 417.9064 32.45929 34.54105       5.226671      35.80008       6.258476      31.63868       9.502254  423.9801 38.42729 389.3544 65.14400 34.62576       75.63330 
1 1 1 -9  22 4  o 526.0878 33.62271 54.71325       6.833493      59.55730       9.144956      48.58872       10.28285  545.7889 43.50625 488.2719 55.19727 57.51694       70.28181 
1 1 1 -9  22 5  o 713.4168 27.32375 99.79182       7.570274      94.85670       9.913315      106.6960       11.72534  691.8329 37.03118 732.0293 41.41458 -40.19635      55.55606 
1 1 1 -9  22 6  o 679.1498 24.14018 90.27847       6.366988      89.74323       7.403998      91.79786       12.47459  676.1584 28.19615 675.5118 47.86147 0.6465454      55.54947 
1 1 1 -9  22 7  o 414.5662 35.91650 34.23545       5.725368      32.59071       6.796232      38.25625       10.62611  401.7861 44.29169 426.4111 66.32338 -24.62500      79.75302 
1 1 1 -9  22 8  o 433.9868 35.16514 37.50109       5.875798      29.24572       6.993208      57.32151       10.83589  378.4427 48.71359 529.4233 53.43379 -150.9806      72.30618 
1 1 1 -9  22 9  o 247.0444 58.95906 13.00216       5.577945      16.77268       6.729344      4.723487       9.971321  279.6468 63.42242 198.9391 81.33123 80.70772       103.1367 
1 1 1 -9  22 10 o 124.1921 56.54367 -3.041900      5.996767      -2.590904      7.453460      -3.869669      10.09779  142.3382 64.09327 162.1094 73.63939 -19.77121      97.62534 
1 1 1 -9  22 11 o 202.6264 66.49905 8.571409       6.045670      13.44969       10.03881      5.795318       7.572963  248.5006 85.71394 188.0126 72.79315 60.48793       112.4532 
1 1 1 -9  22 12 o 93.81406 45.80292 -9.463699      5.477506      -12.66668      7.753767      -6.272926      7.738979  112.1251 54.68821 130.0885 60.95335 -17.96336      81.89085 
1 1 1 -9  22 13 o 637.2859 31.24508 80.83533       7.732928      77.36842       9.395504      88.11533       13.61490  617.9709 39.35414 647.5255 54.65210 -29.55457      67.34687 
1 1 1 -9  22 14 o 238.4776 63.99557 12.77745       6.050381      13.26102       8.685092      12.32149       8.433514  239.3164 79.76041 232.2598 78.59612 7.056625       111.9780 
1 1 1 -9  22 15 f 274.6680 59.21764 16.79827       6.130723      17.96741       8.820179      15.70544       8.527530  272.4257 78.85383 255.4392 78.42970 16.98647       111.2167 
1 1 1 -9  22 16 o 430.7589 46.50540 39.25198       7.656322      44.21198       9.592797      30.54750       12.70796  449.3140 56.20489 337.9513 93.61062 111.3627       109.1876 
1 1 1 -9  22 17 o 180.0052 71.19006 6.307183       7.372738      10.75134       9.160031      -1.868155      12.42382  212.8215 80.63950 172.0281 79.44794 40.79338       113.2021 
1 1 1 -9  22 18 o 133.5685 59.47406 -0.9081540E-01 6.225333      -3.228648      8.813525      3.033418       8.794406  142.1090 66.07492 166.2769 72.47478 -24.16792      98.07390 
1 1 1 -9  22 19 o 204.7414 72.41486 10.82054       7.191643      10.42032       11.96591      11.04686       8.998095  203.7653 86.60579 205.0130 79.35522 -1.247711      117.4641 
1 1 1 -9  22 20 o 198.6488 72.17497 10.65627       7.197162      12.57805       11.20166      9.305163       9.392360  205.8177 85.38003 189.5485 78.36903 16.26920       115.8941 
1 1 1 -9  22 21 o 149.0768 68.04558 1.630665       8.754394      0.000000       0.000000      1.630665       8.754394  ?        ?        149.0768 68.04558 0.000000       68.04558 
1 1 1 -9  22 22 o 232.4306 72.17545 16.19068       7.198625      17.68920       12.41861      15.43235       8.834236  209.9996 88.68837 214.0231 79.58688 -4.023499      119.1625 
1 1 1 -9  23 1  o 981.5118 23.13481 188.3899       8.818392      180.9608       9.994534      214.4993       18.73672  960.8134 26.78524 1036.253 46.55861 -75.43927      53.71362 
1 1 1 -9  23 2  o 232.6206 54.56012 11.34353       4.843672      12.04717       5.798915      9.719711       8.809291  238.5275 62.02147 224.8836 80.08121 13.64383       101.2900 
1 1 1 -9  23 3  o 311.4244 44.28655 19.70195       5.205254      24.72317       6.267163      8.534583       9.346345  348.4268 47.55815 219.0846 81.78364 129.3422       94.60625 
1 1 1 -9  23 4  o 291.2174 60.91360 17.92861       6.667613      18.30694       8.911930      17.44759       10.04900  289.3224 77.68050 281.9343 84.84525 7.388153       115.0347 
1 1 1 -9  23 5  o 203.5849 62.31840 8.622219       5.388555      3.379014       6.372794      21.77397       10.09307  165.1679 65.91243 313.2487 82.00557 -148.0807      105.2110 
1 1 1 -9  23 6  o 457.3656 32.79765 41.53265       5.786836      42.95993       6.853733      37.98858       10.80000  463.3235 38.43743 422.4299 68.15212 40.89365       78.24416 
1 1 1 -9  23 7  o 313.9127 46.78887 20.24805       5.529735      25.81829       6.601470      7.147453       10.12394  354.1992 49.33076 212.2598 83.58815 141.9394       97.05927 
1 1 1 -9  23 8  o 111.5993 52.09816 -4.705538      5.567667      -1.084151      6.776443      -12.22897      9.767250  142.0285 62.70357 134.1251 64.43002 7.903488       89.90530 
1 1 1 -9  23 9  o 226.1080 72.57507 11.03834       7.223283      16.58404       10.00584      5.002783       10.43841  270.0630 85.28446 200.5832 82.74776 69.47980       118.8303 
1 1 1 -9  23 10 o 184.3766 65.18179 6.694057       5.826087      8.353226       6.984540      2.899196       10.56308  202.5958 71.39581 190.1995 81.11768 12.39632       108.0622 
1 1 1 -9  23 11 o 299.9121 57.85274 19.41675       6.494059      22.11367       8.017649      14.27259       11.07312  315.3059 67.51294 251.0402 89.74191 64.26578       112.3014 
1 1 1 -9  23 12 o 181.1178 64.06833 6.626651       5.629557      3.348009       7.909368      9.993002       8.014463  171.9609 71.57333 215.2168 76.41038 -43.25587      104.6962 
1 1 1 -9  23 13 o 156.9162 62.69629 3.614955       5.773117      -4.347772      8.251022      11.25194       8.080490  139.4207 64.51392 222.6508 76.89464 -83.23009      100.3735 
1 1 1 -9  23 14 o 137.3770 59.80667 0.3992469      5.972913      16.84710       8.581634      -15.05527      8.318461  262.9211 78.24487 110.4016 54.41082 152.5195       95.30371 
1 1 1 -9  23 15 f 357.9729 66.99966 29.72802       8.971954      29.72802       8.971954      0.000000       0.000000  357.9729 66.99966 ?        ?        0.000000       66.99966 
1 1 1 -9  23 16 o 407.3141 47.30337 35.72010       7.343215      41.10304       9.116479      25.77528       12.39127  429.1552 56.03749 299.2057 94.95248 129.9495       110.2550 
1 1 1 -9  23 17 o 160.2882 66.60276 4.092032       6.832514      -0.6953673     8.322307      13.99087       11.96702  147.0111 66.80854 225.4114 90.19497 -78.40027      112.2431 
1 1 1 -9  23 18 o 118.5610 55.03910 -2.672063      6.076922      -9.364566      8.415712      4.619442       8.784260  119.0337 57.81248 169.0986 73.07017 -50.06487      93.17474 
1 1 1 -9  23 19 o 117.7696 56.24311 -5.369677      7.208427      8.537562       11.78429      -13.68467      9.112003  188.4672 82.97206 113.5909 56.16333 74.87631       100.1932 
1 1 1 -9  23 20 o 228.3377 82.07532 16.93072       9.274039      0.000000       0.000000      16.93072       9.274039  ?        ?        228.3377 82.07532 0.000000       82.07532 
1 1 1 -9  23 21 o 136.2682 64.24331 -1.476716      8.831021      0.000000       0.000000      -1.476716      8.831021  ?        ?        136.2682 64.24331 0.000000       64.24331 
1 1 1 -9  24 1  o 179.6231 62.08524 6.214458       5.268234      16.33269       6.994809      -7.048829      8.008461  275.1761 66.24928 132.0141 61.90340 143.1619       90.66972 
1 1 1 -9  24 2  f 430.4608 35.53741 36.97953       5.887716      45.90211       7.594299      23.53636       9.321666  477.7305 41.34076 327.3711 74.93829 150.3594       85.58508 
1 1 1 -9  24 3  o 322.8769 54.09228 21.75726       6.542747      26.40323       8.981649      16.50450       9.550182  349.8072 68.56625 272.4881 82.87256 77.31906       107.5602 
1 1 1 -9  24 4  o 162.3145 65.54820 3.085479       6.384032      -0.9207820     8.409828      8.533667       9.807165  158.8912 70.01558 218.2127 83.25788 -59.32150      108.7844 
1 1 1 -9  24 5  o 600.0137 26.54602 70.85146       6.185696      72.03478       7.310263      67.86820       11.60719  602.6580 31.34262 574.1190 52.64550 28.53894       61.26915 
1 1 1 -9  24 6  o 243.2260 58.51679 12.73193       5.460145      3.595956       6.354513      38.50850       10.67376  164.7450 65.79412 422.4865 67.31316 -257.7415      94.12719 
1 1 1 -9  24 7  o 601.7888 29.85911 71.68224       6.978289      81.83833       8.719893      53.59276       11.63753  639.7443 35.23338 502.7933 60.83735 136.9509       70.30344 
1 1 1 -9  24 8  o 210.4652 69.28115 9.482075       6.560281      4.851852       8.401484      16.71580       10.50113  185.7984 75.13801 268.2917 87.62208 -82.49323      115.4268 
1 1 1 -9  24 9  o 488.0548 33.29077 47.74973       6.272206      49.94272       7.532095      42.78918       11.32825  496.1112 39.41880 440.7000 68.40773 55.41119       78.95226 
1 1 1 -9  24 10 o 373.8982 41.71060 28.74358       5.953362      30.48053       7.062275      24.47829       11.06689  381.3964 48.79938 317.1084 87.16503 64.28796       99.89555 
1 1 1 -9  24 11 o 745.3233 27.14910 110.2682       7.858290      124.8820       9.937372      85.87698       12.83828  789.5295 32.40971 637.5829 52.31006 151.9466       61.53643 
1 1 1 -9  24 12 o 150.3732 63.76997 1.859623       6.463254      1.717169       7.989963      2.129307       10.99349  161.6125 69.76204 182.8706 80.33231 -21.25807      106.3956 
1 1 1 -9  24 13 o 222.7457 71.17435 11.69998       6.953122      6.398182       8.110944      26.39597       13.50390  186.2697 74.35149 307.0927 99.30116 -120.8230      124.0519 
1 1 1 -9  24 14 o 119.1816 55.03719 -3.032926      5.960309      -9.254704      8.407409      3.253624       8.451059  123.1295 59.30719 168.7547 72.27855 -45.62522      93.49615 
1 1 1 -9  24 15 o 120.4827 55.65307 -2.822496      6.100542      4.341810       8.558698      -10.22179      8.697926  172.2194 73.22255 121.9933 59.14014 50.22617       94.12278 
1 1 1 -9  24 16 o 261.7052 67.51614 17.08092       6.907391      15.11385       8.601677      20.65261       11.59074  235.6850 79.37770 260.4779 91.95351 -24.79298      121.4754 
1 1 1 -9  24 17 o 189.1581 74.57871 8.897941       8.068051      1.648142       11.58658      15.72191       11.24115  168.3280 77.37070 226.0732 88.36359 -57.74529      117.4493 
1 1 1 -9  24 18 o 114.5732 54.83968 -5.548357      6.935593      2.789223       11.77488      -9.977724      8.582368  168.2040 77.56373 116.7589 57.07538 51.44509       96.30021 
1 1 1 -9  24 19 o 132.0164 62.40649 -2.926682      8.435639      0.000000       0.000000      -2.926682      8.435639  ?        ?        132.0164 62.40649 0.000000       62.40649 
1 1 1 -9  25 1  o 249.0811 58.08151 13.32989       5.514958      14.83676       7.056976      10.96577       8.839242  259.4686 68.88244 228.9729 80.34718 30.49567       105.8322 
1 1 1 -9  25 2  o 309.9121 50.24902 20.04600       5.840660      17.77371       7.577066      23.37303       9.168493  283.4996 69.38425 323.3123 74.54590 -39.81265      101.8394 
1 1 1 -9  25 3  o 182.4741 72.98493 4.761894       7.832425      1.292145       13.93015      6.365924       9.471375  205.1040 90.25546 201.6434 80.39016 3.460526       120.8661 
1 1 1 -9  25 4  o 237.0242 63.77585 12.32056       5.999382      14.06278       7.564280      9.366261       9.850146  250.5882 73.16634 220.1894 83.57629 30.39879       111.0779 
1 1 1 -9  25 5  o 589.6604 34.37554 69.61371       7.837761      70.38931       10.61144      68.68262       11.62651  585.3586 47.07743 574.2415 52.72352 11.11713       70.68277 
1 1 1 -9  25 6  o 216.4339 70.84091 10.21939       6.862607      6.106934       9.559159      14.59311       9.858130  198.5238 80.19559 252.1527 84.97729 -53.62894      116.8438 
1 1 1 -9  25 7  o 281.6614 60.69341 17.42042       6.443118      11.84965       8.275009      25.99781       10.26806  230.1355 77.85413 332.9633 80.33238 -102.8278      111.8685 
1 1 1 -9  25 8  o 454.5933 34.26606 41.67675       6.004962      43.10027       7.089691      38.06290       11.29614  459.2030 40.15911 408.3716 73.95000 50.83142       84.15079 
1 1 1 -9  25 9  o 124.3025 55.91476 -1.631593      5.655705      -3.138389      6.642909      2.338177       10.78235  128.2934 58.82667 184.0922 80.24428 -55.79877      99.49734 
1 1 1 -9  25 10 o 640.5486 28.10983 81.77331       6.992595      89.42612       8.213957      61.62576       13.32764  667.5345 31.68478 523.0006 67.17046 144.5339       74.26840 
1 1 1 -9  25 11 o 391.4588 42.55496 32.01637       6.365193      31.95002       7.447344      32.19622       12.26118  385.3365 51.02074 352.8538 89.37706 32.48273       102.9144 
1 1 1 -9  25 12 o 131.6570 59.07848 -1.002487      6.271173      -4.867410      7.328087      9.572575       12.12165  126.3780 59.24614 213.7928 88.76329 -87.41483      106.7194 
1 1 1 -9  25 13 o 382.3475 41.96133 30.90403       6.128257      39.66043       8.797500      22.64982       8.541499  422.0745 54.97619 302.0212 73.51566 120.0532       91.79833 
1 1 1 -9  25 14 o 131.5333 60.14199 -1.731086      6.876167      -5.607692      11.06039      0.7111682      8.778897  149.8781 71.03003 155.6408 69.86607 -5.762680      99.63199 
1 1 1 -9  25 15 o 257.6839 76.16926 17.92809       8.153375      8.603727       11.67669      26.80004       11.38989  195.9252 84.45463 298.1025 90.46784 -102.1774      123.7619 
1 1 1 -9  25 16 o 146.8736 64.10063 2.369350       6.899472      -2.397515      11.57110      4.999109       8.594413  155.4626 73.36726 167.9003 72.41473 -12.43761      103.0856 
1 1 1 -9  25 17 f 174.2041 68.69162 7.466893       6.845393      11.38653       12.00117      5.576659       8.334100  197.5170 85.37910 166.7262 71.60300 30.79082       111.4297 
1 1 1 -9  25 18 o 122.9054 57.79447 -2.766845      7.064410      11.97254       12.38969      -9.867164      8.599230  194.7960 85.43291 115.4070 56.56563 79.38898       102.4620 
1 1 1 -9  26 1  o 371.8708 38.53436 28.10390       5.484270      30.37932       7.543563      25.55290       7.987304  379.8983 52.53671 342.6465 62.31987 37.25171       81.50995 
1 1 1 -9  26 2  o 243.5693 62.93288 13.13416       5.995428      8.889393       7.872264      18.99641       9.251338  208.0955 75.50297 284.9662 80.20553 -76.87070      110.1527 
1 1 1 -9  26 3  o 135.0518 57.05349 1.088545       5.141848      -6.866954      6.230348      18.08010       9.105319  110.6488 52.68868 277.5353 80.05631 -166.8865      95.83898 
1 1 1 -9  26 4  o 297.0403 60.56590 19.37079       6.749815      19.66546       9.393424      19.05621       9.705588  288.0284 80.73186 282.4425 82.99547 5.585907       115.7838 
1 1 1 -9  26 5  o 282.2314 58.61003 17.47727       6.213922      20.69454       7.937349      12.38360       9.987275  301.4725 69.25253 234.3307 85.03962 67.14177       109.6706 
1 1 1 -9  26 6  o 127.9393 57.92860 -2.117094      6.186916      -12.89599      7.749945      16.82339       10.27323  110.1732 53.93642 262.4555 86.71225 -152.2823      102.1183 
1 1 1 -9  26 7  o 635.9223 30.94115 80.95848       7.641323      81.60275       9.550938      79.81266       12.73723  631.7701 39.12017 610.9456 54.24831 20.82446       66.88248 
1 1 1 -9  26 8  o 246.7698 69.58021 14.29664       6.956019      22.55429       8.830360      0.7931247      11.29207  307.2386 74.72560 178.7632 79.81179 128.4755       109.3336 
1 1 1 -9  26 9  o 174.4410 68.58324 5.548233       6.805091      -0.7657875     8.562101      16.37765       11.21321  153.2344 68.87574 251.5747 90.26800 -98.34030      113.5437 
1 1 1 -9  26 10 o 351.5789 55.78004 27.44788       7.361747      34.23824       9.320488      16.18569       12.00339  385.6661 64.50832 246.4596 92.54856 139.2066       112.8120 
1 1 1 -9  26 11 o 142.2878 63.80113 -0.4195044     7.299391      -3.012290      9.252975      3.852655       11.87741  147.4937 68.27393 186.4632 82.63226 -38.96948      107.1887 
1 1 1 -9  26 12 o 389.4408 54.32096 34.09738       7.991881      41.93255       10.05246      20.63830       13.17516  422.8272 63.15398 258.8311 97.00641 163.9961       115.7526 
1 1 1 -9  26 13 o 299.0439 68.92284 22.39540       7.840109      24.22729       9.751158      19.04593       13.18542  296.1053 81.99339 244.7266 95.68784 51.37869       126.0122 
1 1 1 -9  26 14 o 518.9469 43.54404 58.53280       8.694531      70.78096       13.22195      49.20150       11.54067  538.9267 64.45261 441.9921 69.53044 96.93463       94.80834 
1 1 1 -9  26 15 o 217.7287 76.43331 13.50774       7.999457      19.78728       11.92060      8.363199       10.78964  240.9333 91.82373 187.1484 80.92596 53.78488       122.3953 
1 1 1 -9  26 16 o 145.4450 63.41871 2.766817       6.739583      4.721974       12.01825      1.869924       8.139934  173.1736 79.30244 148.7673 66.98480 24.40625       103.8068 
1 1 1 -9  27 1  o 156.8788 64.67924 2.912154       6.372782      -3.839587      12.98597      5.053989       7.314075  176.6164 81.44713 176.8845 70.60488 -0.2680664     107.7900 
1 1 1 -9  27 2  o 474.4573 43.21652 46.58633       7.875649      59.35302       12.64227      38.48964       10.06791  517.8778 64.23856 415.9109 64.41460 101.9669       90.97161 
1 1 1 -9  27 3  o 532.9041 54.84203 60.97112       11.18782      0.000000       0.000000      60.97112       11.18782  ?        ?        532.9041 54.84203 0.000000       54.84203 
1 1 1 -9  27 4  o 523.1890 28.46661 54.75722       5.762156      50.31628       6.710226      67.22691       11.24416  497.7875 34.93208 561.3331 52.17683 -63.54556      62.79070 
1 1 1 -9  27 5  o 133.5645 56.82938 1.142044       5.162327      -0.9794876E-01 6.067572      4.392680       9.824027  135.3741 59.56892 184.8131 78.50986 -49.43904      98.55077 
1 1 1 -9  27 6  o 252.7825 56.59563 14.32265       5.417594      8.662491       6.383053      28.90414       10.24507  196.6525 68.31829 343.4329 78.52413 -146.7804      104.0838 
1 1 1 -9  27 7  o 439.0048 35.18298 39.48801       5.947924      30.19171       6.926154      65.60268       11.60858  374.6641 48.75684 546.7941 55.43347 -172.1300      73.82479 
1 1 1 -9  27 8  o 468.1687 34.73345 44.97003       6.270049      44.30209       7.336818      46.77907       12.07436  459.4376 41.57025 440.6393 73.12261 18.79825       84.11303 
1 1 1 -9  27 9  o 160.6218 66.55695 3.917926       6.796116      10.25508       8.509115      -7.246045      11.29397  206.4625 77.84346 148.9551 70.93200 57.50735       105.3136 
1 1 1 -9  27 10 o 335.2374 59.12535 26.01724       7.416247      37.10286       9.466921      8.406501       11.93212  396.6898 63.59994 200.6141 85.90302 196.0757       106.8844 
1 1 1 -9  27 11 o 203.8597 72.89082 10.53888       7.305438      24.97972       9.372693      -11.81450      11.66111  305.7599 78.52305 138.2648 67.35602 167.4951       103.4539 
1 1 1 -9  27 12 o 289.9502 69.29082 21.46327       7.695994      18.11095       9.758728      26.97793       12.51642  247.7958 84.54268 287.6263 95.74500 -39.83052      127.7285 
1 1 1 -9  27 13 f 167.3812 70.30538 5.492382       7.735609      5.062019       9.713140      6.238719       12.79117  172.2074 75.58217 185.1373 83.60828 -12.92995      112.7076 
1 1 1 -9  27 14 o 165.9697 73.95068 4.150349       9.642117      4.150349       9.642117      0.000000       0.000000  165.9697 73.95068 ?        ?        0.000000       73.95068 
1 1 1 -9  28 1  o 167.6329 69.31948 4.002176       7.350217      0.000000       0.000000      4.002176       7.350217  ?        ?        167.6329 69.31948 0.000000       69.31948 
1 1 1 -9  28 2  o 211.0685 64.30643 10.32130       5.746711      15.65953       7.449622      2.476357       9.030899  254.3807 72.10497 169.7647 73.72234 84.61598       103.1218 
1 1 1 -9  28 3  o 162.0934 60.95782 5.107552       5.211164      5.270678       6.105189      4.669690       10.00243  167.9382 65.26462 184.2729 78.77140 -16.33473      102.2957 
1 1 1 -9  28 4  o 333.5542 41.71341 23.44707       5.285289      20.22350       6.160183      32.43970       10.28887  301.3146 54.65640 364.3627 75.20535 -63.04807      92.96863 
1 1 1 -9  28 5  o 164.3893 61.89497 5.414575       5.375737      10.21103       6.410814      -5.946952      9.866687  207.1395 68.50190 143.4453 67.71203 63.69418       96.31941 
1 1 1 -9  28 6  o 134.9792 57.56627 1.498458       5.319689      2.073222       6.349084      0.1443453      9.745265  146.8793 62.77177 161.3607 72.91444 -14.48145      96.21232 
1 1 1 -9  28 7  o 115.6263 52.91007 -2.002146      5.336182      0.1630191      6.321646      -7.368675      9.952483  135.7669 60.21933 138.5698 66.15173 -2.802902      89.45625 
1 1 1 -9  28 8  o 460.8710 34.07675 43.90228       6.055852      44.36653       7.112120      42.67820       11.54856  457.7870 40.41951 410.9788 75.12542 46.80829       85.30865 
1 1 1 -9  28 9  o 159.9309 62.99009 5.066138       5.749937      3.815620       6.701741      8.554650       11.19342  156.5106 65.57347 196.2462 83.59497 -39.73560      106.2450 
1 1 1 -9  28 10 o 142.5762 61.06476 2.323423       6.031919      -4.060679      7.177246      17.67688       11.13040  123.6548 58.18076 239.8127 89.30225 -116.1580      106.5828 
1 1 1 -9  28 11 o 254.7740 62.21790 16.06750       6.102793      12.09760       7.088336      27.44060       11.99760  212.6811 72.05538 291.2723 93.53796 -78.59122      118.0734 
1 1 1 -9  29 1  o 253.4789 58.79789 14.83085       5.675891      15.03752       9.096338      14.69908       7.263336  240.0643 81.62440 243.4482 71.87209 -3.383896      108.7572 
1 1 1 -9  29 2  o 94.85828 46.68375 -10.74211      6.051304      -19.35503      8.607164      -2.323848      8.509348  103.3718 51.67260 143.9810 66.22614 -40.60919      83.99976 
1 1 1 -9  29 3  o 181.2069 62.69821 7.472622       5.373454      7.864072       6.677668      6.753494       9.050864  186.5811 69.23133 186.4997 77.00542 0.8142090E-01  103.5510 
1 1 1 -9  29 4  o 546.6069 28.29253 60.42600       5.985284      62.45904       7.162743      55.72155       10.89585  551.2726 33.61750 495.1264 57.75034 56.14621       66.82244 
1 1 1 -9  29 5  o 148.7453 59.14023 3.876160       5.113160      11.78248       6.099746      -14.80912      9.377226  218.8791 66.15575 116.9911 57.68004 101.8880       87.76999 
1 1 1 -9  29 6  o 172.0193 61.48269 6.692606       5.197171      7.212009       6.098549      5.314706       9.933061  178.1018 66.14614 179.6553 77.66658 -1.553574      102.0167 
1 1 1 -9  29 7  o 386.0821 38.23116 31.50184       5.656903      27.83300       6.657028      41.03494       10.73084  353.0452 49.94771 405.4482 70.72270 -52.40298      86.58218 
1 1 1 -8  0  1  o 629.2314 19.13391 77.17698       4.665866      77.17698       4.665866      77.17698       4.665866  629.2314 19.13391 629.2314 19.13391 0.000000       0.000000 
1 1 1 -8  0  2  o 102.9569 54.81239 2.983487       2.969536      2.983487       2.969536      2.983487       2.969536  102.9569 54.81239 102.9569 54.81239 0.000000       0.000000 
1 1 1 -8  0  3  o 253.8585 37.81837 13.36663       3.484787      13.36663       3.484787      13.36663       3.484787  253.8585 37.81837 253.8585 37.81837 0.000000       0.000000 
1 1 1 -8  0  4  o 101.5123 57.55162 2.651716       3.507559      2.651716       3.507559      2.651716       3.507559  101.5123 57.55162 101.5123 57.55162 0.000000       0.000000 
1 1 1 -8  0  5  o 76.51020 49.80194 -0.2914364     3.573985      -0.2914364     3.573985      -0.2914364     3.573985  76.51020 49.80194 76.51020 49.80194 0.000000       0.000000 
1 1 1 -8  0  6  o 117.5998 69.08597 3.197612       5.334634      3.197612       5.334634      3.197612       5.334634  117.5998 69.08597 117.5998 69.08597 0.000000       0.000000 
1 1 1 -8  0  7  o 78.40721 53.77512 -3.495147      5.260718      -3.495147      5.260718      -3.495147      5.260718  78.40721 53.77512 78.40721 53.77512 0.000000       0.000000 
1 1 1 -8  0  8  o 668.7255 31.98055 87.79277       8.262128      87.79277       8.262128      87.79277       8.262128  668.7255 31.98055 668.7255 31.98055 0.000000       0.000000 
1 1 1 -8  0  9  o 438.9213 30.26986 38.09637       5.103359      38.09637       5.103359      38.09637       5.103359  438.9213 30.26986 438.9213 30.26986 0.000000       0.000000 
1 1 1 -8  0  10 o 865.5184 21.84384 146.1076       7.331752      146.1076       7.331752      146.1076       7.331752  865.5184 21.84384 865.5184 21.84384 0.000000       0.000000 
1 1 1 -8  0  11 o 397.8026 34.08995 31.60550       5.177522      31.60550       5.177522      31.60550       5.177522  397.8026 34.08995 397.8026 34.08995 0.000000       0.000000 
1 1 1 -8  0  12 o 487.0286 43.94481 47.72882       8.156088      47.72882       8.156088      47.72882       8.156088  487.0286 43.94481 487.0286 43.94481 0.000000       0.000000 
1 1 1 -8  0  13 o 308.8683 70.20090 21.61997       7.340314      21.61997       7.340314      21.61997       7.340314  308.8683 70.20090 308.8683 70.20090 0.000000       0.000000 
1 1 1 -8  0  14 o 824.8392 24.34525 132.9750       7.783133      132.9750       7.783133      132.9750       7.783133  824.8392 24.34525 824.8392 24.34525 0.000000       0.000000 
1 1 1 -8  0  15 o 87.01410 57.83703 -1.341663      5.223995      -1.341663      5.223995      -1.341663      5.223995  87.01410 57.83703 87.01410 57.83703 0.000000       0.000000 
1 1 1 -8  0  16 o 110.8788 68.16514 2.074571       5.686911      2.074571       5.686911      2.074571       5.686911  110.8788 68.16514 110.8788 68.16514 0.000000       0.000000 
1 1 1 -8  0  17 o 262.1151 71.61003 16.25228       6.302079      16.25228       6.302079      16.25228       6.302079  262.1151 71.61003 262.1151 71.61003 0.000000       0.000000 
1 1 1 -8  0  18 o 121.3822 73.76790 2.794596       6.489159      2.794596       6.489159      2.794596       6.489159  121.3822 73.76790 121.3822 73.76790 0.000000       0.000000 
1 1 1 -8  0  19 o 119.8478 72.67322 2.751196       6.268190      2.751196       6.268190      2.751196       6.268190  119.8478 72.67322 119.8478 72.67322 0.000000       0.000000 
1 1 1 -8  0  20 o 951.3635 27.27258 176.6705       10.05756      176.6705       10.05756      176.6705       10.05756  951.3635 27.27258 951.3635 27.27258 0.000000       0.000000 
1 1 1 -8  0  21 o 93.59251 63.45792 -3.435040      6.891460      -3.435040      6.891460      -3.435040      6.891460  93.59251 63.45792 93.59251 63.45792 0.000000       0.000000 
1 1 1 -8  0  22 o 546.0313 39.78684 59.18148       8.333991      59.18148       8.333991      59.18148       8.333991  546.0313 39.78684 546.0313 39.78684 0.000000       0.000000 
1 1 1 -8  0  23 o 141.3817 83.95144 4.584835       8.028217      4.584835       8.028217      4.584835       8.028217  141.3817 83.95144 141.3817 83.95144 0.000000       0.000000 
1 1 1 -8  0  24 o 500.5158 48.88060 50.64069       9.293255      50.64069       9.293255      50.64069       9.293255  500.5158 48.88060 500.5158 48.88060 0.000000       0.000000 
1 1 1 -8  0  25 o 196.2995 96.72633 11.61554       8.817768      11.61554       8.817768      11.61554       8.817768  196.2995 96.72633 196.2995 96.72633 0.000000       0.000000 
1 1 1 -8  0  26 o 209.0579 114.3095 13.38322       13.24595      13.38322       13.24595      13.38322       13.24595  209.0579 114.3095 209.0579 114.3095 0.000000       0.000000 
1 1 1 -8  0  27 o 250.8603 120.8410 19.93709       13.64641      19.93709       13.64641      19.93709       13.64641  250.8603 120.8410 250.8603 120.8410 0.000000       0.000000 
1 1 1 -8  0  28 o 146.9478 90.09896 4.667534       9.876469      4.667534       9.876469      4.667534       9.876469  146.9478 90.09896 146.9478 90.09896 0.000000       0.000000 
1 1 1 -8  0  29 o 242.0465 104.5276 17.97910       10.11198      17.97910       10.11198      17.97910       10.11198  242.0465 104.5276 242.0465 104.5276 0.000000       0.000000 
1 1 1 -8  0  30 o 118.3879 82.80779 -10.21258      14.13655      -10.21258      14.13655      -10.21258      14.13655  118.3879 82.80779 118.3879 82.80779 0.000000       0.000000 
1 1 1 -8  0  31 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -8  0  32 o 172.7154 99.51071 11.10127       10.72848      11.10127       10.72848      11.10127       10.72848  172.7154 99.51071 172.7154 99.51071 0.000000       0.000000 
1 1 1 -8  0  33 o 126.8382 83.35570 2.545946       10.37160      2.545946       10.37160      2.545946       10.37160  126.8382 83.35570 126.8382 83.35570 0.000000       0.000000 
1 1 1 -8  1  1  o 738.4931 13.00131 106.0187       3.728736      101.5941       5.155529      110.8719       5.399375  722.5108 18.37388 754.7766 18.42032 -32.26575      26.01745 
1 1 1 -8  1  2  o 240.7973 25.60665 11.43581       2.357853      13.20547       3.361877      9.722636       3.307796  257.4997 34.48451 219.1846 40.34648 38.31503       53.07560 
1 1 1 -8  1  3  o 319.7203 20.71743 19.99251       2.558532      16.49088       3.536697      23.83710       3.705848  288.6224 32.09657 348.3486 27.61981 -59.72617      42.34434 
1 1 1 -8  1  4  o 393.5179 18.76365 30.14915       2.867543      30.08275       4.118399      30.21164       3.995049  391.5799 27.25179 392.5511 26.35875 -0.9712830     37.91364 
1 1 1 -8  1  5  o 225.8195 30.71011 10.15639       2.623356      12.73124       3.827973      7.876228       3.602275  251.3288 40.60349 195.7772 47.79571 55.55153       62.71422 
1 1 1 -8  1  6  o 790.2670 16.59656 121.5596       5.093542      126.8618       8.915762      118.9906       6.206007  805.4359 28.50358 781.3857 20.45120 24.05017       35.08142 
1 1 1 -8  1  7  o 293.0527 36.90318 17.14978       4.106752      14.53064       5.882148      19.64059       5.736248  264.2878 58.82418 310.9132 49.14040 -46.62537      76.64896 
1 1 1 -8  1  8  f 88.64993 40.88400 -2.497467      3.272966      -5.105511      4.156168      1.760475       5.310501  90.82865 43.18903 145.1278 59.34536 -54.29919      73.39730 
1 1 1 -8  1  9  o 186.6139 43.89201 7.194383       3.127645      7.342360       4.432877      7.047697       4.413502  189.1137 56.22589 185.8164 56.29828 3.297333       79.56663 
1 1 1 -8  1  10 o 403.6868 23.86712 32.01401       3.725101      36.74561       5.469469      27.92032       5.087430  430.4279 32.97096 374.2188 35.42797 56.20914       48.39654 
1 1 1 -8  1  11 o 336.4287 27.33357 22.39085       3.540349      22.50004       5.164332      22.29404       4.862874  333.5891 40.70779 332.7792 38.32817 0.8098755      55.91219 
1 1 1 -8  1  12 o 672.8354 25.42977 88.94408       6.644760      95.12117       9.548495      83.14378       9.252703  691.0461 35.70145 645.3182 37.07618 45.72791       51.47073 
1 1 1 -8  1  13 o 609.9760 26.97244 73.26125       6.389414      63.19209       8.855913      84.19319       9.227531  560.1100 40.99775 649.1150 36.75554 -89.00500      55.06165 
1 1 1 -8  1  14 o 160.7035 52.55748 5.157674       3.777656      10.73858       5.387025      -0.2421147     5.298889  223.4937 60.55905 130.0708 56.47792 93.42291       82.80793 
1 1 1 -8  1  15 o 555.8858 21.73833 60.52500       4.692884      65.73749       6.795618      55.77300       6.488509  576.1690 30.47884 530.1682 31.65854 46.00085       43.94568 
1 1 1 -8  1  16 o 611.3889 20.70410 73.10780       4.915887      82.32509       7.191301      65.02237       6.735309  646.6700 28.63497 573.4654 30.35086 73.20465       41.72692 
1 1 1 -8  1  17 o 614.8304 21.35301 73.91045       5.098501      69.77108       7.144007      78.20728       7.278617  594.3149 31.06046 630.4185 29.72980 -36.10358      42.99550 
1 1 1 -8  1  18 o 366.2997 33.71279 26.67142       4.741956      32.79934       6.687912      20.47624       6.724515  403.6993 43.33647 313.4354 57.35771 90.26392       71.88850 
1 1 1 -8  1  19 o 91.88693 44.18190 -6.631753      4.617970      -13.33702      6.249958      1.430468       6.853248  94.89730 46.84396 158.2926 66.31482 -63.39527      81.19121 
1 1 1 -8  1  20 o 983.2678 18.74346 188.5118       7.157304      180.3949       9.864530      197.5349       10.40065  959.9000 26.46198 1004.404 26.66391 -44.50439      37.56595 
1 1 1 -8  1  21 o 191.2192 61.53917 7.306441       5.190925      7.705449       7.435788      6.927135       7.249893  205.0421 73.51439 198.2270 72.37516 6.815094       103.1626 
1 1 1 -8  1  22 o 678.4410 24.22201 90.07693       6.381904      90.45473       8.944714      89.68520       9.108259  676.4452 34.15962 673.2752 34.95517 3.169983       48.87478 
1 1 1 -8  1  23 o 881.4299 21.60908 151.9756       7.396939      139.6208       10.35925      164.8273       10.56550  841.2894 31.70699 914.9462 29.73490 -73.65674      43.46835 
1 1 1 -8  1  24 o 686.3525 25.81498 92.58611       6.880927      83.86617       9.613187      101.7474       9.853462  647.4872 38.40183 715.7072 35.45076 -68.21991      52.26334 
1 1 1 -8  1  25 o 254.0164 64.37328 14.06897       6.358301      22.49092       9.125115      6.121142       8.864537  317.1465 75.22572 197.7128 78.10278 119.4338       108.4387 
1 1 1 -8  1  26 o 615.5635 37.39089 76.19201       8.896212      75.90134       10.97128      76.74999       15.20110  608.5580 46.78057 596.2920 66.79011 12.26599       81.54349 
1 1 1 -8  1  27 o 382.2514 58.12935 31.52623       8.357332      53.81789       14.51648      20.47479       10.22114  481.6121 80.45121 291.0550 85.07027 190.5572       117.0869 
1 1 1 -8  1  28 o 115.8552 55.15715 -6.802137      6.820842      5.024544       9.440374      -19.71915      9.865949  185.8619 77.84655 115.4905 57.33619 70.37138       96.68259 
1 1 1 -8  1  29 o 185.9391 71.04170 7.495474       7.146488      0.9299637E-01  10.01311      15.18120       10.20288  163.1770 73.80647 238.4384 86.04102 -75.26138      113.3598 
1 1 1 -8  1  30 o 511.8050 57.72297 60.79439       11.27272      66.94896       15.65230      54.16206       16.24846  495.7128 84.32520 415.5504 101.5461 80.16248       131.9937 
1 1 1 -8  1  31 o 159.1526 70.70319 3.711542       8.747666      2.392357       10.78150      6.253042       14.96482  162.0600 74.54314 183.5172 85.58472 -21.45718      113.4964 
1 1 1 -8  1  32 o 83.11797 42.27113 -22.52608      7.367415      -10.91263      10.36660      -34.37781      10.47241  121.5172 60.04897 93.32829 47.71684 28.18890       76.69926 
1 1 1 -8  1  33 o 186.3670 71.87883 12.12175       7.361818      10.11091       10.48952      14.07362       10.33457  168.0124 75.80875 183.9128 79.36430 -15.90041      109.7527 
1 1 1 -8  2  1  o 1072.438 13.25347 223.5965       5.519884      217.3567       7.609735      230.5255       8.018919  1056.761 18.54235 1088.242 18.97415 -31.48145      26.52993 
1 1 1 -8  2  2  o 525.6227 14.98005 53.73170       3.057845      52.31470       4.294148      55.18940       4.355395  518.2261 21.33682 532.2952 21.06915 -14.06909      29.98615 
1 1 1 -8  2  3  o 874.2099 13.36065 148.5919       4.535982      144.7258       6.264325      152.8532       6.576769  862.2235 18.70796 886.0536 19.11281 -23.83008      26.74486 
1 1 1 -8  2  4  o 317.9914 22.06833 19.80234       2.708420      18.10290       3.936529      21.32994       3.732203  302.1057 34.15235 329.0332 29.52178 -26.92755      45.14331 
1 1 1 -8  2  5  o 86.48920 38.74908 -1.187373      2.686541      -2.400875      4.730684      -0.6097098     3.263932  112.5456 50.83399 101.0132 44.08694 11.53248       67.28858 
1 1 1 -8  2  6  o 313.0170 27.63176 19.30104       3.324476      22.08097       5.874670      17.99138       4.032240  330.8626 47.04521 300.7535 35.18812 30.10907       58.74909 
1 1 1 -8  2  7  o 286.7266 38.78843 16.48187       4.208280      12.97223       5.995696      19.88968       5.908083  248.9866 62.18983 312.4837 50.39923 -63.49712      80.04784 
1 1 1 -8  2  8  o 268.4799 35.20893 14.42289       3.582572      13.60301       4.363337      16.11907       6.275984  258.2214 45.15523 277.6377 59.96085 -19.41629      75.06196 
1 1 1 -8  2  9  o 372.4313 23.86178 27.24133       3.433100      32.35897       5.027617      22.77032       4.699271  404.2545 32.29383 337.6880 36.40915 66.56641       48.66742 
1 1 1 -8  2  10 o 657.5638 16.83221 84.31285       4.298401      83.27818       6.250245      85.24133       5.920836  651.9495 24.68625 659.9562 23.10149 -8.006714      33.80961 
1 1 1 -8  2  11 o 329.8012 27.87118 21.54228       3.536305      20.30198       5.000834      22.78284       5.001348  316.2641 41.73545 336.1759 39.03485 -19.91180      57.14514 
1 1 1 -8  2  12 o 684.1120 23.92821 91.83492       6.357193      80.96524       8.768640      103.8784       9.229945  637.4233 35.56402 724.2681 32.81495 -86.84473      48.39029 
1 1 1 -8  2  13 o 482.3456 30.76402 46.17512       5.732701      41.15963       8.480671      50.39521       7.779200  447.5719 49.62634 500.1736 40.39313 -52.60168      63.98733 
1 1 1 -8  2  14 o 375.9737 27.62522 27.99246       4.005338      31.26984       6.063867      25.45586       5.334734  393.3725 40.26064 354.8592 39.37430 38.51337       56.31389 
1 1 1 -8  2  15 o 340.5967 31.84781 23.12989       4.163683      19.51631       5.903047      26.70767       5.873737  306.1422 51.47747 362.7223 42.50352 -56.58011      66.75687 
1 1 1 -8  2  16 o 495.4896 24.42649 48.14614       4.700279      49.90608       6.471558      46.18126       6.837962  501.2662 33.43577 480.9411 36.89177 20.32510       49.78909 
1 1 1 -8  2  17 o 992.0400 17.50158 191.9685       6.742708      190.5886       9.477489      193.3827       9.594852  986.2371 24.74480 993.3944 24.87073 -7.157288      35.08360 
1 1 1 -8  2  18 o 637.0451 21.69588 79.30303       5.367541      78.55012       7.667848      80.02644       7.516124  631.8738 31.24749 638.0233 30.33398 -6.149475      43.54947 
1 1 1 -8  2  19 o 357.5497 36.14727 25.46996       4.950323      19.43787       7.017337      31.44557       6.984407  304.4485 61.46904 394.6743 46.45786 -90.22577      77.05047 
1 1 1 -8  2  20 o 172.7935 60.74733 5.451086       5.053875      3.631899       7.250268      7.170438       7.048518  175.6020 70.22590 199.0548 71.55253 -23.45282      100.2569 
1 1 1 -8  2  21 o 689.8347 23.41862 93.01429       6.273853      89.30123       8.779542      96.88900       8.968615  673.5986 33.56160 701.8144 32.90600 -28.21582      47.00198 
1 1 1 -8  2  22 o 460.8287 46.93565 42.85652       8.282575      0.000000       0.000000      42.85652       8.282575  ?        ?        460.8287 46.93565 0.000000       46.93565 
1 1 1 -8  2  23 o 199.1894 64.58691 8.105349       5.709713      10.48885       8.133377      5.789350       8.017380  226.4813 77.18223 192.9659 74.84612 33.51535       107.5130 
1 1 1 -8  2  24 o 899.5746 31.77117 160.0502       11.09937      0.000000       0.000000      160.0502       11.09937  ?        ?        899.5746 31.77117 0.000000       31.77117 
1 1 1 -8  2  25 o 235.3550 65.85982 12.07749       6.256723      15.42008       8.761399      8.598846       8.937926  262.1646 79.29706 213.3250 79.90919 48.83958       112.5767 
1 1 1 -8  2  26 o 157.5662 68.88914 0.1549497E-01  8.000283      -11.34004      9.624806      25.39956       14.39026  133.7399 64.16876 319.0667 102.4390 -185.3268      120.8775 
1 1 1 -8  2  27 o 344.8713 63.88250 26.30518       8.240837      28.21167       14.38110      25.37309       10.05553  327.9006 102.0460 327.7614 79.75600 0.1392822      129.5160 
1 1 1 -8  2  28 o 183.7016 70.38718 6.647834       7.027874      -0.4069650     10.04746      13.40581       9.833817  165.8627 74.57594 234.8387 84.50508 -68.97607      112.7062 
1 1 1 -8  2  29 o 298.8434 64.30422 21.10411       7.241731      3.557343       10.22479      38.76502       10.25800  177.3834 77.70805 404.0195 67.77850 -226.6362      103.1138 
1 1 1 -8  2  30 o 415.5846 96.14387 51.96262       15.20876      51.96262       15.20876      0.000000       0.000000  415.5846 96.14387 ?        ?        0.000000       96.14387 
1 1 1 -8  2  31 o 372.9656 63.43563 35.11418       8.859196      25.16106       10.82457      55.30685       15.41800  274.9420 88.90590 404.5598 98.95158 -129.6179      133.0251 
1 1 1 -8  2  32 o 122.7875 58.29593 -2.735965      7.515895      5.504224       10.52436      -11.31247      10.73699  161.6474 74.09257 122.5804 60.67226 39.06708       95.76446 
1 1 1 -8  2  33 o 109.9024 53.29224 -4.816710      7.074911      19.31975       10.41374      -25.50693      9.641674  207.9322 83.80623 93.89647 47.81097 114.0357       96.48508 
1 1 1 -8  3  1  o 1247.484 13.75273 302.5885       6.662723      301.0594       9.308732      304.1949       9.540570  1243.520 19.27568 1249.914 19.65469 -6.393433      27.52923 
1 1 1 -8  3  2  o 150.2378 38.75097 4.597094       2.275750      3.874454       3.166884      5.368741       3.272507  144.0807 48.16582 163.5498 48.23111 -19.46909      68.16294 
1 1 1 -8  3  3  o 619.9438 14.56248 74.74855       3.506030      73.52818       5.042685      75.89050       4.877969  614.3148 21.13698 624.2042 20.12261 -9.889465      29.18375 
1 1 1 -8  3  4  o 132.8712 44.73962 3.265078       2.732559      3.519704       4.627255      3.128734       3.386023  152.8600 57.44989 137.1582 49.55539 15.70181       75.86980 
1 1 1 -8  3  5  o 911.2988 15.99573 161.6110       5.660997      154.8986       9.543621      165.2549       7.031626  890.2485 27.60412 921.0009 19.65929 -30.75238      33.88916 
1 1 1 -8  3  6  f 192.7138 43.31991 7.619796       3.163262      12.91797       5.451741      4.930778       3.883910  249.3593 57.47530 160.8291 53.32517 88.53026       78.40271 
1 1 1 -8  3  7  o 514.3578 21.14902 51.61049       4.224579      49.00468       5.165124      56.87646       7.342577  499.8231 26.70616 536.6052 35.43376 -36.78207      44.37083 
1 1 1 -8  3  8  o 162.9133 50.16059 5.321079       3.485313      6.518543       4.280336      2.965011       6.004001  179.7897 55.62629 160.2881 63.97315 19.50154       84.77528 
1 1 1 -8  3  9  o 317.8942 26.86931 19.95087       3.286096      23.06195       4.777157      17.15662       4.527380  339.6594 36.80455 291.2640 41.17265 48.39542       55.22466 
1 1 1 -8  3  10 o 625.1662 17.34482 76.24078       4.211078      79.73351       6.091898      73.04454       5.827615  637.8483 24.59276 610.5103 24.57932 27.33801       34.76992 
1 1 1 -8  3  11 o 750.0323 16.68059 109.7571       4.858691      113.2076       6.999374      106.5481       6.749871  759.8831 23.71835 737.2365 23.57549 22.64661       33.44195 
1 1 1 -8  3  12 o 247.3018 54.12392 12.95334       5.053774      14.01541       7.655591      12.13302       6.728127  252.5963 73.56480 236.4847 68.99136 16.11160       100.8543 
1 1 1 -8  3  13 o 473.2264 31.28936 44.48262       5.717886      47.67820       8.504433      41.84639       7.724361  483.9867 45.79062 453.8097 44.39762 30.17706       63.78032 
1 1 1 -8  3  14 o 580.0880 20.31675 65.84975       4.576948      56.55813       6.256161      76.54977       6.713585  534.2826 30.27596 623.3693 27.73200 -89.08667      41.05725 
1 1 1 -8  3  15 o 807.3497 17.80523 127.2828       5.582610      132.3961       8.037552      122.5169       7.759778  821.0923 25.20599 789.8318 25.29803 31.26050       35.71180 
1 1 1 -8  3  16 o 815.4711 18.33859 129.8297       5.807677      126.5023       8.100977      133.3482       8.330420  802.7654 25.98488 824.1865 26.02636 -21.42108      36.77751 
1 1 1 -8  3  17 o 443.5051 27.42871 38.75316       4.701053      39.25568       6.506255      38.20424       6.800058  443.4362 38.15235 436.6420 40.56500 6.794220       55.68771 
1 1 1 -8  3  18 o 795.9301 19.53581 123.6326       6.038574      126.6718       8.415321      120.4066       8.670040  803.8323 26.95735 783.2621 28.50270 20.57019       39.23140 
1 1 1 -8  3  19 o 330.0539 39.17231 21.83263       4.923001      22.87415       6.627279      20.55032       7.353579  333.9018 52.86889 312.9474 62.69122 20.95438       82.00798 
1 1 1 -8  3  20 o 464.9336 29.94484 42.58228       5.378050      37.84365       7.491943      47.62008       7.724824  434.1868 45.08892 488.8128 41.07359 -54.62604      60.99221 
1 1 1 -8  3  21 o 806.3042 21.09252 126.9209       6.604735      127.6731       9.381131      126.1816       9.300405  806.4928 29.95206 801.7922 29.86841 4.700623       42.29950 
1 1 1 -8  3  22 o 374.6288 40.47611 28.16572       5.795225      26.02042       7.854300      30.72925       8.585843  353.4955 59.31413 384.7738 59.36803 -31.27826      83.92097 
1 1 1 -8  3  23 o 657.8064 25.90473 84.93951       6.617671      85.01694       9.384888      84.86294       9.332930  653.4130 37.13728 652.8985 36.95986 0.5145264      52.39474 
1 1 1 -8  3  24 o 461.1270 36.80475 42.57466       6.536106      30.90608       9.034554      55.38849       9.467540  381.0758 63.26621 521.5099 47.25958 -140.4341      78.96886 
1 1 1 -8  3  25 o 287.1591 82.34740 18.83224       9.659453      0.000000       0.000000      18.83224       9.659453  ?        ?        287.1591 82.34740 0.000000       82.34740 
1 1 1 -8  3  26 o 371.9242 58.31940 29.52334       8.146570      23.70902       9.829774      42.27628       14.55792  320.8002 79.34212 421.5219 91.55155 -100.7217      121.1481 
1 1 1 -8  3  27 o 260.1768 73.95170 15.73824       7.824939      19.29186       12.99555      13.71709       9.800746  277.0584 97.41145 242.8414 84.63850 34.21704       129.0452 
1 1 1 -8  3  28 o 350.7328 79.32706 30.13018       10.55202      0.000000       0.000000      30.13018       10.55202  ?        ?        350.7328 79.32706 0.000000       79.32706 
1 1 1 -8  3  29 o 214.7886 77.54601 11.52666       8.289155      0.6588408E-01  14.89674      16.66672       9.976270  185.9263 86.26295 247.3754 85.43964 -61.44908      121.4135 
1 1 1 -8  3  30 o 483.8333 51.09407 52.69681       9.455295      34.93284       15.41144      63.41954       11.97364  310.3881 106.2415 517.0178 60.79484 -206.6297      122.4062 
1 1 1 -8  3  31 o 171.4265 73.12214 6.737610       8.585674      14.16924       10.65950      -6.988253      14.48654  208.5520 84.53152 153.1583 74.71275 55.39369       112.8166 
1 1 1 -8  3  32 o 201.2890 72.68774 12.92326       7.283624      14.16515       9.882746      11.44662       10.77637  196.8853 80.78517 182.5668 79.88276 14.31853       113.6112 
1 1 1 -8  3  33 o 131.1979 60.12482 1.992530       6.925999      -7.993657      9.899082      11.56888       9.693825  118.9892 58.77709 173.7931 75.91126 -54.80391      96.00660 
1 1 1 -8  4  1  o 925.9615 15.21349 166.7781       5.470786      154.5862       8.860856      174.2886       6.954614  890.0531 25.63491 946.1312 18.92752 -56.07806      31.86533 
1 1 1 -8  4  2  f 428.7337 19.64017 35.79842       3.270099      36.83863       5.618759      35.26561       4.021316  432.3936 33.72727 424.4841 24.49787 7.909576       41.68542 
1 1 1 -8  4  3  o 437.2688 19.49507 37.24082       3.310559      34.43252       5.501095      38.83537       4.145211  417.7833 34.20533 445.5388 24.04608 -27.75549      41.81171 
1 1 1 -8  4  4  o 345.5073 24.90363 23.42044       3.319145      28.66565       5.821174      20.89369       4.040266  379.6252 40.09104 325.0101 32.44349 54.61505       51.57394 
1 1 1 -8  4  5  o 870.8760 16.20687 147.6205       5.481299      151.3339       9.617696      145.8341       6.670671  879.6497 28.15356 865.0746 19.85583 14.57513       34.45108 
1 1 1 -8  4  6  o 352.2212 25.70261 24.37408       3.491501      25.24740       5.874048      23.89696       4.341724  354.7560 43.55098 347.5111 32.55031 7.244873       54.37104 
1 1 1 -8  4  7  o 256.8244 35.68089 13.22509       3.462626      9.771192       4.481860      18.33934       5.453737  216.7388 53.55666 299.9374 48.47381 -83.19858      72.23591 
1 1 1 -8  4  8  o 134.7649 49.19437 3.009555       3.349283      2.029050       4.121068      4.917277       5.748343  133.5944 53.10086 172.6635 64.20055 -39.06909      83.31514 
1 1 1 -8  4  9  o 332.3279 25.64885 21.77082       3.284654      24.03789       4.665350      19.54250       4.625312  347.1430 35.08740 311.6043 39.08136 35.53867       52.52121 
1 1 1 -8  4  10 o 783.0176 16.07188 119.5468       4.887269      127.1637       7.123304      112.7724       6.717791  805.9066 22.75982 758.9257 22.79288 46.98090       32.21063 
1 1 1 -8  4  11 o 276.9169 38.09616 15.53191       3.988442      14.04230       4.937528      18.32908       6.766007  259.0692 50.89119 292.9077 61.44143 -33.83850      79.78071 
1 1 1 -8  4  12 o 119.7105 52.89356 -1.046300      4.831589      -4.977696      6.651948      3.343997       7.029467  123.7883 57.50548 169.1044 68.60939 -45.31607      89.52167 
1 1 1 -8  4  13 o 228.4888 43.36503 10.81161       3.707223      3.400792       5.267152      18.08698       5.218792  154.7349 60.48446 295.8841 46.98790 -141.1492      76.59134 
1 1 1 -8  4  14 o 578.9496 20.47214 65.58759       4.602904      71.43004       6.552968      59.89766       6.466866  602.1730 28.02133 549.9390 30.39768 52.23401       41.34264 
1 1 1 -8  4  15 o 758.8105 18.38508 112.4534       5.417849      117.9304       7.788674      107.3189       7.541304  774.8819 25.88213 739.0697 26.27442 35.81219       36.88129 
1 1 1 -8  4  16 o 504.0513 24.31627 49.78878       4.759921      52.17562       6.732792      47.40370       6.730299  512.6973 34.00779 488.0211 35.76040 24.67618       49.34912 
1 1 1 -8  4  17 o 254.3367 46.72046 13.31693       4.444651      13.57683       6.299952      13.05936       6.271516  252.4999 64.12540 247.6406 64.55193 4.859344       90.98911 
1 1 1 -8  4  18 o 372.4210 33.39753 27.52904       4.779001      28.86731       6.687060      26.13198       6.832338  377.7077 46.57465 357.8116 50.57816 19.89609       68.75571 
1 1 1 -8  4  19 o 810.6334 20.32185 128.2283       6.397580      128.6973       8.844989      127.7138       9.264686  810.3007 28.10756 806.7961 29.56915 3.504578       40.79669 
1 1 1 -8  4  20 o 408.9723 33.50345 33.11160       5.274525      32.65076       7.188519      33.64906       7.763193  402.4557 46.87114 407.6030 50.09736 -5.147217      68.60503 
1 1 1 -8  4  21 o 186.4047 61.80278 6.810464       5.217017      7.334709       6.969074      6.142172       7.868482  199.6529 71.21355 196.3214 74.65440 3.331528       103.1729 
1 1 1 -8  4  22 o 798.8035 22.36028 124.7791       6.936574      120.5067       9.481670      129.6986       10.17453  782.4074 31.20498 811.3078 32.29243 -28.90039      44.90604 
1 1 1 -8  4  23 o 258.8618 60.14001 14.28956       5.930481      18.55614       8.079686      9.306023       8.732203  291.5164 71.83287 219.6637 79.54754 71.85272       107.1810 
1 1 1 -8  4  24 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -8  4  25 o 510.0833 43.03830 52.79182       8.445963      48.07381       10.19645      63.10509       15.07537  479.7181 55.77209 536.8016 74.30736 -57.08347      92.90915 
1 1 1 -8  4  26 o 375.6583 58.78518 30.19722       8.294890      28.91419       9.641544      33.85203       16.27276  359.8081 71.51910 361.4933 107.7840 -1.685242      129.3536 
1 1 1 -8  4  27 o 279.0289 75.57948 18.32481       8.392522      28.52166       13.85532      12.41534       10.54770  329.2414 99.74901 234.4687 87.00804 94.77269       132.3641 
1 1 1 -8  4  28 o 148.4107 66.77893 -0.9651439     8.073951      -15.91276      14.24170      6.114450       9.801213  153.0909 74.54748 191.4956 79.68689 -38.40472      109.1207 
1 1 1 -8  4  29 o 245.1842 80.12787 15.95273       8.781118      19.22410       14.40143      14.01671       11.07885  251.0310 99.42783 228.2552 88.13705 22.77579       132.8685 
1 1 1 -8  4  30 o 294.7635 68.10262 22.06655       7.639117      17.72105       10.69880      26.58614       10.91101  239.8437 87.86737 297.3048 88.17048 -57.46112      124.4777 
1 1 1 -8  4  31 o 232.0312 78.19135 16.55688       8.346530      28.84128       10.03978      -10.93159      15.01836  307.1198 82.44556 147.8041 72.89562 159.3158       110.0502 
1 1 1 -8  4  32 o 206.0429 81.12995 15.82959       9.536138      15.82959       9.536138      0.000000       0.000000  206.0429 81.12995 ?        ?        0.000000       81.12995 
1 1 1 -8  4  33 o 250.4635 70.04768 19.97738       7.079828      16.30827       10.06317      23.57335       9.962372  193.0528 80.57418 234.9267 84.98285 -41.87390      117.1080 
1 1 1 -8  5  1  o 333.5451 23.20037 21.80004       2.986523      15.32268       4.920580      25.57787       3.757844  274.6111 47.88011 360.8846 27.00866 -86.27344      54.97247 
1 1 1 -8  5  2  o 508.9644 18.10742 50.43715       3.579083      44.69516       5.846587      53.87863       4.526308  476.7491 31.75975 525.6867 22.17119 -48.93765      38.73298 
1 1 1 -8  5  3  o 678.8034 16.55283 89.68381       4.363594      86.60701       7.425591      91.30674       5.393008  665.4764 28.73230 684.5116 20.28721 -19.03522      35.17266 
1 1 1 -8  5  4  o 490.1928 19.11302 46.81470       3.638515      38.30210       6.189374      51.31005       4.497773  439.9874 36.55346 512.8501 22.58287 -72.86270      42.96675 
1 1 1 -8  5  5  o 549.5385 16.53402 58.79794       3.528618      59.94574       5.053745      57.70609       4.929029  554.1198 23.48452 543.6874 23.34448 10.43243       33.11325 
1 1 1 -8  5  6  o 404.0853 19.74306 31.83964       3.098243      34.63044       4.494009      29.31164       4.277183  419.6756 27.72981 385.7666 28.75653 33.90903       39.94847 
1 1 1 -8  5  7  o 579.8610 18.90457 65.57150       4.257147      64.23068       5.271943      68.08443       7.217296  573.2013 23.68293 587.7520 31.73695 -14.55066      39.59943 
1 1 1 -8  5  8  o 655.0406 19.19769 83.73141       4.883656      83.59282       6.087133      83.98174       8.181258  653.5928 23.98157 653.0801 32.25712 0.5126343      40.19499 
1 1 1 -8  5  9  o 535.6005 18.75622 55.99944       3.901345      60.74254       5.695219      51.80587       5.355143  556.3893 26.35747 513.0236 26.97324 43.36578       37.71302 
1 1 1 -8  5  10 o 255.4068 35.15331 13.15417       3.394394      14.23269       4.717679      11.99656       4.887628  261.9998 48.13996 238.4275 54.03443 23.57230       72.36833 
1 1 1 -8  5  11 o 285.0728 38.32040 16.46157       4.134974      12.49687       5.131927      23.79904       6.981498  242.5699 55.65836 337.2784 55.21148 -94.70853      78.39745 
1 1 1 -8  5  12 o 313.5083 44.15745 20.11996       5.227314      20.91930       7.561054      19.38811       7.234810  311.4840 64.62347 299.8356 64.07586 11.64841       91.00500 
1 1 1 -8  5  13 o 378.8681 27.52544 28.40751       4.022294      29.89250       5.799105      27.03075       5.583769  385.0256 39.33558 365.7331 39.96329 19.29245       56.07453 
1 1 1 -8  5  14 o 184.5983 51.89960 7.137686       3.875885      4.190516       5.505417      10.03384       5.457555  163.2744 62.36047 216.8826 61.79958 -53.60828      87.79531 
1 1 1 -8  5  15 o 168.5295 54.72663 5.670102       4.098620      3.891539       5.905330      7.323145       5.693139  164.6044 64.12662 191.7546 64.57776 -27.15016      91.00829 
1 1 1 -8  5  16 o 117.7485 50.34707 0.1017629      4.088072      0.9892734      5.723770      -0.8224174     5.840820  143.4204 60.37071 134.1338 58.74744 9.286606       84.23707 
1 1 1 -8  5  17 o 917.8561 18.04153 164.3036       6.430961      160.8731       9.110535      167.7103       9.079052  906.1317 25.88955 925.3848 25.26331 -19.25311      36.17324 
1 1 1 -8  5  18 o 200.0712 58.42455 8.279282       4.822908      6.778500       6.653449      9.940981       7.001066  193.4768 69.52142 220.9096 71.50713 -27.43275      99.73213 
1 1 1 -8  5  19 o 428.0212 30.87850 36.14758       5.098278      39.19703       7.050874      32.80633       7.380526  443.0696 41.45926 403.0361 48.10412 40.03345       63.50493 
1 1 1 -8  5  20 o 380.2993 35.99631 28.74693       5.253066      25.85485       7.272892      31.90129       7.595520  355.1799 54.46437 396.6259 50.45358 -41.44595      74.24238 
1 1 1 -8  5  21 f 806.9435 30.78979 127.9405       9.648901      127.9405       9.648901      0.000000       0.000000  806.9435 30.78979 ?        ?        0.000000       30.78979 
1 1 1 -8  5  22 o 277.6685 54.34411 16.09464       5.650321      14.97313       7.582591      17.49496       8.472842  263.3393 72.05348 283.4293 75.58802 -20.09000      104.4282 
1 1 1 -8  5  23 o 583.3593 29.11248 67.03410       6.595433      59.67829       9.080580      75.24763       9.595398  544.1915 43.32576 612.7581 40.55161 -68.56653      59.34269 
1 1 1 -8  5  24 f 213.2109 67.39104 9.632788       6.246593      18.62389       8.671062      -0.6744879E-01 9.006519  288.7776 76.20763 167.4936 73.16489 121.2841       105.6442 
1 1 1 -8  5  25 o 588.9617 36.93631 69.54828       8.405531      70.10180       10.08571      68.28952       15.20934  587.1448 44.56413 560.4211 71.51260 26.72369       84.26158 
1 1 1 -8  5  26 o 472.4839 40.18922 45.36837       7.304327      57.93073       10.45104      33.37214       10.21284  526.9512 51.73659 387.2852 70.50008 139.6660       87.44676 
1 1 1 -8  5  27 o 345.9525 65.98365 26.94467       8.541520      30.64649       14.69960      25.05762       10.49517  336.4745 102.9164 320.1939 83.52626 16.28058       132.5459 
1 1 1 -8  5  28 o 205.0111 91.24998 5.005116       14.63925      5.005116       14.63925      0.000000       0.000000  205.0111 91.24998 ?        ?        0.000000       91.24998 
1 1 1 -8  5  29 o 135.7740 63.63980 -4.250246      8.448935      -25.99577      13.92321      8.424507       10.62978  131.4618 65.71494 197.9043 82.72333 -66.44247      105.6485 
1 1 1 -8  5  30 o 137.7264 62.81621 -0.5461741     7.442368      1.586700       10.38344      -2.799548      10.67272  162.3415 74.10274 150.3638 70.80835 11.97769       102.4941 
1 1 1 -8  5  31 o 187.1672 75.62766 10.16039       8.503588      5.414210       10.34343      20.05787       14.93671  167.5047 75.45708 218.4494 94.83784 -50.94466      121.1940 
1 1 1 -8  5  32 o 182.8759 74.05733 11.12749       8.173590      11.20574       9.765036      10.94435       14.93813  179.8948 77.38948 175.8891 83.11527 4.005707       113.5662 
1 1 1 -8  5  33 o 142.7906 63.34697 4.813465       6.998660      3.960574       9.535303      5.809528       10.30460  144.6711 67.74542 151.3518 70.72989 -6.680740      97.93958 
1 1 1 -8  6  1  o 386.2581 20.89025 29.16709       3.121992      28.78745       5.163393      29.38586       3.919641  381.3558 35.26323 386.9580 26.23788 -5.602173      43.95363 
1 1 1 -8  6  2  o 417.4268 17.99339 33.93466       2.916898      36.35656       4.159070      31.59026       4.091983  430.7671 24.96850 401.2144 26.40973 29.55261       36.34418 
1 1 1 -8  6  3  o 103.1360 40.92731 1.135527       2.444427      2.954436       3.373816      -0.8743785     3.546532  134.8885 49.35373 103.5899 45.56347 31.29868       67.17008 
1 1 1 -8  6  4  o 289.0385 24.62423 16.43809       2.737700      17.37255       3.869749      15.50175       3.873638  295.4268 34.37160 278.3423 36.73274 17.08456       50.30608 
1 1 1 -8  6  5  o 423.9069 26.67008 35.29993       4.368205      35.29993       4.368205      0.000000       0.000000  423.9069 26.67008 ?        ?        0.000000       26.67008 
1 1 1 -8  6  6  o 179.0247 39.95716 6.584527       2.707605      11.27415       3.870471      2.090047       3.789089  234.6331 44.09519 130.3974 51.20520 104.2357       67.57484 
1 1 1 -8  6  7  o 85.00546 39.56017 -2.795287      3.170870      -2.556926      4.046786      -3.174370      5.103397  100.8745 46.12913 113.0869 51.74624 -12.21237      69.32222 
1 1 1 -8  6  8  o 787.9663 17.70187 121.1137       5.416949      123.1031       6.717516      117.4148       9.159815  793.4799 21.79941 772.3770 30.53721 21.10291       37.51981 
1 1 1 -8  6  9  o 341.0616 26.21015 22.96638       3.445043      25.91703       4.966612      20.23027       4.782646  359.9225 36.01571 316.4850 39.79203 43.43750       53.67064 
1 1 1 -8  6  10 o 460.2009 24.40206 41.66158       4.345577      46.32800       5.398468      33.07232       7.324140  484.1464 28.84294 402.3133 47.81372 81.83316       55.83965 
1 1 1 -8  6  11 o 179.4876 53.65277 6.695184       4.028365      9.606833       5.023760      1.451329       6.741936  212.3738 58.86858 155.4205 65.47648 56.95335       88.04929 
1 1 1 -8  6  12 o 518.3869 30.24549 53.22931       6.062516      58.98268       9.183322      48.78494       8.071302  539.9193 44.18388 491.3858 42.72050 48.53354       61.45938 
1 1 1 -8  6  13 o 214.9185 47.76919 9.673092       3.883650      14.05418       5.373820      4.883109       5.619002  257.6342 55.35889 169.6576 63.39681 87.97664       84.16508 
1 1 1 -8  6  14 o 272.4241 37.84746 15.01815       3.895977      10.31757       5.458723      19.89866       5.562221  220.1078 61.48960 311.0901 47.54984 -90.98224      77.73004 
1 1 1 -8  6  15 o 586.4280 21.31490 67.24696       4.854293      68.97398       7.060205      65.69855       6.685153  590.8785 30.87461 576.9371 29.93989 13.94141       43.00742 
1 1 1 -8  6  16 o 1022.357 17.27562 203.8038       6.859054      191.0346       9.452754      218.0031       9.968081  987.6888 24.64395 1055.219 24.32433 -67.53027      34.62654 
1 1 1 -8  6  17 o 171.7177 57.33651 5.709855       4.487572      12.37822       6.324594      -1.051211      6.368402  241.7424 65.66528 139.4694 61.20726 102.2730       89.76780 
1 1 1 -8  6  18 o 471.6322 29.31204 43.79811       5.342235      46.71526       7.654558      41.02787       7.459344  483.9900 41.11366 452.8108 42.93160 31.17923       59.44287 
1 1 1 -8  6  19 o 538.1558 26.62131 56.68916       5.563723      50.58746       7.513622      64.09628       8.278447  504.7480 38.62384 568.7715 37.69218 -64.02356      53.96760 
1 1 1 -8  6  20 o 388.8601 37.35101 30.09903       5.571182      28.84382       7.712246      31.46887       8.056720  375.4942 54.47750 392.5646 54.30082 -17.07043      76.91799 
1 1 1 -8  6  21 o 1150.959 19.22062 258.4574       8.591229      269.0287       12.32406      248.4633       11.98279  1171.517 27.08801 1125.724 27.40933 45.79358       38.53611 
1 1 1 -8  6  22 o 209.8113 64.03916 9.193100       5.695294      7.166773       8.124539      11.15090       7.985972  203.0927 76.16483 231.6685 76.44811 -28.57574      107.9138 
1 1 1 -8  6  23 o 180.7218 65.47385 5.978781       5.916633      4.302148       8.153425      7.843724       8.599117  183.9336 74.14779 208.6855 78.33904 -24.75186      107.8652 
1 1 1 -8  6  24 o 538.3591 33.63441 57.72178       6.996850      56.11750       9.408254      59.70713       10.46616  524.8142 46.64733 539.2845 50.56404 -14.47034      68.79459 
1 1 1 -8  6  25 o 179.8031 72.86945 4.235921       7.920090      4.151409       9.305606      4.458043       15.08623  188.5885 77.99197 222.1201 95.87045 -33.53154      123.5876 
1 1 1 -8  6  26 o 190.1239 70.41063 6.978471       6.900547      16.40149       9.606672      -3.066185      9.918489  264.2523 83.57845 160.0072 72.79937 104.2451       110.8382 
1 1 1 -8  6  27 o 211.6131 76.09786 9.930614       7.973236      18.80636       13.87658      5.556118       9.741909  268.8159 99.78925 191.7023 79.58174 77.11360       127.6368 
1 1 1 -8  6  28 o 135.9151 65.16409 -9.126967      9.884940      0.000000       0.000000      -9.126967      9.884940  ?        ?        135.9151 65.16409 0.000000       65.16409 
1 1 1 -8  6  29 o 213.7891 77.14652 11.82869       8.202479      9.298208       14.12281      13.11679       10.07615  207.0072 90.99016 220.5439 84.33370 -13.53668      124.0620 
1 1 1 -8  6  30 o 497.0246 59.46254 59.25251       11.24968      0.000000       0.000000      59.25251       11.24968  ?        ?        497.0246 59.46254 0.000000       59.46254 
1 1 1 -8  6  31 o 210.4790 78.04585 14.22986       8.483471      11.24805       10.23571      20.77238       15.16181  189.2444 80.25243 216.6083 94.76595 -27.36392      124.1815 
1 1 1 -8  6  32 o 134.8041 63.14718 0.5145934      8.297276      9.735944       9.981562      -20.10599      14.92628  171.6813 75.93237 126.7328 63.96915 44.94846       99.28634 
1 1 1 -8  7  1  o 868.9424 13.68059 146.8924       4.616616      142.1978       6.318684      152.2681       6.761556  854.1893 19.04779 883.8060 19.69980 -29.61664      27.40256 
1 1 1 -8  7  2  o 425.4319 17.97644 35.26210       2.970036      32.47553       4.112326      38.30045       4.294098  406.6939 26.17610 441.9806 25.12104 -35.28668      36.28023 
1 1 1 -8  7  3  o 424.1782 17.89880 35.05847       2.948493      30.39331       3.988816      40.67809       4.377888  393.3116 26.26539 455.5219 24.84108 -62.21030      36.15176 
1 1 1 -8  7  4  o 341.0773 21.93540 22.80672       2.890127      20.96260       4.081206      24.66181       4.093334  324.9745 32.78596 353.2967 30.12158 -28.32214      44.52222 
1 1 1 -8  7  5  f 751.5984 14.59907 109.9774       4.261270      120.1172       6.192772      100.8589       5.872653  784.5237 20.32596 718.7574 21.03895 65.76630       29.25376 
1 1 1 -8  7  6  o 646.9041 15.71129 81.52594       3.947114      86.13153       5.745152      77.40855       5.432118  663.8317 22.28515 629.3307 22.22605 34.50098       31.47420 
1 1 1 -8  7  7  o 162.0901 48.71021 5.343713       3.313860      4.848542       4.104822      6.270419       5.615488  160.1350 54.83010 182.6456 64.04362 -22.51068      84.30851 
1 1 1 -8  7  8  o 272.6042 34.58853 14.92095       3.579391      12.67419       4.426422      19.16588       6.084285  247.2553 47.82722 303.4818 53.58283 -56.22643      71.82314 
1 1 1 -8  7  9  o 326.3502 27.18958 21.07718       3.414634      20.27472       4.695123      21.97818       4.975072  316.9116 38.96993 329.9278 39.62107 -13.01620      55.57413 
1 1 1 -8  7  10 o 637.2927 35.77770 80.88549       8.818997      0.000000       0.000000      80.88549       8.818997  ?        ?        637.2927 35.77770 0.000000       35.77770 
1 1 1 -8  7  11 o 198.3657 59.94172 8.262967       5.008086      2.545063       7.601427      12.64850       6.657143  169.2982 70.29057 241.4847 68.06163 -72.18645      97.84248 
1 1 1 -8  7  12 o 274.5460 42.95026 15.43883       4.429317      22.16532       7.821444      12.26322       5.374105  321.2172 64.93179 239.6560 58.29950 81.56122       87.26379 
1 1 1 -8  7  13 o 660.4984 18.49901 85.20676       4.745131      88.50371       6.816627      82.10721       6.609427  671.2101 26.15068 646.4493 26.32700 24.76080       37.10754 
1 1 1 -8  7  14 o 984.7916 16.74156 189.1519       6.402777      186.7194       9.048824      191.5909       9.060975  976.2137 23.86818 988.9683 23.59199 -12.75452      33.55997 
1 1 1 -8  7  15 o 420.9220 27.78251 34.93319       4.515975      36.08709       6.352644      33.75432       6.421012  424.8044 38.94019 410.1322 40.85744 14.67221       56.44173 
1 1 1 -8  7  16 o 617.0493 22.05477 74.40784       5.285067      82.29448       7.624685      67.11444       7.332312  647.0864 30.34112 582.9811 32.51559 64.10529       44.47299 
1 1 1 -8  7  17 o 252.5889 49.70587 13.17225       4.702204      6.318431       6.546238      20.47815       6.758689  189.3171 68.82629 314.0522 57.53599 -124.7351      89.70757 
1 1 1 -8  7  18 o 192.9106 58.93823 7.573470       4.822490      11.30411       6.714413      3.598505       6.930794  232.7491 69.19851 172.8637 68.81483 59.88533       97.59055 
1 1 1 -8  7  19 o 347.7835 39.72313 24.19481       5.268882      30.42098       7.485366      18.08063       7.417745  387.1510 51.02919 292.5264 66.76637 94.62457       84.03408 
1 1 1 -8  7  20 o 132.8892 57.35164 -0.2396749     5.397843      1.410306       7.388153      -2.128817      7.905487  163.5393 68.70086 151.1029 67.16628 12.43642       96.07870 
1 1 1 -8  7  21 o 650.6578 25.98966 82.96118       6.567214      81.42074       9.025542      84.69437       9.573551  640.8087 36.41778 653.0427 37.91199 -12.23401      52.56971 
1 1 1 -8  7  22 o 399.7953 39.26408 32.07761       6.017572      31.57849       8.228074      32.65155       8.823339  390.3583 55.86934 395.5549 59.26260 -5.196625      81.44592 
1 1 1 -8  7  23 o 188.1496 66.24090 6.827130       6.010955      7.314620       8.517221      6.343388       8.484424  204.5255 77.69565 198.1780 76.95969 6.347534       109.3591 
1 1 1 -8  7  24 o 149.8537 66.35698 -1.214927      7.644949      1.186381       8.960400      -7.639949      14.65686  172.4865 74.16549 184.2574 85.51585 -11.77087      113.1966 
1 1 1 -8  7  25 o 367.0362 57.77621 28.64424       7.963184      25.18196       9.163960      39.31977       16.09150  335.7265 72.41413 397.2290 103.3300 -61.50250      126.1780 
1 1 1 -8  7  26 o 216.2731 71.29196 10.34133       6.945729      12.80060       9.687729      7.740036       9.963568  237.7441 84.05175 207.6856 82.56149 30.05847       117.8181 
1 1 1 -8  7  27 o 197.2562 74.59863 8.095916       7.829565      3.460848       12.70496      10.93408       9.941772  195.7593 86.16802 220.5674 83.90562 -24.80811      120.2709 
1 1 1 -8  7  28 o 169.0402 75.99290 0.8589586      10.42817      0.000000       0.000000      0.8589586      10.42817  ?        ?        169.0402 75.99290 0.000000       75.99290 
1 1 1 -8  7  29 o 140.0056 63.11967 -0.2004623     7.254436      -6.063494      10.18452      5.838024       10.33579  141.5432 67.39021 182.3739 79.03311 -40.83070      103.8637 
1 1 1 -8  7  30 o 142.6995 63.62286 1.505774       7.149256      -15.27904      10.06633      18.58894       10.15540  117.4005 58.22159 240.4523 85.94420 -123.0518      103.8083 
1 1 1 -8  7  31 o 143.0259 65.41846 1.684208       8.144744      -2.887463      9.893352      11.29916       14.34760  137.2800 65.65213 185.3553 85.52389 -48.07533      107.8171 
1 1 1 -8  7  32 o 212.8142 82.61192 18.46022       9.773563      31.20532       14.32226      7.352603       13.37058  236.1359 97.11315 163.1939 77.55950 72.94199       124.2837 
1 1 1 -8  8  1  o 501.9853 18.33917 49.11896       3.575186      49.26432       4.372114      48.82559       6.211131  502.2519 22.41516 497.4667 32.32515 4.785187       39.33643 
1 1 1 -8  8  2  o 766.1318 14.16778 114.2424       4.215347      117.5136       6.064152      111.1840       5.863701  776.0956 20.11995 754.9261 20.00043 21.16943       28.36952 
1 1 1 -8  8  3  o 313.6355 22.57232 19.31677       2.730961      23.84680       3.774952      14.34253       3.955710  347.6497 28.20339 266.5653 39.39856 81.08441       48.45284 
1 1 1 -8  8  4  o 765.2311 14.31530 114.0047       4.254230      117.9840       6.075414      110.1763       5.959055  777.4785 20.12146 751.2540 20.42502 26.22443       28.67150 
1 1 1 -8  8  5  o 479.8132 18.12383 44.90369       3.377148      47.71118       4.773181      42.08953       4.778841  492.9749 25.01384 462.5794 26.71535 30.39548       36.59784 
1 1 1 -8  8  6  o 105.5142 42.93260 0.9400715      2.761969      -1.661943      3.914561      3.519486       3.897523  103.7404 46.60516 144.8059 53.03644 -41.06554      70.60386 
1 1 1 -8  8  7  o 172.1070 47.45953 6.140433       3.274743      7.765541       4.193148      3.599432       5.243261  192.7436 53.90893 157.0661 60.63765 35.67743       81.13629 
1 1 1 -8  8  8  o 94.99956 43.15511 -1.901869      3.468153      -0.8198174     4.139516      -4.450084      6.352482  112.0282 49.25137 122.8285 56.75558 -10.80037      75.14582 
1 1 1 -8  8  9  o 181.3338 51.33969 6.862598       3.778963      9.832139       4.687476      1.349415       6.386981  215.3561 55.64793 151.7401 63.81728 63.61609       84.67194 
1 1 1 -8  8  10 o 657.1232 20.22365 84.44984       5.161006      85.01688       6.333009      83.32866       8.905214  658.1511 24.77744 647.0215 35.57699 11.12964       43.35486 
1 1 1 -8  8  11 o 549.5839 28.87935 59.66115       6.142203      65.82446       9.346784      54.97659       8.148718  571.8956 42.38575 523.2510 40.41385 48.64453       58.56476 
1 1 1 -8  8  12 o 685.9589 21.52557 92.08228       5.734304      103.6010       10.53966      87.23893       6.834359  720.8917 37.77829 666.3707 26.40912 54.52094       46.09383 
1 1 1 -8  8  13 o 118.3228 49.58644 0.6650761      3.833867      0.2893636E-01  5.532090      1.252944       5.318056  135.1673 58.19819 140.4973 58.60104 -5.330002      82.59002 
1 1 1 -8  8  14 o 363.7489 31.30132 26.24307       4.378664      26.78504       6.165546      25.69156       6.219540  363.6920 44.58638 355.5833 46.12570 8.108734       64.15237 
1 1 1 -8  8  15 o 102.8811 47.13778 -2.774699      4.253949      0.9296511E-01  6.034696      -5.607083      5.997460  141.8272 60.92034 114.5067 53.65442 27.32053       81.17934 
1 1 1 -8  8  16 o 127.6299 53.45790 0.7585634      4.451962      4.554073       6.224610      -3.216267      6.369956  173.4972 66.29827 129.1858 58.60815 44.31134       88.48942 
1 1 1 -8  8  17 o 928.9615 18.84961 168.2581       6.800300      171.7497       9.559838      164.6817       9.675354  936.7422 26.27862 917.0145 27.16831 19.72772       37.79792 
1 1 1 -8  8  18 o 1013.292 18.72798 200.1454       7.369763      198.8137       10.42042      201.4782       10.42442  1007.934 26.62107 1014.715 26.45329 -6.781250      37.52943 
1 1 1 -8  8  19 o 696.6862 23.05337 94.81178       6.237344      98.83652       8.756279      90.66591       8.887047  709.4228 31.78238 678.9922 33.70270 30.43060       46.32485 
1 1 1 -8  8  20 o 293.2627 49.40165 17.62728       5.426370      14.37297       7.257353      21.75344       8.171883  259.7744 70.24828 320.3972 67.79113 -60.62283      97.62406 
1 1 1 -8  8  21 o 1290.183 18.94160 324.8911       9.490651      316.1338       12.84585      335.4163       14.08290  1269.771 26.05010 1307.074 27.74365 -37.30286      38.05677 
1 1 1 -8  8  22 o 1000.831 21.16251 195.9442       8.225380      202.1980       11.45913      189.2971       11.81387  1013.347 29.11827 979.5538 31.05530 33.79303       42.57118 
1 1 1 -8  8  23 o 208.8095 67.39892 9.119713       6.223063      14.36979       8.747292      3.739325       8.855181  255.4145 79.60214 185.2116 76.28780 70.20294       110.2557 
1 1 1 -8  8  24 o 200.3702 73.97186 7.568212       7.604331      8.001721       8.778032      6.264483       15.22269  208.7213 78.97510 230.8595 97.88274 -22.13820      125.7700 
1 1 1 -8  8  25 o 169.8543 67.35991 4.236908       6.617543      12.78751       8.879081      -6.447476      9.925316  239.6468 80.64782 149.8562 69.82413 89.79059       106.6746 
1 1 1 -8  8  26 o 301.1374 60.38083 20.00522       6.815613      15.33936       9.806825      24.36436       9.478997  253.4200 84.75906 322.0435 76.85951 -68.62347      114.4180 
1 1 1 -8  8  27 o 460.3645 47.90279 45.01293       8.438852      35.70461       13.37166      51.17431       10.87899  366.8281 93.56618 480.3929 59.59248 -113.5649      110.9319 
1 1 1 -8  8  28 o 205.8672 82.05593 9.874633       9.865959      0.000000       0.000000      9.874633       9.865959  ?        ?        205.8672 82.05593 0.000000       82.05593 
1 1 1 -8  8  29 o 155.1431 66.26171 3.400151       7.066649      4.803946       9.846999      1.909439       10.14727  174.4833 76.35278 164.4925 74.35963 9.990860       106.5791 
1 1 1 -8  8  30 o 118.9857 56.41055 -4.043711      6.988765      -9.914436      9.922884      1.734974       9.844790  125.4432 61.33120 155.8237 71.51052 -30.38048      94.20866 
1 1 1 -8  8  31 o 135.5569 63.12387 0.8042163E-01  8.092631      12.44869       13.14249      -7.473183      10.27071  185.7202 84.22842 127.4224 62.31957 58.29773       104.7767 
1 1 1 -8  8  32 o 232.0426 77.88503 19.46455       8.280936      20.57674       9.973777      16.99655       14.85742  220.7466 84.02462 183.1304 85.36169 37.61621       119.7779 
1 1 1 -8  9  1  o 653.7046 15.43156 83.23114       3.917592      83.91991       4.677813      81.61340       7.169009  655.9885 18.36194 644.9279 28.62332 11.06061       34.00669 
1 1 1 -8  9  2  o 463.9537 17.63682 41.96818       3.177773      44.80497       4.499843      39.14594       4.488280  477.8956 24.32620 446.2780 26.00956 31.61752       35.61266 
1 1 1 -8  9  3  o 284.0839 26.01735 15.94352       2.838486      18.78841       4.042409      13.17661       3.986624  306.7435 34.53487 254.3988 41.80422 52.34471       54.22407 
1 1 1 -8  9  4  f 340.9296 22.04235 22.81791       2.902816      21.79511       4.082258      23.86403       4.128538  331.1217 32.15099 346.8959 30.97138 -15.77423      44.64205 
1 1 1 -8  9  5  o 253.2375 30.97172 12.80889       2.982458      16.33708       4.171973      9.121187       4.265239  284.4663 38.77452 208.5363 52.65620 75.93002       65.39219 
1 1 1 -8  9  6  o 250.7864 32.23338 12.60294       3.066669      14.36418       4.075935      10.30526       4.655464  265.7328 40.80013 221.0991 54.55386 44.63370       68.12323 
1 1 1 -8  9  7  o 244.7865 48.51477 12.46104       4.448997      12.46104       4.448997      0.000000       0.000000  244.7865 48.51477 ?        ?        0.000000       48.51477 
1 1 1 -8  9  8  o 256.8519 38.48921 13.39431       3.721032      13.18940       4.511344      13.83039       6.581237  252.0756 47.83352 253.1030 66.19986 -1.027359      81.67293 
1 1 1 -8  9  9  o 454.2042 43.21376 41.66560       7.530692      0.000000       0.000000      41.66560       7.530692  ?        ?        454.2042 43.21376 0.000000       43.21376 
1 1 1 -8  9  10 o 541.6290 22.70490 57.46087       4.775838      54.70475       5.725028      63.76780       8.660403  526.5542 28.09822 564.2734 39.77493 -37.71924      48.69862 
1 1 1 -8  9  11 o 820.8449 19.56485 131.6564       6.236855      156.7534       11.90712      122.1675       7.321575  889.8484 34.45581 789.5045 23.87932 100.3440       41.92165 
1 1 1 -8  9  12 o 283.8572 36.54598 16.21509       3.935151      13.42431       5.572793      18.99060       5.557526  251.7503 58.16899 303.7907 48.75533 -52.04045      75.89936 
1 1 1 -8  9  13 o 764.8997 18.03708 114.1414       5.357951      109.7631       7.575782      118.5233       7.578794  748.1815 26.07309 777.7441 25.09201 -29.56262      36.18584 
1 1 1 -8  9  14 o 129.5779 52.25412 1.666285       4.050885      -1.399388      5.708182      4.776690       5.749676  129.8119 57.41756 171.2821 64.10498 -41.47023      86.05943 
1 1 1 -8  9  15 o 630.4623 21.26326 77.61453       5.206153      80.60548       7.323933      74.55956       7.401910  640.8631 29.42735 615.2288 31.08050 25.63428       42.80147 
1 1 1 -8  9  16 o 357.3373 34.89844 25.37337       4.781157      29.02736       6.785034      21.76949       6.738360  379.1087 47.10008 325.0333 55.36700 54.07544       72.69060 
1 1 1 -8  9  17 o 1169.197 18.12649 266.3990       8.230557      277.8648       11.75631      255.3769       11.52662  1192.038 25.39528 1142.599 25.97648 49.43921       36.32765 
1 1 1 -8  9  18 o 212.9394 60.25193 9.406982       5.206457      10.14389       7.077289      8.537756       7.686460  223.6958 71.84180 213.1557 74.91776 10.54015       103.7975 
1 1 1 -8  9  19 o 161.9429 61.30473 4.004454       5.290986      -3.368424      7.035578      13.60232       8.027281  136.4720 61.78465 253.8881 75.70253 -117.4160      97.71497 
1 1 1 -8  9  20 o 563.2590 28.63487 62.42239       6.243083      77.73183       8.573859      45.14421       9.108479  626.6317 35.37651 471.9388 50.48010 154.6929       61.64202 
1 1 1 -8  9  21 o 420.4335 38.13265 35.35147       6.158452      38.60629       8.526938      31.80241       8.904026  434.5148 51.53590 390.0302 60.76341 44.48456       79.67522 
1 1 1 -8  9  22 o 455.5612 36.31667 41.45800       6.371731      35.94229       8.873329      47.32978       9.155259  415.8228 56.40347 481.3259 49.69337 -65.50311      75.17168 
1 1 1 -8  9  23 o 523.9771 39.67459 55.18469       8.013463      50.98896       9.217011      68.17702       16.21922  499.5983 48.09960 558.7230 76.77827 -59.12473      90.60063 
1 1 1 -8  9  24 o 469.3488 95.32188 52.07795       16.78167      0.000000       0.000000      52.07795       16.78167  ?        ?        469.3488 95.32188 0.000000       95.32188 
1 1 1 -8  9  25 o 261.9934 66.95734 15.36962       6.838257      31.10178       9.782148      0.3341985      9.563085  373.4630 70.01881 170.6036 74.93431 202.8594       102.5563 
1 1 1 -8  9  26 o 187.6652 70.20496 7.012438       6.894451      7.592920       9.138554      6.245553       10.50385  200.5405 79.27503 199.2677 82.67162 1.272781       114.5388 
1 1 1 -8  9  27 o 119.0520 58.36681 -14.11275      9.173834      0.000000       0.000000      -14.11275      9.173834  ?        ?        119.0520 58.36681 0.000000       58.36681 
1 1 1 -8  9  28 o 188.1447 74.29512 7.808396       8.018470      -8.802419      13.29313      17.30926       10.05341  155.8844 74.95541 248.9064 85.78066 -93.02206      113.9150 
1 1 1 -8  9  29 o 110.5340 54.19202 -10.92466      7.909903      -32.12405      12.87142      1.939393       10.02660  114.9165 58.16788 162.1431 73.54858 -47.22656      93.77045 
1 1 1 -8  9  30 o 170.2005 68.43960 7.298444       6.927462      -1.210957      10.14515      14.73213       9.482237  146.0482 68.85513 212.3998 81.67011 -66.35164      106.8224 
1 1 1 -8  9  31 o 116.6198 55.41514 -2.902059      6.819814      0.8128409      9.545068      -6.776173      9.747464  142.5903 67.09157 124.7295 60.94096 17.86073       90.63708 
1 1 1 -8  9  32 o 120.4817 57.93993 -2.794595      7.949030      2.496319       9.407195      -16.00442      14.86426  141.3595 66.54063 127.5044 64.29312 13.85503       92.52708 
1 1 1 -8  10 1  o 426.8840 20.94551 35.59904       3.472394      34.70003       4.313292      37.25473       5.853527  419.8727 26.58957 433.0004 35.11216 -13.12772      44.04395 
1 1 1 -8  10 2  o 374.9942 23.35549 27.61959       3.384391      29.39555       4.175154      24.21666       5.779387  385.9579 28.04678 345.9008 44.02059 40.05701       52.19611 
1 1 1 -8  10 3  o 778.4826 16.57566 118.1483       5.011270      117.5494       6.156878      119.3239       8.625804  775.7043 20.43791 779.3182 28.50078 -3.613892      35.07140 
1 1 1 -8  10 4  o 696.0781 17.38256 94.51013       4.698936      93.54506       5.754340      96.44161       8.140660  691.7059 21.42131 700.0539 29.94334 -8.347961      36.81679 
1 1 1 -8  10 5  o 554.0184 18.79228 59.92596       4.043259      59.38409       4.854497      61.15320       7.305689  550.8217 22.69370 555.2414 34.04498 -4.419678      40.91533 
1 1 1 -8  10 6  o 510.8876 25.91424 51.35018       5.124691      51.35018       5.124691      0.000000       0.000000  510.8876 25.91424 ?        ?        0.000000       25.91424 
1 1 1 -8  10 7  o 586.6934 24.14491 67.46941       5.501293      67.46941       5.501293      0.000000       0.000000  586.6934 24.14491 ?        ?        0.000000       24.14491 
1 1 1 -8  10 8  o 81.04142 39.14128 -5.706062      3.722017      -6.348304      4.522201      -4.357358      6.553280  91.11900 43.78959 125.6052 57.90059 -34.48622      72.59481 
1 1 1 -8  10 9  o 147.1165 52.70988 3.836174       3.822043      1.018204       4.664600      9.593117       6.667180  131.3672 54.84546 215.1181 69.79655 -83.75087      88.76701 
1 1 1 -8  10 10 f 213.5847 50.40158 9.560624       4.113235      18.14188       7.740113      6.183526       4.855610  289.4429 69.69275 177.5065 59.63951 111.9364       91.72758 
1 1 1 -8  10 11 o 684.5483 21.17312 91.60281       5.628816      85.19568       10.28592      94.34176       6.725157  653.1437 40.75490 693.8071 24.95949 -40.66345      47.79057 
1 1 1 -8  10 12 o 605.5007 20.24000 71.60130       4.759411      76.55650       6.856800      66.99422       6.611546  624.4034 28.27667 583.9026 29.15645 40.50079       40.61611 
1 1 1 -8  10 13 o 607.4742 20.87059 72.06416       4.923689      70.85593       6.960299      73.27435       6.965999  600.5873 29.84171 610.8624 29.36378 -10.27509      41.86597 
1 1 1 -8  10 14 o 776.0125 18.95492 117.4462       5.712400      123.1713       8.123782      111.8469       8.034073  793.0792 26.37629 755.4945 27.38271 37.58466       38.02002 
1 1 1 -8  10 15 o 1122.127 17.39284 245.3524       7.579496      239.2973       10.55288      251.8044       10.89328  1106.288 24.56262 1134.781 24.71830 -28.49268      34.84705 
1 1 1 -8  10 16 o 858.5933 19.31393 143.7240       6.440003      145.2899       9.056005      142.1220       9.159964  861.5836 27.06520 851.9833 27.68437 9.600342       38.71627 
1 1 1 -8  10 17 o 1062.432 18.57750 219.9799       7.665074      216.7238       10.70384      223.4071       10.98160  1052.653 26.18342 1068.679 26.46004 -16.02576      37.22506 
1 1 1 -8  10 18 o 534.2079 28.35341 56.05561       5.861192      59.50885       8.108920      52.27769       8.481587  547.9140 38.35038 511.9897 43.05652 35.92429       57.65948 
1 1 1 -8  10 19 f 848.6486 21.77725 140.6507       7.177265      133.8096       9.840674      148.4255       10.49087  825.4292 30.69849 869.2194 31.07807 -43.79022      43.68345 
1 1 1 -8  10 20 o 131.8396 57.42825 -0.5721281     5.514012      -11.87096      7.579131      12.13303       8.036976  113.8125 55.18147 240.2817 76.49377 -126.4692      94.32015 
1 1 1 -8  10 21 o 618.3044 28.36808 75.19527       6.811775      81.37056       9.400252      68.36723       9.884595  638.8840 38.05949 582.8599 43.99249 56.02411       58.17098 
1 1 1 -8  10 22 o 374.7776 45.31887 28.63372       6.462005      39.52063       8.816037      15.99336       9.499499  437.6208 52.95102 268.3261 82.84409 169.2948       98.32067 
1 1 1 -8  10 23 o 691.2142 33.32031 94.79744       8.944369      95.91115       10.35393      91.52202       17.75636  691.7147 38.69862 652.0493 71.28167 39.66534       81.10894 
1 1 1 -8  10 24 o 489.0190 37.71808 48.18565       7.107806      45.69834       9.801019      50.94507       10.32321  466.7698 55.13248 493.3033 54.81236 -26.53357      77.74307 
1 1 1 -8  10 25 o 151.9228 64.85593 1.353804       6.764255      7.972564       9.271375      -6.178979      9.890848  205.9762 80.32092 148.8518 69.47203 57.12444       106.1971 
1 1 1 -8  10 26 o 211.3582 71.57552 10.19979       6.994208      -1.461978      9.783506      22.39007       10.00275  160.7886 72.81995 299.4073 83.09322 -138.6186      110.4863 
1 1 1 -8  10 27 o 183.7528 78.72302 4.916603       10.03001      0.000000       0.000000      4.916603       10.03001  ?        ?        183.7528 78.72302 0.000000       78.72302 
1 1 1 -8  10 28 o 154.1724 68.14584 1.726636       8.027122      1.340032       12.92422      1.969428       10.24209  177.0736 81.51046 167.2984 75.25124 9.775146       110.9356 
1 1 1 -8  10 29 o 209.3613 72.10190 12.02013       7.102174      2.699947       10.12055      21.06351       9.969137  162.9673 73.91089 260.0155 85.39584 -97.04825      112.9392 
1 1 1 -8  10 30 o 242.3133 70.26733 16.90424       6.998094      16.31352       9.654601      17.55819       10.15819  216.9882 82.65129 221.6425 84.69470 -4.654282      118.3403 
1 1 1 -8  10 31 o 141.3513 62.91558 3.553781       6.959496      8.252497       9.797363      -1.231971      9.887687  166.1676 74.25403 136.6126 65.41239 29.55504       98.95676 
1 1 1 -8  11 1  o 519.5264 18.91409 52.67339       3.816111      52.64869       4.754776      52.71811       6.397093  518.6816 23.60485 516.3836 32.05776 2.298035       39.81067 
1 1 1 -8  11 2  o 176.9547 45.51774 6.494352       3.145866      4.015024       3.936073      10.87886       5.234278  150.2405 53.52628 226.9138 58.88718 -76.67328      79.57866 
1 1 1 -8  11 3  o 155.1788 48.06632 4.840298       3.194919      7.930550       3.828614      -2.246945      5.798068  194.8755 50.26105 126.2751 56.72493 68.60041       75.78847 
1 1 1 -8  11 4  o 585.2860 19.08646 66.88147       4.338319      70.26732       5.350441      60.38303       7.412429  599.1822 22.99338 551.6190 34.77945 47.56323       41.69299 
1 1 1 -8  11 5  o 864.7465 17.06761 145.8498       5.731781      138.4710       6.855904      162.9817       10.44659  841.6362 20.97550 910.0995 29.55681 -68.46338      36.24330 
1 1 1 -8  11 6  o 214.6024 52.62042 9.677615       4.351847      9.677615       4.351847      0.000000       0.000000  214.6024 52.62042 ?        ?        0.000000       52.62042 
1 1 1 -8  11 7  o 846.5452 21.50219 140.1502       7.069046      140.1502       7.069046      0.000000       0.000000  846.5452 21.50219 ?        ?        0.000000       21.50219 
1 1 1 -8  11 8  o 252.6716 35.75415 12.87288       3.410464      13.78629       4.838093      11.97070       4.808294  257.5412 50.17643 238.8277 53.20443 18.71342       73.13266 
1 1 1 -8  11 9  o 445.3541 22.09859 38.79248       3.822064      38.61963       5.516221      38.95210       5.300651  441.4078 32.40558 443.7044 30.95545 -2.296600      44.81475 
1 1 1 -8  11 10 o 451.1653 26.66874 40.05927       4.651919      43.57251       8.519165      38.56665       5.552871  463.9485 47.97535 441.1819 32.64116 22.76654       58.02654 
1 1 1 -8  11 11 o 225.4588 77.04607 10.14983       8.104927      10.14983       8.104927      0.000000       0.000000  225.4588 77.04607 ?        ?        0.000000       77.04607 
1 1 1 -8  11 12 o 723.6609 18.59599 102.1309       5.226158      110.5262       7.610754      94.64001       7.189066  751.2409 26.08678 695.0333 26.63415 56.20764       37.28134 
1 1 1 -8  11 13 o 595.0984 21.59732 69.14704       4.991334      76.53931       7.327240      62.74683       6.817877  624.4573 30.21410 564.3646 31.22869 60.09265       43.45253 
1 1 1 -8  11 14 o 410.4236 28.77331 33.17022       4.557170      36.74416       6.679397      30.05771       6.233325  429.2531 40.54811 387.4553 42.10340 41.79782       58.45379 
1 1 1 -8  11 15 o 375.1249 33.18761 27.85255       4.784924      25.12376       6.771789      30.57348       6.762031  351.5019 51.10441 390.0659 45.49332 -38.56400      68.42005 
1 1 1 -8  11 16 o 494.8019 27.87529 48.07010       5.334651      42.79116       7.468715      53.56838       7.622300  463.4508 41.95151 520.0441 38.00458 -56.59332      56.60634 
1 1 1 -8  11 17 o 102.1608 48.13344 -5.234841      4.943262      -2.953602      6.833196      -7.739433      7.159899  136.2428 61.35666 121.7108 57.52240 14.53198       84.10390 
1 1 1 -8  11 18 o 513.9136 28.66274 51.92138       5.697741      51.99584       7.936841      51.84220       8.184512  511.2462 40.30191 510.0658 41.68220 1.180389       57.97974 
1 1 1 -8  11 19 o 379.2076 40.60506 28.82843       5.886824      34.86028       8.109467      22.10904       8.559177  413.6883 51.59853 321.5826 70.48026 92.10562       87.34916 
1 1 1 -8  11 20 o 466.1483 34.98066 43.19868       6.286393      52.87942       8.745217      32.84779       9.042855  512.5515 44.37217 396.6802 60.62467 115.8713       75.12816 
1 1 1 -8  11 21 o 471.7407 35.24662 44.34701       6.410621      43.91213       8.803319      44.83797       9.353664  463.6829 49.65979 467.2957 52.44753 -3.612762      72.22768 
1 1 1 -8  11 22 o 264.0829 62.59908 15.03893       6.322149      24.47385       8.899172      5.425081       8.983159  334.7966 70.66438 195.4342 78.16481 139.3624       105.3717 
1 1 1 -8  11 23 o 136.0327 62.90656 -4.987742      7.826810      -3.263681      9.183545      -9.564034      14.96205  155.3053 70.42455 180.8329 84.73695 -25.52757      110.1815 
1 1 1 -8  11 24 o 296.5355 59.09725 19.04643       6.566778      20.16750       8.961872      17.74662       9.649903  295.8924 77.18266 275.3776 83.20446 20.51486       113.4907 
1 1 1 -8  11 25 o 258.4090 68.95620 15.37006       7.048620      6.874651       9.522501      25.66591       10.48310  198.9708 80.15900 325.3281 82.77272 -126.3573      115.2250 
1 1 1 -8  11 26 o 238.9487 85.24959 14.27765       9.987538      0.000000       0.000000      14.27765       9.987538  ?        ?        238.9487 85.24959 0.000000       85.24959 
1 1 1 -8  11 27 o 394.4792 72.97155 38.18467       10.76732      0.000000       0.000000      38.18467       10.76732  ?        ?        394.4792 72.97155 0.000000       72.97155 
1 1 1 -8  11 28 o 313.6008 69.79250 24.97388       8.280982      28.52548       13.38299      22.77041       10.54133  291.3249 99.00661 275.8540 87.58208 15.47092       132.1852 
1 1 1 -8  11 29 o 149.5025 64.25900 3.593894       6.722080      -1.106449      9.793066      7.781604       9.243624  146.6165 68.65594 178.4362 75.98624 -31.81973      102.4087 
1 1 1 -8  11 30 o 260.6355 67.16523 19.11922       6.840909      25.14589       9.591576      12.87951       9.759625  272.7393 83.07491 193.2458 79.89120 79.49353       115.2564 
1 1 1 -8  11 31 o 142.9588 65.11338 3.525306       7.962078      8.732317       9.452173      -9.195733      14.77402  165.7088 73.56120 137.2834 68.48038 28.42540       100.5028 
1 1 1 -8  12 1  o 301.1856 33.52338 18.09142       3.854588      18.22842       5.359689      17.94463       5.547587  298.4225 47.86450 295.3277 50.16405 3.094818       69.33572 
1 1 1 -8  12 2  o 130.3547 46.42923 2.964084       2.961315      2.730821       3.487894      3.566427       5.604832  133.0011 49.89917 160.4610 62.48449 -27.45998      79.96399 
1 1 1 -8  12 3  o 460.0978 20.47875 41.34746       3.659163      37.54405       4.274975      51.77038       7.076872  437.0437 25.29541 510.5478 35.92138 -73.50412      43.93407 
1 1 1 -8  12 4  o 242.4803 34.18285 11.82257       3.129624      14.88301       4.413912      8.728494       4.438100  270.0898 43.56330 204.1448 54.82119 65.94499       70.02231 
1 1 1 -8  12 5  o 126.9294 46.50466 2.647957       2.996990      1.094885       4.101722      4.426752       4.389684  125.4040 51.81408 157.8146 56.49435 -32.41056      76.65710 
1 1 1 -8  12 6  o 416.8385 24.75213 34.15105       3.988928      38.08017       4.860289      26.04324       6.981789  439.3747 28.64047 356.1146 52.01776 83.26010       59.38118 
1 1 1 -8  12 7  o 624.1102 17.74530 75.96972       4.301033      83.14889       6.115247      68.94194       6.050427  651.7076 24.16202 592.9854 26.27327 58.72229       35.69437 
1 1 1 -8  12 8  o 431.5604 23.05626 36.52873       3.850203      35.62220       5.415735      37.45514       5.474762  423.9004 33.16197 434.8621 32.65644 -10.96173      46.54202 
1 1 1 -8  12 9  f 357.1514 39.17482 25.55242       5.344399      0.000000       0.000000      25.55242       5.344399  ?        ?        357.1514 39.17482 0.000000       39.17482 
1 1 1 -8  12 10 o 395.8132 30.42149 30.94963       4.640470      38.40385       8.529716      27.81585       5.530544  434.8075 51.51551 373.0920 38.73472 61.71545       64.45329 
1 1 1 -8  12 11 o 450.4583 24.44326 39.79568       4.260032      40.22635       6.045362      39.37089       6.004041  450.6225 34.81472 445.7406 34.96482 4.881897       49.34170 
1 1 1 -8  12 12 o 119.6864 50.27410 0.5393417      3.955803      -7.342046      5.434944      9.418305       5.768659  101.1457 48.44771 213.7196 64.27676 -112.5740      80.49026 
1 1 1 -8  12 13 o 204.7717 53.00959 8.699071       4.248438      6.462232       6.104798      10.79973       5.916045  188.4480 66.71177 227.5115 64.17480 -39.06351      92.56817 
1 1 1 -8  12 14 o 491.0005 26.71435 47.29351       5.074781      44.29651       7.177928      50.28868       7.175722  472.2672 39.49929 504.0804 36.91207 -31.81317      54.06195 
1 1 1 -8  12 15 o 126.1706 53.76594 0.1520780      4.633682      1.160868       6.608448      -0.8235611     6.498956  155.1410 65.06344 142.8934 62.29202 12.24768       90.07523 
1 1 1 -8  12 16 o 469.1715 29.81188 43.30005       5.403674      49.64347       7.677382      37.07240       7.607002  500.0702 39.86367 429.9410 46.28881 70.12915       61.08819 
1 1 1 -8  12 17 o 559.0536 26.63022 61.15950       5.781709      59.33607       7.980662      63.17366       8.387655  547.2880 37.78005 564.5794 38.48443 -17.29138      53.92943 
1 1 1 -8  12 18 o 732.8113 22.97847 104.9585       6.539451      106.8964       8.980104      102.7707       9.541793  737.4799 31.35474 722.3393 34.01424 15.14063       46.26109 
1 1 1 -8  12 19 f 233.4472 60.65496 11.54052       5.548923      8.169250       7.595997      15.39813       8.125454  208.0923 74.33450 266.8373 75.18915 -58.74501      105.7309 
1 1 1 -8  12 20 o 151.2933 62.19925 2.021345       5.872709      -3.282657      8.339574      7.238954       8.271377  149.1707 67.42447 203.9154 76.77618 -54.74464      102.1795 
1 1 1 -8  12 21 o 551.8807 31.58076 60.35935       6.740447      60.67272       9.290128      60.01102       9.794738  548.1750 44.00999 543.7968 46.83666 4.378235       64.26937 
1 1 1 -8  12 22 o 557.5563 38.66482 62.37725       8.320342      55.49064       9.552099      84.03323       16.93891  521.3409 47.70799 625.2437 71.02032 -103.9027      85.55665 
1 1 1 -8  12 23 o 340.0087 63.96224 25.09019       8.135836      22.09676       9.492387      33.37590       15.79266  310.9551 78.57332 363.9156 105.5660 -52.96048      131.5977 
1 1 1 -8  12 24 o 387.6003 46.94501 31.28411       6.922346      25.87357       9.462272      37.51414       10.15360  335.5333 74.55215 412.6917 65.54414 -77.15839      99.26760 
1 1 1 -8  12 25 o 215.8652 74.78953 10.64936       7.647058      3.011178       11.56869      16.57662       10.19099  189.1286 82.76028 257.6373 86.40210 -68.50868      119.6436 
1 1 1 -8  12 26 o 177.8834 83.98436 -5.204126      15.19200      -5.204126      15.19200      0.000000       0.000000  177.8834 83.98436 ?        ?        0.000000       83.98436 
1 1 1 -8  12 27 o 174.8033 71.75835 5.834769       7.802143      8.281371       11.92712      4.004734       10.31534  199.1346 85.59363 176.5419 77.67741 22.59271       115.5857 
1 1 1 -8  12 28 o 213.8463 75.24764 12.67185       7.755699      20.00863       12.38854      7.943066       9.945851  242.6326 93.33757 185.3476 78.87193 57.28506       122.1994 
1 1 1 -8  12 29 o 269.4194 65.39813 19.35917       6.773644      31.09554       9.591638      7.682597       9.567167  327.5575 76.74411 174.8162 75.89781 152.7412       107.9358 
1 1 1 -8  12 30 o 126.8907 59.59661 -1.088293      7.473592      -1.429367      8.885003      -0.2631923     13.81934  133.3412 63.32894 152.8149 74.18801 -19.47372      97.54186 
1 1 1 -8  13 1  o 313.4106 26.93302 19.38117       3.246288      16.42903       3.897369      26.07009       5.866520  286.5081 35.80932 360.0273 42.79659 -73.51913      55.80193 
1 1 1 -8  13 2  o 277.2098 38.37822 15.46834       4.020798      18.49554       5.560626      12.15120       5.820827  300.4878 49.36543 239.9732 62.01266 60.51459       79.26232 
1 1 1 -8  13 3  o 312.8686 29.33825 19.37820       3.523079      13.93002       4.168229      33.00629       6.592402  261.7395 42.46160 405.5984 42.48269 -143.8588      60.06468 
1 1 1 -8  13 4  o 240.9360 39.93195 11.78732       3.605525      11.62912       4.322427      12.14916       6.537110  237.1386 48.56889 239.6354 67.41184 -2.496841      83.08606 
1 1 1 -8  13 5  o 431.1352 24.74919 36.49147       4.126472      38.33184       5.035225      32.72754       7.200899  440.8962 29.57864 402.4422 46.95683 38.45404       55.49631 
1 1 1 -8  13 6  o 612.5737 20.31953 73.24506       4.833925      71.83291       5.825336      76.36756       8.662247  605.8773 24.75759 621.0370 36.07115 -15.15973      43.75004 
1 1 1 -8  13 7  o 206.4604 44.66363 8.791736       3.477026      11.38361       4.861742      6.078005       4.974719  233.4113 54.60526 178.1107 60.36397 55.30063       81.39744 
1 1 1 -8  13 8  o 315.2011 29.90877 19.66776       3.617282      19.37943       4.983725      19.98876       5.258552  309.8795 42.53470 314.3044 44.31079 -4.424896      61.42187 
1 1 1 -8  13 9  o 538.0538 24.63426 56.60847       5.147463      61.68932       9.360283      54.40580       6.163052  555.9446 43.70641 525.6970 30.31647 30.24762       53.19152 
1 1 1 -8  13 10 o 570.9514 24.24684 63.71319       5.376284      67.79855       9.669896      61.88531       6.468140  583.4420 42.97984 561.0060 29.79502 22.43597       52.29733 
1 1 1 -8  13 11 o 787.9081 17.53652 120.9408       5.365955      116.9202       7.545219      125.0553       7.632752  773.3701 25.12214 799.9390 24.56950 -26.56891      35.13947 
1 1 1 -8  13 12 o 681.3321 19.79088 90.50249       5.236630      88.45457       7.464710      92.48692       7.348095  672.1146 28.59839 687.4752 27.52262 -15.36060      39.69083 
1 1 1 -8  13 13 o 136.0405 53.74627 2.151229       4.198216      10.96825       6.114735      -5.711177      5.774234  229.7139 65.40043 111.8082 52.47174 117.9057       83.84808 
1 1 1 -8  13 14 o 1360.383 17.11289 360.3737       9.040918      370.8720       13.19707      351.0893       12.41071  1377.954 24.66123 1340.960 23.83158 36.99402       34.29462 
1 1 1 -8  13 15 o 680.8257 21.84545 90.43204       5.775970      91.08900       8.186760      89.78091       8.150274  681.6830 30.92443 676.7528 31.01089 4.930176       43.79492 
1 1 1 -8  13 16 o 820.0172 20.14978 131.1316       6.416842      138.0300       9.270643      124.7869       8.890838  839.5300 28.43450 798.1816 28.68224 41.34839       40.38801 
1 1 1 -8  13 17 o 398.7578 35.91547 31.59013       5.502161      30.49246       7.777598      32.68985       7.784868  386.5825 53.21608 401.1980 51.12684 -14.61557      73.79637 
1 1 1 -8  13 18 o 388.0775 38.76388 30.11693       5.764003      32.24050       8.185807      28.02856       8.117682  396.2693 54.64532 367.4411 58.87540 28.82822       80.32697 
1 1 1 -8  13 19 o 177.2571 64.17603 5.635901       5.683030      7.435288       7.991985      3.795380       8.082821  204.2037 75.74492 181.5475 73.60102 22.65625       105.6144 
1 1 1 -8  13 20 o 511.5133 33.66505 51.98094       6.650136      68.39330       9.483583      36.10342       9.327777  583.4777 42.13577 415.6111 59.48830 167.8666       72.89912 
1 1 1 -8  13 21 o 481.1577 36.31823 46.27974       6.736403      58.49939       9.537459      34.11501       9.516001  536.7456 46.20508 400.9622 63.20475 135.7834       78.29272 
1 1 1 -8  13 22 o 327.4655 64.02643 23.19595       7.850621      18.19095       8.936754      40.11383       16.43051  283.3901 78.50272 403.9925 104.0818 -120.6024      130.3676 
1 1 1 -8  13 23 o 448.4335 46.19135 41.46778       7.929157      51.78827       11.87356      33.16069       10.65259  489.3425 64.01453 383.5278 74.20334 105.8147       97.99997 
1 1 1 -8  13 24 o 263.3565 68.14809 15.91683       7.023321      1.674903       9.681520      31.73748       10.20402  174.4995 76.05099 370.7453 73.46786 -196.2459      105.7416 
1 1 1 -8  13 25 o 163.9930 71.18246 1.962325       8.411474      4.584424       16.26529      1.005078       9.827643  211.0610 94.89322 169.1063 75.04165 41.95467       120.9792 
1 1 1 -8  13 26 o 397.0144 60.30979 36.11709       9.006189      32.86120       16.32949      37.54044       10.79677  314.1489 109.2644 390.7032 73.86343 -76.55432      131.8883 
1 1 1 -8  13 27 o 154.9122 67.56048 2.624034       7.652110      24.19772       12.83529      -9.272026      9.531149  271.5145 96.66607 128.4369 62.17733 143.0776       114.9363 
1 1 1 -8  13 28 o 233.4064 83.11649 17.15416       9.489742      21.76080       13.10660      12.07814       13.75814  241.3575 95.08822 200.4283 88.87208 40.92915       130.1538 
1 1 1 -8  13 29 o 237.2184 68.35735 16.07966       6.641596      23.95398       9.315808      7.940115       9.471395  270.3951 81.76320 172.1765 75.12478 98.21860       111.0358 
1 1 1 -8  13 30 o 139.8416 61.51032 3.638558       6.463873      2.128528       9.143987      5.146812       9.138609  143.2090 66.82474 153.5013 69.85454 -10.29231      96.67058 
1 1 1 -8  14 1  o 402.8564 22.82483 31.78874       3.556290      31.75915       4.316136      31.85129       6.275888  401.8269 27.82982 399.4470 41.03995 2.379944       49.58605 
1 1 1 -8  14 2  o 356.7046 25.30529 25.00173       3.482734      21.51836       4.125217      33.64568       6.498342  329.4182 32.67680 410.4966 41.32472 -81.07840      52.68307 
1 1 1 -8  14 3  o 862.9209 16.00344 144.9988       5.363057      143.5966       6.347311      148.4978       10.02682  858.2360 19.04386 870.2907 29.66682 -12.05469      35.25321 
1 1 1 -8  14 4  o 1124.173 18.44368 246.3214       8.052095      238.3098       10.06287      260.5818       13.42549  1104.457 23.46093 1152.696 29.99077 -48.23914      38.07705 
1 1 1 -8  14 5  o 530.1210 22.30699 54.86957       4.592445      60.42561       5.628461      43.80341       7.943388  555.7563 26.07818 467.9747 44.23189 87.78159       51.34717 
1 1 1 -8  14 6  o 775.1374 16.51581 117.0164       4.971719      128.4267       7.055234      105.7611       7.007158  811.0402 22.39964 735.6010 24.52853 75.43915       33.21736 
1 1 1 -8  14 7  o 630.2902 18.14954 77.41251       4.442570      67.68772       5.934405      89.81067       6.700632  588.2879 25.97522 677.7358 25.45818 -89.44788      36.37074 
1 1 1 -8  14 8  o 246.7226 40.04318 12.31042       3.705230      8.089071       5.284616      16.39212       5.196470  199.8300 61.80544 283.2411 49.01603 -83.41110      78.88272 
1 1 1 -8  14 9  o 560.9869 41.77880 62.52188       9.036764      62.52188       9.036764      0.000000       0.000000  560.9869 41.77880 ?        ?        0.000000       41.77880 
1 1 1 -8  14 10 o 357.6364 30.44553 25.24148       4.188325      19.38618       6.012147      30.76260       5.838060  307.9167 52.13763 393.2851 38.72611 -85.36832      64.94647 
1 1 1 -8  14 11 o 579.9642 21.08935 65.59379       4.749986      65.48280       6.759180      65.70209       6.676570  577.3994 30.24845 578.4584 29.82178 -1.059082      42.47714 
1 1 1 -8  14 12 o 268.2671 42.39988 14.53862       4.270535      10.69833       6.244499      17.91288       5.853356  227.5585 66.48795 295.7249 52.90947 -68.16635      84.97093 
1 1 1 -8  14 13 o 362.5481 46.11093 26.42150       6.345386      0.000000       0.000000      26.42150       6.345386  ?        ?        362.5481 46.11093 0.000000       46.11093 
1 1 1 -8  14 14 o 943.8389 18.41808 173.5462       6.751032      173.3934       9.820934      173.6832       9.295521  941.6925 26.85442 942.8260 25.38717 -1.133484      36.95494 
1 1 1 -8  14 15 o 727.7680 21.58755 103.3405       6.101326      105.3697       8.947412      101.5768       8.341566  732.9131 31.43525 719.9625 29.83388 12.95062       43.33862 
1 1 1 -8  14 16 o 673.1414 23.67072 88.55599       6.187935      93.54250       8.845042      83.77593       8.660015  689.7350 33.02096 651.5386 34.34690 38.19635       47.64550 
1 1 1 -8  14 17 o 633.7122 25.50922 78.64587       6.277942      79.89206       8.849240      77.38315       8.907749  635.0773 36.02829 624.6984 36.88074 10.37891       51.55799 
1 1 1 -8  14 18 o 1021.596 28.51679 205.0763       11.31379      205.0763       11.31379      0.000000       0.000000  1021.596 28.51679 ?        ?        0.000000       28.51679 
1 1 1 -8  14 19 o 402.0486 39.59486 32.46523       6.102004      37.56870       8.819782      27.77952       8.451093  426.8399 54.44664 362.8902 62.20523 63.94971       82.66757 
1 1 1 -8  14 20 o 472.6867 35.95687 44.60398       6.551102      54.35664       9.221391      34.66611       9.308539  517.6058 46.36563 405.9558 60.92442 111.6500       76.56081 
1 1 1 -8  14 21 o 142.6520 64.66728 -3.108886      7.736540      -3.989529      8.834740      -0.2125009     16.02219  149.8920 68.39418 213.7433 95.27550 -63.85135      117.2825 
1 1 1 -8  14 22 o 630.3207 44.29224 80.96252       10.77334      76.13702       13.36438      89.91766       18.20599  601.2709 57.95111 637.9296 74.91340 -36.65869      94.71192 
1 1 1 -8  14 23 o 330.6226 54.87251 23.46603       6.798531      23.17830       9.393411      23.78255       9.852133  314.6119 77.40991 316.9911 80.02092 -2.379120      111.3357 
1 1 1 -8  14 24 o 256.5659 69.05821 15.40732       7.032896      6.308607       9.550895      26.18460       10.39462  193.6196 79.42798 325.6109 82.19316 -131.9913      114.3001 
1 1 1 -8  14 25 o 354.1040 66.65686 29.37856       8.830141      39.46872       16.80294      25.52891       10.37880  354.3188 110.3103 313.0738 83.73403 41.24509       138.4910 
1 1 1 -8  14 26 o 431.3620 44.01022 39.99253       7.269379      42.82610       10.57181      37.45115       10.01193  422.1585 66.69860 392.8979 68.08283 29.26053       95.30989 
1 1 1 -8  14 27 o 233.6673 82.61361 16.27475       9.359132      18.32350       13.05673      14.10961       13.42247  232.7064 93.82320 214.1180 91.38235 18.58839       130.9715 
1 1 1 -8  14 28 o 176.7783 69.39958 8.305254       6.958412      18.49489       12.56754      3.800493       8.356158  220.4954 90.85915 155.5449 69.10156 64.95052       114.1508 
1 1 1 -8  14 29 o 152.5150 62.84229 5.630037       6.011458      16.41532       9.256978      -2.235214      7.905142  212.7699 80.95838 126.4074 59.94823 86.36244       100.7375 
1 1 1 -8  15 1  o 290.7569 30.54467 16.73324       3.397452      19.54733       4.122990      10.78017       5.996721  313.7677 34.39981 228.1254 64.70306 85.64233       73.27914 
1 1 1 -8  15 2  o 751.9343 16.68100 110.0751       4.871132      106.7073       5.724683      118.9107       9.272555  739.9320 19.92194 779.1271 30.64525 -39.19513      36.55154 
1 1 1 -8  15 3  o 517.5345 20.40786 52.21501       4.101709      51.86593       4.886262      53.04787       7.547436  515.3630 24.41381 517.8472 37.79015 -2.484131      44.99033 
1 1 1 -8  15 4  o 329.9674 29.36719 21.48135       3.723900      25.39725       4.406412      11.69524       6.965852  358.5122 31.98440 237.5577 70.44901 120.9545       77.36966 
1 1 1 -8  15 5  o 173.2858 63.70938 4.972553       5.631653      4.972553       5.631653      0.000000       0.000000  173.2858 63.70938 ?        ?        0.000000       63.70938 
1 1 1 -8  15 6  o 303.0280 36.72787 18.31313       4.233926      29.90652       7.695101      13.27964       5.070413  384.0153 53.01209 253.6307 53.17640 130.3845       75.08669 
1 1 1 -8  15 7  o 693.1312 25.36519 93.85835       6.827813      0.000000       0.000000      93.85835       6.827813  ?        ?        693.1312 25.36519 0.000000       25.36519 
1 1 1 -8  15 8  f 273.6739 43.30191 15.13974       4.449077      22.25373       7.896756      11.83143       5.385115  327.0834 64.45947 238.4552 58.57494 88.62813       87.09792 
1 1 1 -8  15 9  o 478.1899 27.35537 44.84911       5.058994      40.70353       8.659524      46.99713       6.233348  450.0233 50.41482 488.4418 33.05559 -38.41846      60.28537 
1 1 1 -8  15 10 o 497.2257 23.76019 48.25117       4.588086      49.47818       6.615983      47.11436       6.368177  501.0236 34.20673 488.9517 33.74329 12.07190       48.04903 
1 1 1 -8  15 11 o 215.8518 66.50935 9.447083       6.126193      9.447083       6.126193      0.000000       0.000000  215.8518 66.50935 ?        ?        0.000000       66.50935 
1 1 1 -8  15 12 o 281.0366 42.11316 15.90971       4.454741      23.96808       6.384279      8.263450       6.218885  344.3487 49.13363 205.3417 67.44762 139.0070       83.44636 
1 1 1 -8  15 13 o 581.4478 23.21002 65.98270       5.241001      70.50816       7.831064      62.31126       7.053550  598.4269 33.83487 562.7795 32.41018 35.64746       46.85316 
1 1 1 -8  15 14 o 342.0891 57.24946 24.04960       7.336928      24.04960       7.336928      0.000000       0.000000  342.0891 57.24946 ?        ?        0.000000       57.24946 
1 1 1 -8  15 15 o 145.4850 57.78328 2.445017       4.876486      -2.253676      7.165310      6.499053       6.655646  142.8784 63.69907 191.7492 69.44661 -48.87076      94.23589 
1 1 1 -8  15 16 o 572.4230 36.76558 64.98217       8.129863      0.000000       0.000000      64.98217       8.129863  ?        ?        572.4230 36.76558 0.000000       36.76558 
1 1 1 -8  15 17 o 473.1967 32.35608 44.32512       5.910342      38.18938       8.392200      50.36325       8.325173  432.9133 50.88781 500.9338 43.21723 -68.02051      66.76300 
1 1 1 -8  15 18 o 306.8115 51.84706 19.49854       5.957523      24.60900       8.582730      14.74676       8.276055  339.1387 67.53903 260.4745 76.66832 78.66422       102.1741 
1 1 1 -8  15 19 o 377.6842 43.31655 28.90807       6.238577      28.83564       9.247077      28.96859       8.451819  366.9648 67.36879 370.9239 60.77857 -3.959045      90.73361 
1 1 1 -8  15 20 o 671.0282 30.63379 88.97416       7.983061      95.25005       13.01316      85.18714       10.10866  683.3864 49.36515 651.4400 40.15250 31.94635       63.63287 
1 1 1 -8  15 21 o 419.9034 50.47507 36.55077       8.066119      31.09106       9.305078      53.05566       16.17862  378.8199 65.62724 477.4344 90.57055 -98.61453      111.8479 
1 1 1 -8  15 22 o 113.3775 54.01747 -7.240668      6.567365      -8.370329      9.353994      -6.142494      9.222712  138.2447 65.46017 143.7322 67.08327 -5.487549      93.72939 
1 1 1 -8  15 23 o 216.7161 71.70879 10.67955       7.024745      22.26144       9.573505      -2.830268      10.33965  303.0898 80.11855 161.2309 73.73156 141.8590       108.8822 
1 1 1 -8  15 24 f 633.2061 38.26022 82.53781       9.364317      95.70470       17.65515      77.38363       11.04613  638.0430 72.54091 603.9444 47.47889 34.09863       86.69734 
1 1 1 -8  15 25 o 234.3047 85.55944 14.76418       10.13235      14.11996       16.42874      15.15966       12.87199  231.2891 99.93615 234.3352 93.62199 -3.046097      136.9391 
1 1 1 -8  15 26 o 129.5738 59.45239 -1.635687      6.800116      -8.165038      9.466286      5.326140       9.774763  130.3510 62.82231 176.6189 76.69868 -46.26794      99.14298 
1 1 1 -8  15 27 o 147.4788 64.24426 2.935992       6.901461      -7.841826      12.68973      7.462923       8.224107  145.4883 70.73703 176.0435 73.10380 -30.55527      101.7246 
1 1 1 -8  15 28 o 153.5901 65.37984 5.057945       6.838309      9.119811       12.89900      3.470082       8.064915  179.2264 82.10461 150.0701 67.19296 29.15628       106.0946 
1 1 1 -8  15 29 o 120.7738 57.61466 -2.840586      7.521145      0.000000       0.000000      -2.840586      7.521145  ?        ?        120.7738 57.61466 0.000000       57.61466 
1 1 1 -8  16 1  o 367.0537 30.83049 26.54347       4.354081      26.54347       4.354081      0.000000       0.000000  367.0537 30.83049 ?        ?        0.000000       30.83049 
1 1 1 -8  16 2  o 380.6644 26.57377 28.43686       3.903824      25.66441       4.574423      35.86833       7.489313  360.4568 33.04586 423.6788 46.26961 -63.22202      56.85864 
1 1 1 -8  16 3  o 438.0343 23.82341 37.54391       4.037419      40.84701       4.814375      29.71500       7.411907  456.4269 27.28567 383.9021 50.97471 72.52481       57.81807 
1 1 1 -8  16 4  o 544.4872 25.22322 57.87671       5.333548      57.87671       5.333548      0.000000       0.000000  544.4872 25.22322 ?        ?        0.000000       25.22322 
1 1 1 -8  16 5  o 1075.790 19.14355 225.4244       7.997931      225.4244       7.997931      0.000000       0.000000  1075.790 19.14355 ?        ?        0.000000       19.14355 
1 1 1 -8  16 6  o 118.4441 50.63828 -0.3014104E-01 4.134585      1.573541       4.980656      -3.584877      7.415339  140.7177 57.49945 140.6945 63.58728 0.2319336E-01  85.72940 
1 1 1 -8  16 7  o 176.2733 55.74552 6.124734       4.273802      18.33740       7.431314      0.8915661E-01  5.224199  296.3859 66.23003 133.5540 57.00504 162.8319       87.38416 
1 1 1 -8  16 8  o 136.4150 54.20310 2.033609       4.292549      -2.190130      7.301488      4.264506       5.306432  145.6013 64.64320 165.1874 61.63153 -19.58611      89.31510 
1 1 1 -8  16 9  o 403.4263 41.48522 32.38331       6.406969      32.38331       6.406969      0.000000       0.000000  403.4263 41.48522 ?        ?        0.000000       41.48522 
1 1 1 -8  16 10 o 298.3383 37.40443 17.75349       4.238449      21.23759       6.109774      14.52136       5.884704  323.6645 50.23585 264.6423 58.78666 59.02222       77.32731 
1 1 1 -8  16 11 o 157.6654 56.23398 4.311999       4.345520      14.44541       6.343932      -4.645740      5.964581  263.1051 62.93353 118.7324 54.90944 144.3727       83.52051 
1 1 1 -8  16 12 o 277.8785 43.90622 15.61635       4.580752      10.78488       6.558133      20.21914       6.401046  228.8655 68.46699 314.1971 54.43091 -85.33162      87.46687 
1 1 1 -8  16 13 o 178.5164 58.02480 6.238802       4.607114      7.373598       6.920264      5.335482       6.174254  200.6842 71.02945 179.9439 66.60983 20.74031       97.37583 
1 1 1 -8  16 14 o 847.3904 19.78039 140.0574       6.509480      141.2191       9.611731      139.0731       8.847298  848.6794 29.16285 842.7789 27.03143 5.900513       39.76392 
1 1 1 -8  16 15 o 451.8087 32.02831 40.34855       5.583324      40.00697       8.083854      40.66014       7.720686  445.2578 47.48214 449.8335 44.79093 -4.575714      65.27465 
1 1 1 -8  16 16 o 488.1066 31.56831 47.09531       5.951983      50.78278       8.754879      43.92630       8.116118  502.3339 45.36718 466.9422 45.32769 35.39166       64.13097 
1 1 1 -8  16 17 o 542.7375 29.70676 58.13092       6.237662      62.38050       9.083663      54.33901       8.580590  557.8066 42.24583 520.1693 42.85756 37.63739       60.17874 
1 1 1 -8  16 18 o 907.9761 31.08192 162.6183       10.95999      0.000000       0.000000      162.6183       10.95999  ?        ?        907.9761 31.08192 0.000000       31.08192 
1 1 1 -8  16 19 o 742.3140 28.24009 108.5473       8.141074      107.6476       12.91528      109.1405       10.48681  729.5115 45.82002 740.8257 36.45015 -11.31427      58.54987 
1 1 1 -8  16 20 o 331.2232 64.38158 23.74769       7.983215      18.85811       9.660146      34.28019       14.17795  287.0630 82.35925 378.4720 96.24257 -91.40903      126.6715 
1 1 1 -8  16 21 o 409.9068 53.01672 35.35810       8.241917      38.70742       9.771956      27.10338       15.34104  424.0260 61.10612 323.9879 105.9111 100.0381       122.2748 
1 1 1 -8  16 22 o 419.2382 43.98859 36.44345       7.055178      37.13881       9.790100      35.69217       10.17615  409.9442 63.55137 398.1738 68.26557 11.77032       93.26824 
1 1 1 -8  16 23 o 141.9660 63.01196 -0.3478378     6.933036      2.238518       9.465683      -3.341141      10.18317  172.5341 75.19635 156.4321 72.13383 16.10201       104.2007 
1 1 1 -8  16 24 f 324.4075 82.01135 27.28166       10.33779      26.22043       15.83709      28.06956       13.64605  286.3557 106.5452 306.4933 99.87428 -20.13754      146.0368 
1 1 1 -8  16 25 o 105.3674 51.17702 -8.560149      6.596472      -3.252734      9.144596      -14.31788      9.524647  143.0016 66.76117 118.5843 58.40058 24.41729       88.69995 
1 1 1 -8  16 26 o 193.0110 69.27959 9.709428       6.605563      12.67403       9.678925      7.124795       9.037391  208.7275 81.87902 178.7825 75.58932 29.94501       111.4357 
1 1 1 -8  16 27 o 235.8220 70.74558 15.88750       6.994691      12.03388       12.28451      17.73624       8.508666  193.4395 84.94804 237.5167 78.93591 -44.07721      115.9614 
1 1 1 -8  16 28 o 101.5013 49.64705 -7.538101      6.523222      -5.476714      11.73272      -8.460425      7.848033  137.4824 67.10367 109.8764 53.89177 27.60603       86.06523 
1 1 1 -8  17 1  o 570.4477 22.36362 63.41364       4.954341      67.96857       6.436529      56.79157       7.760821  589.9714 28.09265 536.8486 37.45919 53.12286       46.82295 
1 1 1 -8  17 2  o 1201.645 15.93472 280.9038       7.436157      283.8814       8.820460      273.5873       13.82640  1207.556 18.80858 1183.076 30.09320 24.48010       35.48751 
1 1 1 -8  17 3  o 932.8708 19.40736 169.4566       7.030981      169.4566       7.030981      0.000000       0.000000  932.8708 19.40736 ?        ?        0.000000       19.40736 
1 1 1 -8  17 4  o 1242.920 19.19657 300.8092       9.266052      300.8092       9.266052      0.000000       0.000000  1242.920 19.19657 ?        ?        0.000000       19.19657 
1 1 1 -8  17 5  o 1329.201 16.70045 343.8007       8.620786      337.5709       9.970207      362.2556       17.16034  1316.593 19.49955 1360.378 32.48166 -43.78503      37.88522 
1 1 1 -8  17 6  o 856.9108 18.13858 142.9482       6.036244      141.1265       7.076980      147.8118       11.56351  851.0059 21.41349 868.5213 34.28320 -17.51544      40.42122 
1 1 1 -8  17 7  f 261.1225 47.98510 13.88521       4.686757      7.920355       8.115892      16.86963       5.740722  212.5682 76.73328 287.1768 53.44086 -74.60869      93.50894 
1 1 1 -8  17 8  o 352.4373 35.67183 24.60961       4.815181      27.98812       8.060624      22.73504       6.004226  370.5810 57.90332 336.0179 47.32238 34.56308       74.78103 
1 1 1 -8  17 9  o 110.2709 50.33040 -2.999170      4.788760      -5.935784      8.408998      -1.589701      5.825707  142.4465 65.63663 131.3564 58.05790 11.09016       87.62926 
1 1 1 -8  17 10 f 795.2365 18.53048 123.1726       5.722831      124.4534       8.012612      121.8388       8.176488  798.2129 25.84803 789.6346 26.66322 8.578247       37.13553 
1 1 1 -8  17 11 o 411.8394 30.57803 33.40657       4.855730      40.08569       7.067542      27.43506       6.682687  448.9913 40.98418 369.0259 47.74989 79.96539       62.92659 
1 1 1 -8  17 12 o 244.2546 51.85910 12.33591       4.767168      8.132810       6.906858      16.15991       6.588025  206.5523 71.10532 277.6877 62.58781 -71.13548      94.72698 
1 1 1 -8  17 13 o 411.1911 32.45691 33.43087       5.140832      35.07185       7.417908      31.91435       7.131045  417.3897 46.55594 397.7754 47.07536 19.61432       66.20834 
1 1 1 -8  17 14 o 790.3737 21.14450 121.9912       6.490197      135.0490       9.533485      110.7120       8.860472  829.3489 29.59964 750.6871 30.39274 78.66180       42.42473 
1 1 1 -8  17 15 o 393.7349 36.93394 30.92429       5.581515      24.37065       8.113509      36.81221       7.690385  340.0918 63.77345 426.5079 47.22179 -86.41614      79.35333 
1 1 1 -8  17 16 o 258.4705 58.71910 14.12966       5.760020      16.17071       8.324733      12.25504       7.978115  272.5883 75.85852 240.6169 76.17210 31.97136       107.5021 
1 1 1 -8  17 17 o 408.4022 42.52077 33.65135       6.645108      38.20966       10.66738      30.76082       8.494628  424.5703 66.91180 383.8115 58.86877 40.75882       89.12194 
1 1 1 -8  17 18 o 181.6924 66.22421 6.002961       6.066220      -7.178499      8.830202      17.78397       8.347956  139.5793 65.30741 283.6788 74.73225 -144.0996      99.24700 
1 1 1 -8  17 19 o 483.8890 36.23360 46.91738       6.759601      57.04353       9.727107      37.46021       9.400306  527.9374 47.96658 421.3433 59.07189 106.5941       76.09389 
1 1 1 -8  17 20 o 214.4462 75.70540 9.660628       7.856530      11.83115       9.443919      4.782156       14.15835  233.4495 82.93862 216.4522 93.15092 16.99728       124.7233 
1 1 1 -8  17 21 o 161.2075 65.27398 3.524530       6.348863      17.92392       9.120805      -10.01086      8.842937  274.0727 80.43362 128.2667 61.53330 145.8059       101.2715 
1 1 1 -8  17 22 o 109.6747 53.34962 -10.59626      7.240839      -13.24701      9.071786      -5.943130      12.01938  121.1686 59.11118 162.2699 76.00974 -41.10134      96.28922 
1 1 1 -8  17 23 o 214.4902 78.41713 11.01326       8.514932      11.23515       16.37828      10.93107       9.967936  227.9266 99.13091 215.5033 83.49253 12.42328       129.6069 
1 1 1 -8  17 24 o 157.6958 68.73027 2.370227       7.908024      -34.78870      14.99139      16.69655       9.308459  127.5186 64.33416 247.1097 82.57767 -119.5911      104.6803 
1 1 1 -8  17 25 o 141.8795 61.78415 1.892081       6.378174      3.582211       9.111485      0.2680960      8.931411  164.9657 72.77547 150.9655 68.83871 14.00023       100.1750 
1 1 1 -8  17 26 f 226.3780 72.04913 14.56906       7.130486      13.66593       12.19138      15.03864       8.790912  204.0640 87.09113 220.1244 79.79915 -16.06039      118.1218 
1 1 1 -8  17 27 o 151.8356 65.26614 4.776715       6.935268      1.976555       11.98236      6.187308       8.504558  157.1763 74.32381 162.6391 71.06918 -5.462830      102.8341 
1 1 1 -8  18 1  o 758.7978 18.26913 112.0569       5.383588      105.3103       7.331455      119.9519       7.930918  734.7845 25.69225 784.1541 26.04318 -49.36957      36.58332 
1 1 1 -8  18 2  o 104.8021 46.04514 -0.8956105     3.613025      0.6500287      4.336020      -4.406357      6.534871  126.3268 52.82151 127.3078 58.36427 -0.9809723     78.71785 
1 1 1 -8  18 3  o 834.3074 20.65462 135.5735       6.692236      135.5735       6.692236      0.000000       0.000000  834.3074 20.65462 ?        ?        0.000000       20.65462 
1 1 1 -8  18 4  o 1368.689 19.48469 364.7684       10.35682      364.7684       10.35682      0.000000       0.000000  1368.689 19.48469 ?        ?        0.000000       19.48469 
1 1 1 -8  18 5  f 448.6667 31.63020 39.57489       5.476006      39.57489       5.476006      0.000000       0.000000  448.6667 31.63020 ?        ?        0.000000       31.63020 
1 1 1 -8  18 6  f 468.6847 26.40121 43.02063       4.785863      44.64336       5.603973      38.64795       9.199114  476.8169 30.42197 437.6980 55.35574 39.11890       63.16450 
1 1 1 -8  18 7  o 226.5636 59.94755 10.62391       5.356440      6.688747       6.914921      16.52755       8.469665  196.2968 70.83346 280.4295 75.91232 -84.13271      103.8271 
1 1 1 -8  18 8  o 1170.989 16.78373 266.9041       7.632547      246.4068       10.12949      293.8278       11.60931  1123.889 23.20792 1226.991 24.36336 -103.1018      33.64790 
1 1 1 -8  18 9  o 586.3176 22.69236 67.06828       5.167024      71.34166       7.239190      62.63026       7.377320  602.6954 31.03422 563.9819 33.83904 38.71344       45.91517 
1 1 1 -8  18 10 o 305.7506 46.57609 18.93880       5.355693      26.74561       9.615564      15.42764       6.448565  356.3665 71.95715 271.5150 62.45697 84.85147       95.28223 
1 1 1 -8  18 11 o 369.9286 39.89743 27.32877       5.641079      43.34816       10.41167      20.67222       6.711535  460.2742 59.65020 316.4645 56.69171 143.8096       82.29275 
1 1 1 -8  18 12 o 678.3868 22.36924 89.89159       5.893274      103.4315       8.850713      79.10715       7.898952  725.6129 31.40836 633.6074 32.20720 92.00549       44.98654 
1 1 1 -8  18 13 o 123.1341 54.08418 -0.9748101     4.981674      0.6585623      7.201722      -2.473477      6.898366  157.2820 67.02642 138.5289 62.07616 18.75311       91.35639 
1 1 1 -8  18 14 o 445.5629 33.37244 39.34888       5.732697      36.45585       8.410057      41.85979       7.834973  422.5421 52.37331 456.0248 44.81964 -33.48273      68.93304 
1 1 1 -8  18 15 o 819.0764 24.42168 131.4110       7.768334      134.0570       13.32359      130.0483       9.561786  819.3556 42.01303 812.9227 30.28739 6.432922       51.79209 
1 1 1 -8  18 16 o 188.9896 67.19050 6.709889       6.199083      3.709246       9.998959      8.583319       7.900713  194.5845 80.68883 211.5750 75.78615 -16.99049      110.6988 
1 1 1 -8  18 17 o 490.0384 34.84927 47.84935       6.588879      53.29501       9.695073      43.17538       8.981904  510.9207 49.48183 458.5829 51.31344 52.33777       71.28479 
1 1 1 -8  18 18 o 387.4062 43.75477 30.59963       6.467585      23.32908       9.250667      37.55181       9.045865  323.2593 75.11815 423.4228 56.41453 -100.1635      93.94326 
1 1 1 -8  18 19 o 619.8474 35.40718 77.05449       8.487869      73.47086       10.35388      84.39770       14.82123  599.5481 44.79186 629.4655 61.41180 -29.91742      76.01131 
1 1 1 -8  18 20 o 536.5842 40.34291 58.76723       8.345318      63.82553       10.38141      49.52810       14.03039  553.2145 48.82169 460.1200 81.50146 93.09445       95.00550 
1 1 1 -8  18 21 o 190.2587 73.25418 7.078598       7.636003      10.21210       9.712936      2.007903       12.35575  216.5782 82.80391 189.6387 84.14794 26.93954       118.0566 
1 1 1 -8  18 22 o 262.3979 65.55716 16.17934       6.661288      15.42075       9.536524      16.90210       9.308580  245.5331 83.57558 256.7376 82.38563 -11.20447      117.3553 
1 1 1 -8  18 23 o 561.6844 39.58199 66.08132       8.578886      36.51453       15.60074      78.89767       10.27130  336.4951 106.5161 609.1528 43.70870 -272.6576      115.1353 
1 1 1 -8  18 24 o 100.4001 48.98014 -8.759736      6.229274      -13.19482      8.519273      -3.664180      9.131617  111.7395 55.06889 140.2088 65.85966 -28.46935      85.84916 
1 1 1 -8  18 25 o 155.5204 64.21383 4.784647       6.293637      -3.381624      8.764926      13.47666       9.042665  134.8396 63.70175 211.7796 80.15083 -76.93997      102.3820 
1 1 1 -8  18 26 o 220.1126 71.41309 14.26370       6.979640      18.41637       12.48265      12.37484       8.418654  216.2481 89.95327 198.5808 76.78780 17.66730       118.2707 
1 1 1 -8  18 27 o 211.6977 70.28831 13.75773       6.747086      12.34206       12.01533      14.40971       8.154072  184.3935 82.32664 206.3558 76.51591 -21.96231      112.3938 
1 1 1 -8  19 1  o 193.7376 53.12980 7.672246       4.117254      6.435305       5.751748      8.972138       5.896294  187.5528 64.86916 211.5066 65.26255 -23.95372      92.01744 
1 1 1 -8  19 2  o 766.1700 18.44497 114.2714       5.488215      112.5330       6.516599      118.5130       10.17880  759.9073 22.08169 777.9865 33.68967 -18.07922      40.28145 
1 1 1 -8  19 3  o 488.4569 28.89904 46.78298       5.457593      46.78298       5.457593      0.000000       0.000000  488.4569 28.89904 ?        ?        0.000000       28.89904 
1 1 1 -8  19 4  o 477.8722 25.09242 44.68369       4.640451      50.12899       5.599397      32.74230       8.291968  505.6697 28.63076 402.5743 54.43343 103.0954       61.50381 
1 1 1 -8  19 5  o 459.1128 26.70165 41.30650       4.740298      37.01212       5.574826      52.51624       9.006977  433.3560 33.38224 513.7532 45.61820 -80.39728      56.52782 
1 1 1 -8  19 6  o 761.5358 30.85023 113.5420       9.123821      113.5420       9.123821      0.000000       0.000000  761.5358 30.85023 ?        ?        0.000000       30.85023 
1 1 1 -8  19 7  o 1004.137 22.48221 196.7010       8.767182      195.7448       10.83044      198.5189       14.93233  1000.445 27.87564 1004.343 38.28400 -3.898315      47.35733 
1 1 1 -8  19 8  o 768.3427 22.16908 115.1878       6.615011      119.3696       8.042208      106.4401       11.63157  781.3575 26.50315 733.2356 41.01202 48.12195       48.83034 
1 1 1 -8  19 9  o 522.0395 24.71817 53.25946       5.011268      56.56808       7.035419      49.85199       7.139740  535.4426 34.01010 501.7997 36.89612 33.64288       50.17978 
1 1 1 -8  19 10 o 448.9159 29.12205 39.66806       5.049678      37.42473       7.090008      41.97753       7.193769  432.5861 42.76322 458.9455 40.78658 -26.35941      59.09516 
1 1 1 -8  19 11 o 601.4224 24.20982 70.73455       5.654563      76.36076       8.153199      65.52035       7.848994  621.9000 33.88602 575.5228 35.28784 46.37726       48.92335 
1 1 1 -8  19 12 o 452.7397 76.54066 43.70831       12.97792      43.70831       12.97792      0.000000       0.000000  452.7397 76.54066 ?        ?        0.000000       76.54066 
1 1 1 -8  19 13 o 177.9875 62.09562 5.934356       5.275894      1.332352       7.705365      9.996080       7.238940  165.3169 69.84097 221.3739 72.77192 -56.05696      100.8638 
1 1 1 -8  19 14 o 138.5365 60.23761 -0.4532025     6.044580      -5.137991      10.05893      2.194604       7.562232  159.0523 72.73107 168.4131 70.03151 -9.360840      100.9664 
1 1 1 -8  19 15 o 378.0703 42.44556 28.87381       6.124411      17.51504       8.770631      39.68298       8.555815  282.2080 77.60738 440.4989 50.95418 -158.2909      92.83983 
1 1 1 -8  19 16 o 362.1829 44.89132 26.73226       6.178876      18.22322       8.868422      34.75942       8.613647  286.2863 77.75452 408.9130 55.68950 -122.6267      95.64039 
1 1 1 -8  19 17 o 905.0362 22.99525 160.7559       8.082248      161.1700       11.77562      160.3871       11.11318  900.7504 33.66288 899.6445 31.80821 1.105835       46.31363 
1 1 1 -8  19 18 o 459.0562 38.05168 42.58847       6.722556      56.04689       9.996249      31.47577       9.083430  519.9327 50.12751 380.9425 63.64460 138.9901       81.01483 
1 1 1 -8  19 19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -8  19 20 o 112.0533 53.54191 -7.211790      6.550920      -9.153609      9.500760      -5.451865      9.044845  135.2295 64.57814 141.9958 66.32667 -6.766342      92.57194 
1 1 1 -8  19 21 o 167.9410 66.98583 4.849279       6.579056      10.33022       9.558946      -0.8396528E-01 9.068774  213.1259 81.98787 159.1002 71.24299 54.02576       108.6166 
1 1 1 -8  19 22 o 369.7410 58.57850 31.13255       8.130947      35.47144       16.03553      29.63090       9.433618  329.9544 108.3024 347.5912 72.24253 -17.63684      130.1860 
1 1 1 -8  19 23 o 206.7738 74.11704 11.03429       7.557763      -2.913301      13.38274      17.56567       9.157938  166.6707 78.73161 249.8798 81.83714 -83.20908      113.5605 
1 1 1 -8  19 24 o 236.0667 65.45948 14.44581       6.210481      16.32809       8.542549      12.33565       9.044852  235.6967 79.10577 206.6577 79.68163 29.03900       112.2804 
1 1 1 -8  19 25 o 191.2695 67.07492 10.08221       6.159732      12.65638       8.783925      7.591576       8.640206  201.5777 78.29890 173.5165 73.66625 28.06119       107.5055 
1 1 1 -8  19 26 o 121.3839 56.89933 -1.755077      6.756211      -13.75204      12.13215      3.637907       8.134234  126.4065 62.89260 149.5689 67.18843 -23.16238      92.03133 
1 1 1 -8  20 1  o 408.3423 28.99794 32.76459       4.568635      32.40676       6.376037      33.14214       6.549504  403.6687 41.25183 408.1138 41.91925 -4.445160      58.81273 
1 1 1 -8  20 2  o 478.0277 29.49621 44.86637       5.449047      44.86637       5.449047      0.000000       0.000000  478.0277 29.49621 ?        ?        0.000000       29.49621 
1 1 1 -8  20 3  o 827.4529 18.67546 133.3560       6.001262      135.9765       7.105568      126.8355       11.20851  835.0633 21.91046 803.6663 35.91236 31.39703       42.06858 
1 1 1 -8  20 4  o 459.4463 26.54176 41.38704       4.715620      40.81956       5.638923      42.70697       8.599979  455.2632 32.09935 461.6179 48.70726 -6.354675      58.33323 
1 1 1 -8  20 5  o 502.1689 26.23938 49.41873       5.099422      50.32161       5.956773      46.94181       9.866199  505.9509 30.45815 482.4245 53.56578 23.52640       61.61973 
1 1 1 -8  20 6  o 276.8282 55.65794 15.84570       5.776179      14.40668       7.603351      17.80965       8.882506  261.4414 72.40520 289.2016 77.51168 -27.76019      106.0687 
1 1 1 -8  20 7  o 865.4300 19.60937 146.0197       6.590580      154.9660       7.859321      124.8240       12.09734  890.9351 22.71491 795.3920 39.16341 95.54309       45.27406 
1 1 1 -8  20 8  o 251.4914 61.97649 13.28758       6.014078      13.28758       6.014078      0.000000       0.000000  251.4914 61.97649 ?        ?        0.000000       61.97649 
1 1 1 -8  20 9  o 609.7637 26.58379 72.79431       6.295155      79.29847       7.649428      59.14560       11.08101  635.4861 30.99524 540.5584 53.48662 94.92767       61.81847 
1 1 1 -8  20 10 o 532.6165 26.11605 55.54789       5.401945      60.65782       7.781955      50.79571       7.504600  553.2623 36.42209 505.4685 38.52009 47.79379       53.01289 
1 1 1 -8  20 11 o 400.8366 34.56594 31.90504       5.328149      29.48494       7.727798      34.09800       7.356209  379.2141 53.99919 410.7776 46.95625 -31.56348      71.55978 
1 1 1 -8  20 12 f 222.6374 64.49088 10.42947       5.897700      26.89252       9.865859      1.275016       7.356918  353.3797 74.24936 161.7757 68.28870 191.6040       100.8777 
1 1 1 -8  20 13 o 134.1441 58.03734 -0.2318464     5.555418      -10.05595      8.354095      7.556799       7.438474  126.9601 60.60881 202.4696 73.40373 -75.50949      95.19210 
1 1 1 -8  20 14 o 375.5132 48.71254 28.84703       6.936483      46.12844       13.74380      22.94060       8.034890  459.4369 79.93164 327.6538 65.43523 131.7831       103.2998 
1 1 1 -8  20 15 o 844.9990 22.84015 139.9626       7.495197      132.5771       10.64824      147.2153       10.55203  817.9784 33.52032 862.9716 31.48557 -44.99323      45.98861 
1 1 1 -8  20 16 o 761.3376 24.91016 114.0149       7.365151      119.8088       10.54358      108.4934       10.29275  775.6074 35.00403 737.5765 35.93322 38.03088       50.16452 
1 1 1 -8  20 17 o 176.2803 74.22525 2.876263       8.656598      0.000000       0.000000      2.876263       8.656598  ?        ?        176.2803 74.22525 0.000000       74.22525 
1 1 1 -8  20 18 o 609.3824 45.29181 76.64385       10.64197      76.64385       10.64197      0.000000       0.000000  609.3824 45.29181 ?        ?        0.000000       45.29181 
1 1 1 -8  20 19 o 304.8746 57.30012 20.46664       6.535224      25.36600       9.448795      15.97352       9.048594  326.6254 75.93056 255.9658 81.13121 70.65961       111.1203 
1 1 1 -8  20 20 o 154.0616 64.65752 2.683184       6.533928      -5.922628      9.198086      11.44908       9.283244  139.9959 65.86781 219.9167 81.62273 -79.92084      104.8849 
1 1 1 -8  20 21 o 162.3996 65.75958 4.475862       6.443982      -0.5903368     9.080775      9.614995       9.145907  154.5902 70.07145 203.8649 79.69839 -49.27472      106.1218 
1 1 1 -8  20 22 o 134.9064 62.15996 -2.056425      7.540820      -5.965102      13.64921      -0.3392731     9.046841  161.6007 77.23591 151.9665 69.29012 9.634216       103.7618 
1 1 1 -8  20 23 o 227.1240 67.44674 13.52050       6.381551      11.96223       8.871770      15.19118       9.186193  205.9271 79.04086 225.9828 81.62701 -20.05566      113.6241 
1 1 1 -8  20 24 o 195.4280 67.45668 10.45343       6.218237      13.26744       8.752456      7.585461       8.835969  207.2907 78.75764 175.1709 74.43647 32.11984       108.3677 
1 1 1 -8  20 25 o 97.27911 48.16443 -10.77243      6.786150      -8.045670      12.19211      -11.99639      8.168415  137.0249 67.20011 106.1702 52.61578 30.85477       85.34797 
1 1 1 -8  21 1  o 845.0287 23.23780 139.3585       7.625957      135.9883       8.551979      152.4415       16.84957  834.1378 26.39981 874.6033 49.81393 -40.46558      56.37711 
1 1 1 -8  21 2  o 825.2789 21.93075 132.8619       7.028818      132.8619       7.028818      0.000000       0.000000  825.2789 21.93075 ?        ?        0.000000       21.93075 
1 1 1 -8  21 3  f 935.5546 17.93450 170.4961       6.516078      173.7895       7.753472      162.5764       12.02329  943.9634 21.15013 909.8285 34.02796 34.13495       40.06532 
1 1 1 -8  21 4  o 934.6364 18.31586 170.2033       6.648106      172.4887       7.868408      164.5013       12.42854  940.2742 21.54787 914.7222 34.98668 25.55200       41.08988 
1 1 1 -8  21 5  o 735.2723 39.16342 106.9673       11.14266      0.000000       0.000000      106.9673       11.14266  ?        ?        735.2723 39.16342 0.000000       39.16342 
1 1 1 -8  21 6  o 307.6844 51.85100 19.39550       5.975422      8.370933       7.651485      36.63051       9.566885  211.6676 74.71240 422.3557 60.01434 -210.6881      95.83143 
1 1 1 -8  21 7  o 592.9092 24.79129 68.74195       5.708412      71.14843       6.780009      62.88228       10.57977  602.4267 28.97998 559.3867 49.20123 43.03998       57.10166 
1 1 1 -8  21 8  o 956.5575 19.81923 178.5057       7.362507      176.5799       8.573937      183.9128       14.36684  950.5558 23.22602 964.7803 38.34464 -14.22443      44.83034 
1 1 1 -8  21 9  o 407.7508 35.10875 33.01181       5.505323      39.86111       6.474364      15.12948       10.46131  447.6469 37.59006 267.8786 87.45426 179.7683       95.19065 
1 1 1 -8  21 10 o 571.1920 29.02383 64.21715       6.417043      63.04167       7.972717      66.37944       10.81322  563.6877 36.61846 573.7504 48.99916 -10.06268      61.17050 
1 1 1 -8  21 11 o 457.3997 59.75526 43.27392       10.36082      43.27392       10.36082      0.000000       0.000000  457.3997 59.75526 ?        ?        0.000000       59.75526 
1 1 1 -8  21 12 o 598.6902 26.28246 70.33720       6.110772      82.62963       8.877329      59.26729       8.424329  645.1701 35.56814 544.4099 40.12858 100.7603       53.62271 
1 1 1 -8  21 13 o 271.7096 55.88917 15.57551       5.700571      21.80058       8.254181      9.898705       7.882318  317.2942 68.95544 220.6405 75.96037 96.65370       102.5906 
1 1 1 -8  21 14 o 438.9388 36.00648 38.57347       6.083748      44.57465       8.782015      33.03605       8.435862  466.2200 49.24917 397.4645 56.22020 68.75549       74.74084 
1 1 1 -8  21 15 o 536.7793 74.07654 63.38464       15.03058      63.38464       15.03058      0.000000       0.000000  536.7793 74.07654 ?        ?        0.000000       74.07654 
1 1 1 -8  21 16 o 438.1172 59.68989 41.14339       9.891576      44.35854       16.91219      39.47169       12.19494  416.8157 104.6357 415.5210 78.44730 1.294708       130.7769 
1 1 1 -8  21 17 o 287.4059 59.42115 18.17482       6.413235      31.42591       9.041893      4.759556       9.097732  376.9845 64.05183 186.3673 77.09809 190.6173       100.2335 
1 1 1 -8  21 18 o 537.2249 38.80964 59.13285       8.042506      60.59721       9.821535      56.15250       14.01166  536.9401 47.59374 489.6106 76.16621 47.32950       89.81345 
1 1 1 -8  21 19 o 236.5690 65.96013 13.15519       6.287695      10.49650       9.249183      15.43961       8.573498  213.7193 81.01866 248.6583 78.98936 -34.93909      113.1519 
1 1 1 -8  21 20 o 131.3269 58.39526 -0.2610349     5.980432      9.992779       8.433862      -10.63115      8.481555  205.1860 77.46564 119.4746 58.02929 85.71144       96.79011 
1 1 1 -8  21 21 o 322.7515 60.85555 24.62158       7.348010      16.87857       12.27673      28.94384       9.172409  236.9217 92.41608 338.7757 71.94018 -101.8540      117.1158 
1 1 1 -8  21 22 o 164.4288 67.98553 5.397819       7.068704      -0.3458573E-01 12.31163      8.069203       8.633517  165.0457 77.18834 183.7564 75.46518 -18.71074      107.9492 
1 1 1 -8  21 23 o 139.7011 60.79389 2.417072       6.166781      -2.324691      8.588247      7.464132       8.860412  135.6465 63.76582 175.5602 74.56920 -39.91374      98.11547 
1 1 1 -8  21 24 o 102.1891 50.15724 -8.940949      6.836652      1.072800       12.13515      -13.59705      8.274809  157.1194 74.44424 104.4752 51.97435 52.64426       90.79250 
1 1 1 -8  22 1  o 672.7281 26.74454 88.51221       6.987191      88.26408       7.856501      89.45102       15.28176  671.1342 30.14337 664.4057 59.86901 6.728516       67.02925 
1 1 1 -8  22 2  o 400.8080 34.67062 31.80811       5.343528      26.88405       6.859249      39.40966       8.522472  364.3497 49.77874 442.0612 50.55161 -77.71155      70.94637 
1 1 1 -8  22 3  o 519.6939 25.68027 52.81135       5.182928      54.90330       6.239339      48.15424       9.309387  528.2709 30.54293 489.2938 49.68081 38.97711       58.31856 
1 1 1 -8  22 4  o 802.1145 19.83691 125.4701       6.179288      125.8423       7.307045      124.5356       11.57779  802.6201 23.44249 794.7369 37.51235 7.883179       44.23490 
1 1 1 -8  22 5  o 783.7747 25.23050 120.1457       7.679714      122.9655       10.06188      116.2107       11.88618  790.9758 32.75576 765.6578 40.11371 25.31799       51.78851 
1 1 1 -8  22 6  o 930.7946 19.73371 169.0050       7.133302      171.9309       8.436547      161.6677       13.35981  938.0070 23.15958 904.7624 38.02223 33.24463       44.52029 
1 1 1 -8  22 7  o 780.9435 21.90896 119.1266       6.644609      134.7153       8.045133      85.67299       11.78556  829.7382 24.96687 653.9352 46.71494 175.8030       52.96820 
1 1 1 -8  22 8  o 1270.063 21.84473 315.1734       10.77457      307.2204       13.37750      329.8599       18.17887  1251.661 27.52075 1292.329 36.22145 -40.66809      45.49049 
1 1 1 -8  22 9  o 731.3248 30.31979 105.1829       8.611217      109.2481       11.90535      100.7226       12.47049  740.1312 41.58812 708.7111 45.55049 31.42010       61.67997 
1 1 1 -8  22 10 o 191.4033 64.27842 7.250358       5.640325      11.38338       6.792859      -1.925370      10.12136  231.6884 69.76529 171.1547 76.04288 60.53375       103.1975 
1 1 1 -8  22 11 o 475.2707 33.13885 44.85680       6.078272      59.11712       8.514025      30.03391       8.680338  543.0386 40.66691 377.8702 61.24805 165.1684       73.51954 
1 1 1 -8  22 12 o 172.6757 65.83157 4.830194       6.128403      5.659261       7.445869      3.089078       10.79033  187.3253 72.27690 195.3845 82.60132 -8.059143      109.7585 
1 1 1 -8  22 13 o 327.1025 47.42510 22.11775       5.848797      13.31373       8.223023      31.13225       8.320738  245.4437 77.29208 384.1773 57.54117 -138.7336      96.35897 
1 1 1 -8  22 14 o 572.3229 29.28111 65.03432       6.486347      63.51675       9.097647      66.60328       9.250422  559.0331 42.21608 572.7175 41.88083 -13.68445      59.46597 
1 1 1 -8  22 15 o 236.6457 69.10400 12.61392       6.747258      7.422544       8.245903      23.13221       11.73734  198.9620 76.24105 306.6186 91.56607 -107.6566      119.1513 
1 1 1 -8  22 16 o 264.8414 60.01329 15.58269       6.029708      22.71375       8.908850      9.554667       8.190908  311.6472 74.60095 210.9314 76.94182 100.7158       107.1697 
1 1 1 -8  22 17 o 585.2315 45.69452 71.62978       10.30298      91.56954       16.36511      58.53712       13.26090  636.9750 67.16859 506.3736 69.24807 130.6015       96.47235 
1 1 1 -8  22 18 o 134.7524 59.71068 -0.2707352     6.200499      3.594383       9.222899      -3.458482      8.375833  175.6346 75.37367 140.8823 65.12328 34.75223       99.61040 
1 1 1 -8  22 19 o 455.0242 36.84790 42.94225       6.455505      42.96514       9.022351      42.91823       9.240482  439.8475 53.95001 437.9896 55.57605 1.857941       77.45515 
1 1 1 -8  22 20 o 189.4111 65.48563 8.638347       5.861303      9.603943       7.997958      7.518110       8.614617  197.3728 75.21550 185.7013 75.72058 11.67151       106.7285 
1 1 1 -8  22 21 o 140.1911 61.43021 1.682858       6.393317      1.936043       9.877309      1.500296       8.387339  160.8228 72.96864 151.6674 68.17051 9.155365       99.85810 
1 1 1 -8  22 22 o 107.5415 51.22233 -4.515597      5.896422      -3.389418      8.127355      -5.767105      8.567658  129.6528 61.27886 125.9325 60.45446 3.720245       86.08043 
1 1 1 -8  22 23 o 114.0248 53.46061 -2.499914      5.969441      2.134594       8.612518      -6.784861      8.281348  148.4978 67.66895 119.2164 57.77273 29.28137       88.97626 
1 1 1 -8  23 1  o 613.5086 28.57971 73.75595       6.809363      67.23457       7.579750      101.0338       15.50209  583.8272 33.57184 706.5472 56.98096 -122.7200      66.13544 
1 1 1 -8  23 2  o 329.5187 42.82821 21.86334       5.351154      23.33277       6.932310      19.69689       8.417396  336.9822 54.85892 303.8239 72.37250 33.15829       90.81453 
1 1 1 -8  23 3  o 672.7214 22.34109 88.39448       5.836704      87.53759       6.885602      90.58204       11.00171  668.6513 26.51638 674.6957 42.20000 -6.044434      49.83932 
1 1 1 -8  23 4  o 530.0573 32.85825 55.48142       6.730530      72.77625       9.239634      35.92961       9.824038  605.2159 39.52832 416.2918 62.71255 188.9241       74.13064 
1 1 1 -8  23 5  o 200.5651 59.93485 8.302242       5.027509      5.176890       5.969341      15.92940       9.325203  176.2748 65.44681 272.1657 81.69368 -95.89091      104.6764 
1 1 1 -8  23 6  o 303.1410 46.60740 18.74887       5.311204      20.37671       6.258362      14.55843       10.04116  314.1717 53.19216 262.3316 85.68186 51.84006       100.8503 
1 1 1 -8  23 7  o 355.5476 43.38772 25.54584       5.866637      29.01345       7.212932      18.76825       10.08403  376.7450 50.57597 292.0028 84.25473 84.74216       98.26897 
1 1 1 -8  23 8  o 298.7039 56.64806 18.69409       6.330888      13.29917       7.957364      27.99847       10.45010  248.7737 75.64360 357.9132 77.43233 -109.1395      108.2484 
1 1 1 -8  23 9  o 176.9053 63.41041 5.756748       5.531940      4.193122       6.544846      9.668468       10.35182  171.7252 67.34038 228.6024 85.92591 -56.87715      109.1695 
1 1 1 -8  23 10 o 363.2340 41.71707 26.74317       5.777967      25.07176       6.846889      30.87801       10.76917  347.4555 52.36797 373.9020 76.73636 -26.44653      92.90249 
1 1 1 -8  23 11 o 445.1854 39.01449 39.94104       6.677147      51.52596       8.312137      18.86548       11.21129  504.2290 42.85411 285.8117 90.27763 218.4174       99.93260 
1 1 1 -8  23 12 o 677.8614 24.91582 90.47092       6.559099      94.99873       9.229578      85.85091       9.323062  690.3033 34.42817 654.0541 36.85447 36.24915       50.43363 
1 1 1 -8  23 13 o 364.3560 60.41080 28.66825       8.248626      28.66825       8.248626      0.000000       0.000000  364.3560 60.41080 ?        ?        0.000000       60.41080 
1 1 1 -8  23 14 o 91.04611 44.94579 -11.67369      5.756904      -19.61324      8.296256      -4.300131      7.995078  102.7441 51.26171 137.9900 63.72990 -35.24588      81.78792 
1 1 1 -8  23 15 o 219.5979 64.96251 10.92481       5.928607      27.67067       8.609437      -4.177299      8.175980  350.5349 65.65623 139.0686 64.30482 211.4663       91.90131 
1 1 1 -8  23 16 o 144.7290 63.21822 0.5583573      6.723508      3.156754       8.256441      -4.556856      11.58436  169.5151 71.99174 162.6378 75.66415 6.877304       104.4408 
1 1 1 -8  23 17 o 121.7973 57.06321 -4.587878      6.779992      -8.734881      8.423694      3.040303       11.42473  124.7120 59.88870 183.8075 81.26898 -59.09550      100.9520 
1 1 1 -8  23 18 o 133.4987 58.67422 0.4425745      5.871408      -5.067330      8.402581      5.699856       8.207697  133.4379 62.83475 177.4548 73.30569 -44.01692      96.55015 
1 1 1 -8  23 19 o 408.4433 46.30410 36.51159       7.215010      28.56820       11.14935      42.23471       9.463737  314.4330 87.89150 425.7610 58.80566 -111.3280      105.7498 
1 1 1 -8  23 20 o 181.6149 68.89893 8.140546       6.692057      5.697955       9.938947      10.16629       9.051218  175.4371 76.74088 195.6929 78.39230 -20.25583      109.7019 
1 1 1 -8  23 21 o 151.6544 61.62543 4.694277       5.681221      -6.202432      7.326056      21.13309       8.998242  115.3565 55.51241 264.2548 80.45858 -148.8983      97.75076 
1 1 1 -8  23 22 o 167.3629 63.78223 7.131124       5.751441      1.659806       7.841166      13.50279       8.461771  143.5732 65.09235 207.1862 77.72369 -63.61299      101.3804 
1 1 1 -8  24 1  o 323.2057 40.68487 21.03565       4.993536      22.98122       6.730442      18.65326       7.447770  333.9203 53.72248 296.0411 66.41521 37.87921       85.42297 
1 1 1 -8  24 2  o 367.5673 40.61865 27.13000       5.701275      33.94766       7.213463      15.78282       9.306152  409.8316 46.12373 270.2547 81.72083 139.5768       93.83865 
1 1 1 -8  24 3  o 256.5659 62.60775 13.99315       6.183085      15.99611       8.594861      11.84467       8.901609  271.5406 77.61684 239.9090 80.75001 31.63158       112.0042 
1 1 1 -8  24 4  o 464.7713 37.16054 43.05772       6.651236      42.45452       8.788073      43.86658       10.17645  456.6214 50.39726 460.8165 58.15963 -4.195129      76.95731 
1 1 1 -8  24 5  o 223.7424 59.34821 10.61619       5.241457      11.14700       6.239675      9.343747       9.660711  228.8418 66.34760 224.5072 83.27769 4.334671       106.4762 
1 1 1 -8  24 6  o 130.5805 58.84673 -2.512182      6.298079      -0.7947372     8.514365      -4.587316      9.359098  161.1161 70.73814 153.7936 70.25986 7.322449       99.70121 
1 1 1 -8  24 7  f 267.5201 51.90335 14.98996       5.197836      15.54733       6.196195      13.66614       9.549169  269.5633 60.65479 251.5647 83.62408 17.99864       103.3053 
1 1 1 -8  24 8  o 672.7211 26.34708 89.03799       6.883282      99.62140       8.593657      70.09535       11.49702  709.7274 31.17873 584.5211 51.16260 125.2063       59.91431 
1 1 1 -8  24 9  o 181.7510 76.42110 2.884619       9.155472      2.884619       9.155472      0.000000       0.000000  181.7510 76.42110 ?        ?        0.000000       76.42110 
1 1 1 -8  24 10 o 217.1506 63.05764 10.25017       5.632221      14.53743       6.653747      -0.5861234     10.57832  256.4633 66.31449 175.9208 77.97034 80.54247       102.3571 
1 1 1 -8  24 11 o 168.1031 63.94778 4.842933       5.774742      8.441960       6.751612      -4.965264      11.14575  201.5260 70.24873 163.8648 75.52793 37.66118       103.1472 
1 1 1 -8  24 12 o 130.5344 58.90191 -2.049820      6.333631      -8.164510      7.753246      10.21595       10.98105  123.1409 58.67553 224.9913 87.50303 -101.8504      105.3546 
1 1 1 -8  24 13 o 94.39180 46.10394 -9.362245      5.565834      -7.620822      7.641395      -11.33021      8.123240  122.9447 58.48984 117.6586 57.06496 5.286125       81.71579 
1 1 1 -8  24 14 o 413.8886 38.64540 35.19975       6.139818      37.92677       8.821178      32.63715       8.551145  417.9989 55.72882 384.9495 59.08728 33.04941       81.22197 
1 1 1 -8  24 15 o 248.9219 67.06911 14.59727       6.629582      12.15967       8.226906      19.11194       11.19614  224.7871 77.59068 268.2031 90.55983 -43.41600      119.2535 
1 1 1 -8  24 16 o 148.6647 63.93727 1.829412       6.662067      -0.1738504     8.325904      5.394763       11.10743  151.6995 68.07223 190.2374 82.18555 -38.53787      106.7159 
1 1 1 -8  24 17 o 160.3865 62.77348 4.962379       5.678899      7.912632       7.931849      1.859576       8.134331  188.5233 74.06799 156.8183 68.98932 31.70500       101.2205 
1 1 1 -8  24 18 o 156.6299 62.28223 4.762514       5.671490      2.735459       7.740754      7.111836       8.333391  155.7916 67.94715 181.0767 74.22734 -25.28513      100.6306 
1 1 1 -8  24 19 o 270.0434 64.30199 18.41704       6.646725      -0.9316324     10.23677      32.51979       8.739557  152.4480 70.99142 361.5243 64.61943 -209.0763      95.99715 
1 1 1 -8  24 20 o 224.7015 67.73190 13.67890       6.400209      -2.189826      9.207686      28.51330       8.902551  140.2744 65.96835 323.5148 72.63756 -183.2404      98.12257 
1 1 1 -8  25 1  o 387.2632 34.67614 29.93150       5.159915      32.04421       6.934947      27.31139       7.722929  396.9368 45.83005 361.6859 56.85846 35.25089       73.02930 
1 1 1 -8  25 2  o 123.3631 54.73340 -1.340866      5.225969      1.512171       7.138658      -4.635567      7.671333  159.7768 67.34694 136.7209 62.88446 23.05588       92.14155 
1 1 1 -8  25 3  o 370.0183 48.15881 28.08240       6.756333      30.65489       9.138395      24.98091       10.03409  379.4644 64.30790 334.9799 78.50169 44.48447       101.4792 
1 1 1 -8  25 4  o 572.0032 33.26954 65.04225       7.358568      60.75861       9.866753      70.41100       11.04598  546.5446 46.94138 587.5394 48.85345 -40.99481      67.75066 
1 1 1 -8  25 5  o 204.6896 61.06727 8.900838       5.222447      7.133482       6.280935      12.85961       9.400317  191.4122 67.67738 244.1911 82.97728 -52.77881      107.0769 
1 1 1 -8  25 6  o 610.6113 25.52529 73.36702       6.052900      77.66256       7.182098      62.83648       11.24521  626.8434 29.50287 550.9528 53.21893 75.89069       60.84960 
1 1 1 -8  25 7  o 396.1463 36.38957 31.59359       5.535771      37.12508       6.615070      18.66800       10.11203  428.0403 40.26773 283.9081 85.03703 144.1322       94.08925 
1 1 1 -8  25 8  o 509.7396 30.18697 51.70364       5.949177      53.40139       7.029353      47.41750       11.16895  515.8046 35.30381 469.8901 62.77470 45.91446       72.02098 
1 1 1 -8  25 9  o 481.8669 32.52744 46.48956       6.051390      52.34409       7.204340      32.46181       11.15173  509.3992 36.66249 375.3618 79.00058 134.0374       87.09322 
1 1 1 -8  25 10 o 300.5227 50.70284 19.17401       5.706900      25.96746       6.832739      3.501833       10.37801  350.0801 51.82304 188.6984 80.43890 161.3817       95.68723 
1 1 1 -8  25 11 o 136.0227 58.85815 0.4167998      5.715234      -0.1848121     6.842296      1.805257       10.39465  143.8079 63.26939 179.9177 78.59637 -36.10977      100.8980 
1 1 1 -8  25 12 o 469.7723 35.88187 44.90266       6.496707      49.90459       7.571714      30.94322       12.64909  492.7663 39.90904 346.4583 92.33734 146.3080       100.5928 
1 1 1 -8  25 13 f 183.0392 68.76048 6.819313       6.627130      9.390915       7.824960      0.2950864      12.46363  205.1595 75.14754 182.3064 82.41187 22.85318       111.5297 
1 1 1 -8  25 14 o 187.2022 64.63786 7.851811       5.709629      2.527981       7.871082      13.76432       8.294844  161.6480 69.50841 234.7989 77.93324 -73.15085      104.4271 
1 1 1 -8  25 15 o 518.6774 35.43981 55.49278       7.095922      66.14695       8.858703      36.41833       11.85322  561.0823 40.93766 372.4896 83.94946 188.5927       93.39917 
1 1 1 -8  25 16 o 159.1310 68.67784 3.076694       7.740577      3.076694       7.740577      0.000000       0.000000  159.1310 68.67784 ?        ?        0.000000       68.67784 
1 1 1 -8  25 17 o 274.9230 62.56080 18.52200       6.529186      14.37480       8.079151      26.33020       11.08571  228.1927 76.92858 294.7316 89.20851 -66.53888      117.7971 
1 1 1 -8  25 18 o 157.9598 61.97418 5.376090       5.545877      3.400753       7.550200      7.690672       8.172863  154.7233 67.29954 179.5359 73.54227 -24.81262      99.68798 
1 1 1 -8  25 19 o 216.7271 68.62708 12.86015       6.475568      6.053075       10.19885      17.45784       8.381866  172.9451 76.60979 241.2928 78.25581 -68.34775      109.5127 
1 1 1 -8  26 1  f 379.4042 38.72046 29.09109       5.625238      19.00242       7.032810      47.00863       9.372410  296.0881 63.09192 476.7756 51.43299 -180.6876      81.39989 
1 1 1 -8  26 2  o 440.1252 59.04445 40.94783       9.837675      0.000000       0.000000      40.94783       9.837675  ?        ?        440.1252 59.04445 0.000000       59.04445 
1 1 1 -8  26 3  o 197.9306 64.99235 8.205046       5.774532      9.391616       7.393709      6.349358       9.246303  212.3637 73.54225 200.0617 79.53314 12.30202       108.3235 
1 1 1 -8  26 4  o 418.7416 33.57560 35.13032       5.414147      41.17236       6.375822      19.50953       10.25170  452.2474 36.61640 288.8327 85.41949 163.4146       92.93681 
1 1 1 -8  26 5  o 502.5634 29.31243 50.21012       5.696156      49.89205       6.829456      50.93713       10.32514  498.2772 35.52559 492.3304 54.93906 5.946808       65.42451 
1 1 1 -8  26 6  o 834.3012 22.94912 136.9557       7.435615      136.5665       9.120540      137.7272       12.84007  830.2914 28.28538 825.6441 40.04485 4.647339       49.02706 
1 1 1 -8  26 7  o 468.9662 31.87699 44.05528       5.771132      45.41913       6.866107      40.77258       10.65230  473.3763 37.66015 430.6727 65.77582 42.70361       75.79409 
1 1 1 -8  26 8  o 297.3262 49.89632 18.77608       5.557317      19.35619       6.489975      17.18156       10.75975  297.6365 58.23281 265.9952 88.78251 31.64136       106.1762 
1 1 1 -8  26 9  o 134.2292 57.84988 0.5620816      5.476714      -5.769599      6.415858      17.56607       10.51407  115.7470 54.62646 266.7214 87.70358 -150.9745      103.3246 
1 1 1 -8  26 10 o 184.1859 64.79343 7.178470       5.750014      5.534597       6.704573      11.75013       11.18083  175.4471 68.33465 228.4967 88.45442 -53.04965      111.7757 
1 1 1 -8  26 11 o 334.3451 47.65659 23.85944       6.012814      27.30815       7.011158      14.27012       11.69111  354.8239 52.46198 239.9500 91.05793 114.8739       105.0895 
1 1 1 -8  26 12 o 425.7423 38.42780 37.54995       6.285122      39.36961       7.302227      32.34858       12.34578  431.7773 44.16976 347.9010 90.51278 83.87625       100.7151 
1 1 1 -8  26 13 o 203.0733 67.10020 9.797100       6.151619      13.19948       7.155032      0.1540711      12.04556  230.6569 72.01117 174.5393 79.72612 56.11763       107.4331 
1 1 1 -8  26 14 o 631.0116 37.91439 83.13556       9.248041      83.13556       9.248041      0.000000       0.000000  631.0116 37.91439 ?        ?        0.000000       37.91439 
1 1 1 -8  26 15 o 138.0341 60.91117 0.8877971      6.387132      2.905532       7.920204      -2.864997      10.80144  158.0304 68.83224 153.5338 71.96166 4.496597       99.58091 
1 1 1 -8  26 16 o 142.8810 59.97045 2.982258       5.621775      -4.704990      8.000479      10.47997       7.901231  127.5537 60.43873 198.9967 75.01556 -71.44296      96.33366 
1 1 1 -8  26 17 o 212.0457 64.12502 11.61668       5.729880      6.135840       8.055094      17.23063       8.152330  170.1813 71.62559 244.8209 76.93694 -74.63956      105.1167 
1 1 1 -8  27 1  o 553.2373 39.24291 62.03952       8.376711      0.000000       0.000000      62.03952       8.376711  ?        ?        553.2373 39.24291 0.000000       39.24291 
1 1 1 -8  27 2  o 340.4386 60.83606 25.21191       7.748008      24.39853       13.58000      25.60447       9.434225  310.2606 99.50285 334.6156 74.51228 -24.35498      124.3097 
1 1 1 -8  27 3  o 151.2823 61.68367 2.710285       5.716456      2.762142       7.217558      2.623005       9.363656  163.8462 68.29845 178.5386 76.26468 -14.69235      102.3767 
1 1 1 -8  27 4  f 576.6210 51.13711 69.71909       11.33248      0.000000       0.000000      69.71909       11.33248  ?        ?        576.6210 51.13711 0.000000       51.13711 
1 1 1 -8  27 5  o 95.09080 46.78633 -11.48444      6.065064      -19.14727      7.686568      1.156751       9.872605  97.34213 48.68448 174.2001 76.33464 -76.85793      90.53815 
1 1 1 -8  27 6  o 265.3371 62.29211 15.81779       6.309016      17.89338       8.056979      12.52778       10.14378  275.9291 73.76597 233.5576 85.55888 42.37146       112.9679 
1 1 1 -8  27 7  o 295.5183 58.11797 19.31420       6.432271      19.19339       8.191379      19.50850       10.38837  284.7389 73.55608 278.4222 86.74444 6.316681       113.7326 
1 1 1 -8  27 8  f 293.9280 51.73520 18.74943       5.689812      25.47441       6.819892      3.349100       10.32042  342.7915 52.93444 182.9120 79.12034 159.8795       95.19498 
1 1 1 -8  27 9  o 516.5750 31.64822 53.97572       6.318467      65.26110       7.539434      27.34776       11.58110  566.1235 34.45648 322.2094 89.40444 243.9141       95.81442 
1 1 1 -8  27 10 o 287.2686 54.39538 18.38576       5.846259      18.01132       6.916868      19.32233       10.93940  276.5486 65.42601 266.8836 89.51845 9.664948       110.8788 
1 1 1 -8  27 11 o 172.8696 65.04166 6.256804       5.934176      6.204349       6.934613      6.400281       11.46883  176.2683 69.25479 194.4239 83.75383 -18.15559      108.6781 
1 1 1 -8  27 12 o 423.2946 39.42267 37.71295       6.406095      35.58476       7.506122      43.41980       12.29162  402.9188 48.97727 410.0291 80.06351 -7.110352      93.85595 
1 1 1 -8  27 13 o 185.5108 66.97224 8.185471       6.182626      -3.914222      7.131023      44.81515       12.40741  124.6534 58.43970 411.8044 80.46744 -287.1510      99.44952 
1 1 1 -8  27 14 o 105.2324 51.60951 -10.61259      7.192430      -10.61259      7.192430      0.000000       0.000000  105.2324 51.60951 ?        ?        0.000000       51.60951 
1 1 1 -8  27 15 o 270.1761 68.17193 18.91432       7.152773      16.29396       8.532314      25.10998       13.11990  237.6364 79.04887 266.4364 97.34932 -28.79996      125.4018 
1 1 1 -8  28 1  o 181.7659 66.91467 6.603018       6.215466      24.61641       12.66533      0.8885976      7.133535  306.5504 95.82497 151.2747 65.60719 155.2756       116.1324 
1 1 1 -8  28 2  o 389.9621 36.05048 31.00427       5.397820      20.42295       7.239394      44.25183       8.100286  300.6345 63.97117 459.9940 45.95921 -159.3596      78.76903 
1 1 1 -8  28 3  o 139.3579 56.58255 2.437097       4.784821      2.462318       5.643098      2.372582       9.025487  147.1049 60.77714 171.7756 74.14706 -24.67064      95.87308 
1 1 1 -8  28 4  o 367.9261 37.79296 27.84199       5.323341      21.58284       6.215211      45.07777       10.31368  315.4118 52.59187 451.4384 60.33831 -136.0266      80.04134 
1 1 1 -8  28 5  o 239.3119 63.38154 13.20938       5.983968      7.281116       7.604482      22.84951       9.697225  189.9707 73.11422 302.6636 80.93296 -112.6929      109.0680 
1 1 1 -8  28 6  o 211.0924 66.96861 10.37570       6.164136      15.48520       7.792888      1.835374       10.07504  251.6376 74.48857 173.3735 76.50358 78.26410       106.7771 
1 1 1 -8  28 7  o 185.7532 67.53998 7.528710       6.304151      9.804469       8.040525      3.897551       10.15650  206.0079 76.06171 181.1618 78.42626 24.84610       109.2523 
1 1 1 -8  28 8  o 335.0168 53.24895 24.86033       6.696136      27.72516       8.671192      20.62809       10.53936  341.8235 67.71494 275.1384 87.59717 66.68509       110.7185 
1 1 1 -8  28 9  o 291.1056 61.87216 19.85295       6.779223      18.84289       8.730791      21.38655       10.75810  268.7102 78.64818 276.2366 88.56031 -7.526398      118.4418 
1 1 1 -8  28 10 o 174.1257 68.00862 6.327285       6.654945      6.286346       8.681747      6.385612       10.36287  181.1733 75.16186 187.4991 80.16502 -6.325867      109.8897 
1 1 1 -8  28 11 o 372.2442 54.47445 31.51366       7.641917      26.96502       9.753173      38.74666       12.29885  317.8419 79.27947 374.2507 86.37379 -56.40887      117.2419 
1 1 1 -8  28 12 o 181.5123 70.65974 7.649608       7.165673      3.916354       9.247813      13.25867       11.33550  168.4988 73.85694 216.2204 87.33469 -47.72165      114.3774 
1 1 1 -8  29 1  o 86.11349 42.20108 -8.399674      4.780620      -15.51621      6.587749      -0.4828844     6.948282  91.29836 45.57164 140.7424 62.73832 -49.44401      77.54270 
1 1 1 -8  29 2  o 431.5555 33.15428 37.94231       5.514059      37.58104       7.599046      38.34407       8.013570  419.4906 47.48149 421.8466 49.88070 -2.356018      68.86636 
1 1 1 -8  29 3  o 441.5981 30.65211 39.49686       5.224174      34.83634       6.144856      51.64854       9.922311  409.3321 39.13201 486.0292 53.45128 -76.69714      66.24465 
1 1 1 -8  29 4  o 113.0738 51.27519 -1.622605      4.868570      -3.689469      5.720812      3.805906       9.271331  113.6230 52.96465 175.3273 75.41568 -61.70423      92.15627 
1 1 1 -8  29 5  o 198.3183 59.87887 9.107971       4.999073      6.407294       5.907484      15.92007       9.382246  174.3205 65.03049 245.7935 82.90053 -71.47299      105.3635 
1 1 1 -8  29 6  o 268.8907 53.03794 16.23858       5.341713      15.20920       6.388770      18.62995       9.737666  251.7374 64.92593 262.1868 84.27660 -10.44948      106.3857 
1 1 1 -8  29 7  o 122.9434 54.58357 -0.2746344     5.205805      -5.195099      6.149190      12.17355       9.780653  111.6811 52.93773 217.4516 83.10293 -105.7704      98.53172 
1 1 1 -8  29 8  o 133.9683 57.65593 1.374793       5.424508      -1.073440      6.358453      7.921120       10.39738  129.6197 58.70448 193.9972 81.49799 -64.37750      100.4397 
1 1 1 -8  29 9  o 110.8358 51.86142 -3.512056      5.569699      -12.02958      6.532080      19.17512       10.66069  96.16264 47.54735 255.0450 88.30852 -158.8824      100.2953 
1 1 1 -7  0  1  o 841.9317 17.64732 137.9267       5.764381      137.9267       5.764381      137.9267       5.764381  841.9317 17.64732 841.9317 17.64732 0.000000       0.000000 
1 1 1 -7  0  2  o 806.1758 18.03223 126.4878       5.639184      126.4878       5.639184      126.4878       5.639184  806.1758 18.03223 806.1758 18.03223 0.000000       0.000000 
1 1 1 -7  0  3  o 976.8638 18.22655 185.6400       6.909161      185.6400       6.909161      185.6400       6.909161  976.8638 18.22655 976.8638 18.22655 0.000000       0.000000 
1 1 1 -7  0  4  o 452.2413 22.66070 40.06265       3.957098      40.06265       3.957098      40.06265       3.957098  452.2413 22.66070 452.2413 22.66070 0.000000       0.000000 
1 1 1 -7  0  5  o 834.9346 18.97791 135.7013       6.146417      135.7013       6.146417      135.7013       6.146417  834.9346 18.97791 834.9346 18.97791 0.000000       0.000000 
1 1 1 -7  0  6  o 578.8058 21.45126 65.40237       4.806820      65.40237       4.806820      65.40237       4.806820  578.8058 21.45126 578.8058 21.45126 0.000000       0.000000 
1 1 1 -7  0  7  o 286.5630 37.87630 16.82331       4.010080      16.82331       4.010080      16.82331       4.010080  286.5630 37.87630 286.5630 37.87630 0.000000       0.000000 
1 1 1 -7  0  8  o 328.6513 48.94972 22.46582       5.839591      22.46582       5.839591      22.46582       5.839591  328.6513 48.94972 328.6513 48.94972 0.000000       0.000000 
1 1 1 -7  0  9  o 385.6002 44.83966 30.21888       6.477780      30.21888       6.477780      30.21888       6.477780  385.6002 44.83966 385.6002 44.83966 0.000000       0.000000 
1 1 1 -7  0  10 o 445.4414 29.01271 39.14786       4.970042      39.14786       4.970042      39.14786       4.970042  445.4414 29.01271 445.4414 29.01271 0.000000       0.000000 
1 1 1 -7  0  11 o 538.0173 25.78042 56.77332       5.358402      56.77332       5.358402      56.77332       5.358402  538.0173 25.78042 538.0173 25.78042 0.000000       0.000000 
1 1 1 -7  0  12 o 777.6523 22.55783 118.0580       6.799597      118.0580       6.799597      118.0580       6.799597  777.6523 22.55783 777.6523 22.55783 0.000000       0.000000 
1 1 1 -7  0  13 o 625.2371 36.37860 77.30119       8.764778      77.30119       8.764778      77.30119       8.764778  625.2371 36.37860 625.2371 36.37860 0.000000       0.000000 
1 1 1 -7  0  14 o 134.1877 77.97208 4.585527       6.674060      4.585527       6.674060      4.585527       6.674060  134.1877 77.97208 134.1877 77.97208 0.000000       0.000000 
1 1 1 -7  0  15 f 616.3984 26.99458 74.55697       6.433784      74.55697       6.433784      74.55697       6.433784  616.3984 26.99458 616.3984 26.99458 0.000000       0.000000 
1 1 1 -7  0  16 f 123.1907 70.72564 3.934858       5.389407      3.934858       5.389407      3.934858       5.389407  123.1907 70.72564 123.1907 70.72564 0.000000       0.000000 
1 1 1 -7  0  17 o 830.6774 24.69741 134.8008       7.951373      134.8008       7.951373      134.8008       7.951373  830.6774 24.69741 830.6774 24.69741 0.000000       0.000000 
1 1 1 -7  0  18 o 377.5665 45.28297 29.11363       6.387092      29.11363       6.387092      29.11363       6.387092  377.5665 45.28297 377.5665 45.28297 0.000000       0.000000 
1 1 1 -7  0  19 o 109.8380 68.85063 1.410457       6.086497      1.410457       6.086497      1.410457       6.086497  109.8380 68.85063 109.8380 68.85063 0.000000       0.000000 
1 1 1 -7  0  20 o 704.8707 30.14417 97.34879       8.217322      97.34879       8.217322      97.34879       8.217322  704.8707 30.14417 704.8707 30.14417 0.000000       0.000000 
1 1 1 -7  0  21 o 461.4639 43.12668 42.69847       7.573652      42.69847       7.573652      42.69847       7.573652  461.4639 43.12668 461.4639 43.12668 0.000000       0.000000 
1 1 1 -7  0  22 o 91.37675 62.52325 -4.362727      7.020329      -4.362727      7.020329      -4.362727      7.020329  91.37675 62.52325 91.37675 62.52325 0.000000       0.000000 
1 1 1 -7  0  23 o 164.2898 87.22356 7.847229       7.501566      7.847229       7.501566      7.847229       7.501566  164.2898 87.22356 164.2898 87.22356 0.000000       0.000000 
1 1 1 -7  0  24 o 77.77504 55.58409 -11.35259      7.627180      -11.35259      7.627180      -11.35259      7.627180  77.77504 55.58409 77.77504 55.58409 0.000000       0.000000 
1 1 1 -7  0  25 o 450.7667 54.34933 41.77311       9.147614      41.77311       9.147614      41.77311       9.147614  450.7667 54.34933 450.7667 54.34933 0.000000       0.000000 
1 1 1 -7  0  26 o 120.5387 78.66310 -0.4136949     9.001272      -0.4136949     9.001272      -0.4136949     9.001272  120.5387 78.66310 120.5387 78.66310 0.000000       0.000000 
1 1 1 -7  0  27 o 722.4147 55.95486 105.4585       15.48169      105.4585       15.48169      105.4585       15.48169  722.4147 55.95486 722.4147 55.95486 0.000000       0.000000 
1 1 1 -7  0  28 o 680.8441 60.50341 95.10746       15.70706      95.10746       15.70706      95.10746       15.70706  680.8441 60.50341 680.8441 60.50341 0.000000       0.000000 
1 1 1 -7  0  29 o 125.4697 82.60495 -0.4531651     10.25360      -0.4531651     10.25360      -0.4531651     10.25360  125.4697 82.60495 125.4697 82.60495 0.000000       0.000000 
1 1 1 -7  0  30 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -7  0  31 o 202.7659 117.8229 15.26347       15.23996      15.26347       15.23996      15.26347       15.23996  202.7659 117.8229 202.7659 117.8229 0.000000       0.000000 
1 1 1 -7  0  32 o 164.5572 98.49169 9.288289       11.21654      9.288289       11.21654      9.288289       11.21654  164.5572 98.49169 164.5572 98.49169 0.000000       0.000000 
1 1 1 -7  0  33 o 111.4168 76.50485 -3.102331      10.71918      -3.102331      10.71918      -3.102331      10.71918  111.4168 76.50485 111.4168 76.50485 0.000000       0.000000 
1 1 1 -7  1  1  o 1245.323 13.26809 301.4178       6.416798      305.3782       9.164609      297.6089       8.987430  1252.882 18.83544 1236.857 18.71061 16.02478       26.54921 
1 1 1 -7  1  2  o 1256.885 13.42315 307.0544       6.552062      301.1702       9.098312      313.3934       9.443346  1244.193 18.82977 1269.147 19.15958 -24.95398      26.86354 
1 1 1 -7  1  3  o 541.0668 14.17414 56.91030       2.978348      55.47837       4.180682      58.38597       4.244075  533.9078 20.16289 547.7332 19.95198 -13.82538      28.36589 
1 1 1 -7  1  4  o 839.1995 13.27653 136.8924       4.326910      143.4407       6.296974      131.0348       5.955632  858.5807 18.88525 820.6308 18.68754 37.94995       26.56834 
1 1 1 -7  1  5  o 607.6628 14.41003 71.79400       3.400600      72.58345       4.850688      71.03101       4.768710  610.5919 20.45617 604.0366 20.32870 6.555298       28.83940 
1 1 1 -7  1  6  o 479.8029 16.83615 44.78674       3.137139      44.29499       4.379305      45.30509       4.496173  476.7209 23.65446 482.0981 24.01483 -5.377258      33.70824 
1 1 1 -7  1  7  f 343.6091 21.69452 23.09546       2.880097      16.69724       4.114907      29.23993       4.032487  289.4196 37.49142 386.0861 27.06546 -96.66641      46.24009 
1 1 1 -7  1  8  o 457.7367 21.25113 40.83442       3.777685      28.42398       6.070848      48.67652       4.825829  377.6406 42.11166 499.4212 24.88152 -121.7805      48.91301 
1 1 1 -7  1  9  o 523.4209 24.81394 53.49963       5.043997      55.01704       7.340226      52.14205       6.942921  527.9702 36.01406 514.1638 34.97858 13.80634       50.20472 
1 1 1 -7  1  10 o 179.7872 43.41333 6.653831       2.996888      3.568104       4.268155      9.654540       4.208945  149.3781 55.36453 215.8068 51.02394 -66.42877      75.29059 
1 1 1 -7  1  11 o 389.8075 23.01718 29.80778       3.468963      26.73065       4.961080      32.75160       4.852434  366.4900 35.29303 407.0637 30.92636 -40.57373      46.92588 
1 1 1 -7  1  12 o 249.7103 36.25061 12.58639       3.412714      9.629724       4.975789      15.21265       4.689533  213.7243 58.32285 272.2233 45.99738 -58.49895      74.27863 
1 1 1 -7  1  13 o 789.7828 22.55112 122.1689       6.916776      115.3037       9.691158      129.2970       9.875030  763.6725 32.67688 809.2303 31.42232 -45.55780      45.33366 
1 1 1 -7  1  14 o 269.1239 48.93120 15.07556       4.925676      21.52075       7.114306      9.141272       6.826519  318.3715 59.73421 210.6652 70.71535 107.7063       92.56802 
1 1 1 -7  1  15 o 292.3334 34.49587 17.17464       3.840838      25.82891       5.301984      7.617926       5.571568  357.8876 38.76701 193.2826 63.85804 164.6050       74.70428 
1 1 1 -7  1  16 o 181.9914 52.38477 6.909793       3.902377      11.29601       5.482758      2.406330       5.555552  229.7847 60.57882 150.4251 61.00675 79.35963       85.97451 
1 1 1 -7  1  17 o 413.1704 27.49476 33.68619       4.386522      22.76947       5.909646      47.08055       6.546005  333.7849 46.88240 486.5758 34.87286 -152.7909      58.43009 
1 1 1 -7  1  18 o 205.6862 52.77294 8.849751       4.236237      10.80685       6.062709      6.982648       5.921667  226.3067 65.33866 190.6928 65.82804 35.61385       92.74951 
1 1 1 -7  1  19 o 88.86205 42.77493 -6.385958      4.357242      -12.59656      6.075618      0.1911568      6.252322  94.47702 46.55045 145.0170 62.14186 -50.53993      77.64377 
1 1 1 -7  1  20 o 433.1635 29.79437 36.97206       4.981554      34.22244       7.038641      39.73162       7.051339  412.9035 44.60330 446.2570 41.15084 -33.35355      60.68645 
1 1 1 -7  1  21 o 405.7862 33.18919 32.56364       5.184469      33.70376       7.230041      31.35690       7.438288  409.4638 46.27939 393.7343 49.75612 15.72955       67.95185 
1 1 1 -7  1  22 f 1042.773 19.07501 212.0169       7.724716      218.5195       10.98990      205.6671       10.86005  1056.531 26.78450 1024.833 27.28671 31.69812       38.23577 
1 1 1 -7  1  23 o 424.0412 34.83517 35.69646       5.685887      34.95683       7.941538      36.47437       8.144417  414.7407 50.33762 423.7041 50.49022 -8.963379      71.29613 
1 1 1 -7  1  24 o 99.62987 48.11147 -8.403025      5.617832      -7.149041      8.096010      -9.567520      7.801785  132.8850 62.28913 122.2713 58.42606 10.61370       85.40222 
1 1 1 -7  1  25 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -7  1  26 o 474.1693 37.16395 45.07681       6.788790      52.48740       9.550336      37.50748       9.652071  506.1215 49.21104 421.3267 60.74453 84.79483       78.17688 
1 1 1 -7  1  27 o 264.2390 84.05293 16.01551       9.705395      13.74718       13.30505      18.59506       14.18851  254.4887 97.00482 281.2987 101.4707 -26.81000      140.3790 
1 1 1 -7  1  28 o 206.3092 75.20035 8.905911       7.822253      6.287409       13.21705      10.31751       9.704275  213.9352 90.97675 220.9428 83.16603 -7.007584      123.2613 
1 1 1 -7  1  29 o 444.2437 63.80501 44.48703       10.69193      44.48703       10.69193      0.000000       0.000000  444.2437 63.80501 ?        ?        0.000000       63.80501 
1 1 1 -7  1  30 o 430.1856 45.01595 39.58426       7.409182      38.62631       10.63629      40.48727       10.32689  399.4236 71.17883 414.2470 66.43769 -14.82346      97.36731 
1 1 1 -7  1  31 o 163.8367 74.05585 1.888575       10.06163      -6.029341      13.97549      10.40899       14.49746  160.7942 77.19561 205.7009 91.21844 -44.90666      119.4988 
1 1 1 -7  1  32 o 232.6468 80.57138 16.94862       8.874695      19.57662       10.98005      11.99704       15.07172  236.6970 88.58746 196.9904 89.66992 39.70668       126.0493 
1 1 1 -7  1  33 o 176.5903 71.46487 9.355130       7.605960      -0.6335291     10.81716      19.12266       10.69675  144.7838 69.07589 220.0586 86.14618 -75.27480      110.4203 
1 1 1 -7  2  1  o 290.1995 19.06468 16.45521       2.136639      14.02017       2.965143      19.08519       3.081545  266.5316 29.12013 311.9081 25.66763 -45.37656      38.81765 
1 1 1 -7  2  2  o 781.5835 12.66480 118.7229       3.844162      120.9655       5.459733      116.5182       5.413492  788.5871 17.82764 773.9411 18.01116 14.64600       25.34219 
1 1 1 -7  2  3  o 463.5521 20.84145 41.82886       3.751928      0.000000       0.000000      41.82886       3.751928  ?        ?        463.5521 20.84145 0.000000       20.84145 
1 1 1 -7  2  4  o 987.0995 13.25288 189.3994       5.080413      190.7496       7.226018      188.0796       7.144258  990.0836 18.79313 983.1389 18.71174 6.944702       26.52002 
1 1 1 -7  2  5  o 470.0298 16.30670 42.97197       2.976593      39.83659       4.166132      46.24152       4.254331  451.4990 23.84466 487.2112 22.48464 -35.71228      32.77387 
1 1 1 -7  2  6  o 361.5583 19.70817 25.52638       2.756834      27.94082       3.960030      23.25580       3.840234  377.4123 27.20041 343.8767 29.02719 33.53558       39.77990 
1 1 1 -7  2  7  o 217.6842 33.57563 9.490157       2.747151      14.89299       3.900782      4.173566       3.869523  272.9814 37.81040 152.8296 53.18704 120.1517       65.25709 
1 1 1 -7  2  8  o 68.46721 33.53136 -5.845304      3.003585      -5.879236      5.285773      -5.829123      3.650163  104.7681 49.48709 79.91389 38.63639 24.85417       62.78330 
1 1 1 -7  2  9  o 201.5412 50.56544 8.387156       3.951143      0.7997155      5.575771      16.04021       5.599826  141.9893 59.66702 279.2853 53.57850 -137.2960      80.19232 
1 1 1 -7  2  10 o 607.7770 17.13894 71.96049       4.045350      71.33850       5.642010      72.61856       5.803379  604.1989 24.04506 609.5189 24.51691 -5.319946      34.34013 
1 1 1 -7  2  11 f 235.7621 36.33940 11.22182       3.220298      5.663903       4.535705      16.87127       4.572902  171.4318 57.64119 288.6342 42.02986 -117.2024      71.33734 
1 1 1 -7  2  12 o 491.2211 19.85072 47.13691       3.786877      54.15919       5.566518      41.08713       5.166709  524.4247 27.42736 456.1008 29.32469 68.32394       40.15218 
1 1 1 -7  2  13 o 524.4830 27.88607 54.27613       5.659572      57.24368       8.044374      51.36764       7.963920  534.6852 39.00975 505.5906 40.91083 29.09454       56.52837 
1 1 1 -7  2  14 o 352.4797 38.25801 25.03565       5.152940      29.32310       7.377853      20.95228       7.200113  376.4700 51.83751 313.3469 61.36361 63.12314       80.32820 
1 1 1 -7  2  15 o 259.0050 39.93466 13.68732       3.887733      9.126015       5.403839      18.58130       5.597439  207.5713 62.16229 299.1216 49.94639 -91.55035      79.74203 
1 1 1 -7  2  16 o 295.0785 35.62793 17.50901       4.000145      12.83608       5.687786      22.08232       5.626826  244.9634 60.21368 328.7274 45.27711 -83.76398      75.33727 
1 1 1 -7  2  17 o 173.0401 53.87879 6.084358       4.008434      5.397748       5.612624      6.799151       5.726659  174.6928 63.69604 187.4970 64.73449 -12.80421      90.81706 
1 1 1 -7  2  18 o 333.0302 34.35009 22.10478       4.378839      21.21807       6.088090      23.05511       6.302713  321.5466 50.41111 335.6261 49.87147 -14.07950      70.91151 
1 1 1 -7  2  19 o 267.3006 45.02375 14.57945       4.507688      12.03958       6.405270      17.07161       6.344827  238.8026 66.57080 285.6171 59.14812 -46.81447      89.05151 
1 1 1 -7  2  20 o 355.9234 35.21260 25.17603       4.803393      26.03304       6.646788      24.23923       6.949355  358.2630 49.06193 344.0331 53.77367 14.22995       72.79204 
1 1 1 -7  2  21 o 932.9503 19.23395 169.6891       6.968751      179.0666       9.959824      160.6952       9.754004  956.5817 26.81030 905.9409 27.72395 50.64075       38.56694 
1 1 1 -7  2  22 o 384.1545 35.89459 29.31872       5.292987      27.37910       7.537106      31.20602       7.434772  365.6822 54.75760 392.4669 49.90827 -26.78473      74.08934 
1 1 1 -7  2  23 o 176.1490 62.95171 5.597672       5.448348      8.343618       7.504424      2.536978       7.922847  209.5159 73.98685 174.0101 71.96385 35.50577       103.2126 
1 1 1 -7  2  24 o 789.6356 22.75483 122.0507       6.977957      133.9944       10.05489      110.9542       9.691767  824.3906 31.40627 749.4696 33.29821 74.92096       45.77253 
1 1 1 -7  2  25 o 238.5659 79.90234 12.06162       8.715276      12.06162       8.715276      0.000000       0.000000  238.5659 79.90234 ?        ?        0.000000       79.90234 
1 1 1 -7  2  26 o 359.1055 48.67191 26.59808       6.612885      27.02166       9.257095      26.15667       9.449949  351.6502 70.24345 344.4237 72.92087 7.226501       101.2502 
1 1 1 -7  2  27 o 153.4220 67.36510 -0.3618047     7.723013      0.3360967      9.532586      -1.694900      13.17481  171.6151 75.11011 189.4877 85.27895 -17.87265      113.6399 
1 1 1 -7  2  28 o 113.3743 55.17031 -11.70615      7.763117      -9.220140      13.64685      -12.89549      9.439176  167.8267 79.34721 126.7030 61.46581 41.12363       100.3694 
1 1 1 -7  2  29 o 307.2499 62.72163 21.49404       7.230833      11.06493       10.39868      31.25786       10.06154  220.4532 85.31456 362.3846 73.99602 -141.9314      112.9335 
1 1 1 -7  2  30 o 182.8615 74.63924 6.462961       8.381146      -0.5281781     14.36531      10.07072       10.31953  182.2918 84.62395 207.6368 83.51799 -25.34496      118.8969 
1 1 1 -7  2  31 o 179.5903 78.07672 5.907659       10.15184      -5.184510      13.99275      18.23454       14.75099  162.2688 77.72818 233.4321 97.50063 -71.16335      124.6918 
1 1 1 -7  2  32 o 131.9709 62.23606 -2.807471      8.299164      -3.937279      10.08022      -0.4302717     14.62178  139.3669 66.54407 165.4536 79.30711 -26.08664      103.5265 
1 1 1 -7  2  33 o 190.2876 72.60780 11.47783       7.458933      9.813185       10.49377      13.17768       10.60414  176.5502 77.98250 190.4682 81.25481 -13.91795      112.6216 
1 1 1 -7  3  1  o 813.0853 12.57068 128.4851       3.969383      131.4011       5.626716      125.5962       5.600485  821.9107 17.62797 803.5253 17.94726 18.38538       25.15650 
1 1 1 -7  3  2  o 707.8020 13.11344 97.37510       3.604594      92.45500       4.974122      102.8163       5.230899  689.3479 18.58018 726.9534 18.52856 -37.60547      26.23987 
1 1 1 -7  3  3  o 242.9095 24.26776 11.61091       2.258658      8.900311       3.151518      14.47359       3.238717  209.6681 40.16672 270.4368 31.42329 -60.76869      50.99792 
1 1 1 -7  3  4  o 760.6544 13.21845 112.4720       3.904774      110.7318       5.466873      114.2844       5.579210  754.3405 18.66138 766.3383 18.74667 -11.99780      26.45155 
1 1 1 -7  3  5  o 759.2256 13.51238 112.0629       3.984104      114.3745       5.740315      109.9144       5.534091  766.5389 19.28295 751.4746 18.96287 15.06433       27.04483 
1 1 1 -7  3  6  o 850.5953 13.89526 140.6818       4.590051      142.5672       6.570634      138.8847       6.414794  855.6772 19.77286 844.5790 19.55755 11.09814       27.81121 
1 1 1 -7  3  7  o 1043.417 16.07640 211.8287       6.514400      217.8543       11.60134      209.0539       7.872746  1055.937 28.29062 1036.060 19.56650 19.87610       34.39778 
1 1 1 -7  3  8  o 97.41326 42.54045 -0.5863317     3.042896      -1.522838      5.213140      -0.1023773     3.747540  123.8535 54.82226 112.3018 48.11620 11.55173       72.94277 
1 1 1 -7  3  9  o 182.2530 53.10319 6.767925       3.988314      3.459232       5.638319      10.08134       5.642339  161.1598 62.69472 220.6049 62.82906 -59.44514      88.75877 
1 1 1 -7  3  10 o 321.1841 25.27114 20.30099       3.126689      22.75907       4.479341      17.96527       4.366434  338.3378 34.57653 299.2967 38.45572 39.04111       51.71440 
1 1 1 -7  3  11 o 809.9939 15.37718 127.8079       4.837114      131.1844       6.872656      124.4934       6.809211  819.3453 21.59880 798.0895 21.96935 21.25580       30.80845 
1 1 1 -7  3  12 o 288.9806 31.02096 16.64146       3.426915      17.86910       4.762946      15.32385       4.934377  296.3824 42.60525 272.2720 48.44144 24.11047       64.51186 
1 1 1 -7  3  13 o 433.8553 32.80394 37.43608       5.486286      35.40044       7.958604      39.27937       7.573288  415.2469 50.38356 440.0202 44.94950 -24.77338      67.52007 
1 1 1 -7  3  14 o 718.5594 24.78784 101.3848       6.917185      96.01448       10.12671      106.0821       9.470934  693.2625 37.75571 731.7426 33.32779 -38.48004      50.36105 
1 1 1 -7  3  15 o 303.7672 33.11959 18.47386       3.843778      22.49636       5.361947      14.22147       5.513046  332.5838 42.48462 258.8075 56.44124 73.77637       70.64388 
1 1 1 -7  3  16 o 981.2488 16.50763 187.8231       6.290598      176.7636       8.562880      200.7898       9.271854  949.7982 23.21456 1012.144 23.58829 -62.34564      33.09566 
1 1 1 -7  3  17 o 221.9166 49.69342 10.28325       4.176149      16.45585       5.852814      3.881220       5.960594  280.2172 55.74417 165.4113 64.43014 114.8059       85.19774 
1 1 1 -7  3  18 f 132.7518 52.52914 2.086345       4.016061      6.557292       5.545847      -2.843403      5.823452  185.2250 63.71834 124.0055 56.16948 61.21957       84.94138 
1 1 1 -7  3  19 o 511.3927 25.23153 51.17550       5.011019      50.86078       6.980599      51.51009       7.197690  506.6730 35.70458 509.6536 36.60946 -2.980591      51.13774 
1 1 1 -7  3  20 o 229.6418 54.68210 10.98579       4.806695      9.195804       6.501360      13.14389       7.138630  213.6503 68.88197 249.6495 70.52109 -35.99919      98.57966 
1 1 1 -7  3  21 f 404.8112 34.32267 32.44740       5.345050      36.69112       7.602154      28.29859       7.516655  427.3605 46.55846 372.6014 53.47920 54.75909       70.90639 
1 1 1 -7  3  22 o 332.4799 44.65227 22.32100       5.619771      32.47219       7.871302      11.76670       8.026069  399.7382 51.93078 239.0164 76.47903 160.7218       92.44376 
1 1 1 -7  3  23 o 852.2663 29.88109 142.7419       9.890078      142.7419       9.890078      0.000000       0.000000  852.2663 29.88109 ?        ?        0.000000       29.88109 
1 1 1 -7  3  24 o 812.0214 22.99608 129.1054       7.251856      125.3867       10.35406      132.6861       10.16004  796.5605 33.47063 820.0714 31.90184 -23.51093      46.23862 
1 1 1 -7  3  25 f 498.8514 33.70797 49.50459       6.491963      46.95871       9.281424      51.94320       9.083810  478.6765 50.69978 505.5820 46.79528 -26.90552      68.99467 
1 1 1 -7  3  26 o 348.4495 59.50052 25.77236       7.762649      24.07675       9.255724      29.79346       14.25346  329.3126 74.15696 351.8088 99.74310 -22.49622      124.2897 
1 1 1 -7  3  27 o 377.5678 55.14582 30.12194       7.847563      32.88953       9.495337      24.15774       13.93912  388.9311 65.17072 312.1772 100.8828 76.75391       120.1023 
1 1 1 -7  3  28 o 113.1923 55.17238 -12.11842      7.854879      -22.99772      14.24441      -7.364709      9.415866  144.9404 71.38798 140.5687 66.29083 4.371674       97.42032 
1 1 1 -7  3  29 o 384.5344 50.02038 31.78428       7.292969      24.75508       10.21426      39.09436       10.41634  312.8421 82.78490 411.9573 67.44254 -99.11514      106.7794 
1 1 1 -7  3  30 o 258.5495 78.21003 17.49570       8.522582      5.559316       13.94778      24.60767       10.76622  197.6958 88.45147 297.8624 87.38045 -100.1666      124.3343 
1 1 1 -7  3  31 o 98.04545 48.66829 -13.45761      7.098249      -18.01033      9.689277      -8.183914      10.42829  111.9244 55.77114 136.1290 65.69052 -24.20465      86.17229 
1 1 1 -7  3  32 o 121.9896 58.70658 -5.904527      8.195189      -3.887439      9.970677      -10.10472      14.38788  138.3927 66.10735 146.4539 72.05846 -8.061249      97.78857 
1 1 1 -7  3  33 o 140.9205 63.33071 2.762878       7.235548      11.81555       10.41463      -5.683468      10.05981  184.1186 79.56163 129.1431 62.83434 54.97556       101.3815 
1 1 1 -7  4  1  o 839.9561 12.78128 137.1279       4.169259      139.4751       5.914283      134.8091       5.878326  846.7185 17.98602 832.4177 18.18379 14.30084       25.57630 
1 1 1 -7  4  2  o 808.1883 12.93633 126.9574       4.060238      122.4221       5.599654      131.9852       5.895881  793.2352 18.17738 823.6116 18.43310 -30.37640      25.88815 
1 1 1 -7  4  3  o 468.6512 15.39087 42.71048       2.801178      38.76767       3.903462      46.89667       4.022132  445.5471 22.63379 490.7650 21.10351 -45.21786      30.94586 
1 1 1 -7  4  4  o 1136.239 13.46564 250.9858       5.941891      242.0258       8.112449      261.3558       8.727417  1115.159 18.73214 1158.741 19.39418 -43.58240      26.96344 
1 1 1 -7  4  5  o 305.2154 21.76322 18.23924       2.562730      19.45178       3.647285      17.05686       3.601640  314.0851 30.27659 293.6259 32.10806 20.45920       44.13161 
1 1 1 -7  4  6  o 646.8561 14.68140 81.37866       3.688104      83.31767       5.308837      79.56992       5.127427  653.9785 20.90297 639.1251 20.65787 14.85345       29.38846 
1 1 1 -7  4  7  o 388.5700 23.03093 29.54762       3.459932      41.55532       6.268041      24.28552       4.149362  458.9250 35.44384 350.9796 30.75203 107.9453       46.92498 
1 1 1 -7  4  8  o 1034.858 20.15698 208.7263       8.100920      224.4893       12.08094      195.8480       10.91973  1071.083 29.04355 1000.672 28.09910 70.41113       40.41147 
1 1 1 -7  4  9  o 527.3385 20.87966 54.24604       4.276031      53.31045       5.212206      56.17192       7.478100  522.1560 25.70357 532.9642 36.34666 -10.80817      44.51688 
1 1 1 -7  4  10 o 545.8134 18.00533 58.08044       3.816570      57.82825       5.398673      58.33239       5.396219  543.5199 25.57664 545.9051 25.45332 -2.385193      36.08374 
1 1 1 -7  4  11 o 558.4149 18.10199 60.83426       3.925649      55.35756       5.395227      66.99584       5.722641  531.3380 26.14634 584.7310 25.20068 -53.39301      36.31398 
1 1 1 -7  4  12 o 368.3562 24.85200 26.72977       3.534358      25.21544       5.064096      28.16792       4.935074  354.5208 37.34339 375.8428 34.18485 -21.32202      50.62739 
1 1 1 -7  4  13 o 1010.674 22.00624 200.0458       8.637440      207.0086       12.54991      193.7792       11.90589  1023.517 31.57314 990.6085 30.94794 32.90814       44.21129 
1 1 1 -7  4  14 o 299.2480 37.36828 18.08146       4.248068      16.21208       5.113766      22.24396       7.630779  279.3704 48.91613 322.3652 63.21173 -42.99487      79.92816 
1 1 1 -7  4  15 o 808.0446 17.29913 127.4524       5.428598      130.0571       7.735023      124.9241       7.620647  814.1317 24.46465 797.8601 24.59445 16.27155       34.69015 
1 1 1 -7  4  16 o 296.6483 36.57989 17.70228       4.124903      14.67548       5.665353      21.11710       6.017551  263.4885 57.02049 319.9875 50.06490 -56.49902      75.88036 
1 1 1 -7  4  17 o 643.7775 20.01404 80.94495       5.003785      70.16449       6.772398      93.90470       7.425443  597.4314 29.18949 691.5864 27.64700 -94.15497      40.20426 
1 1 1 -7  4  18 o 341.4958 35.06197 23.23593       4.583973      29.18764       6.263956      16.37356       6.726126  380.8743 43.10755 278.0387 63.66357 102.8356       76.88506 
1 1 1 -7  4  19 o 350.8638 34.95329 24.47803       4.699320      15.86799       6.381982      34.67537       6.945393  274.8156 61.35106 415.7974 43.66376 -140.9818      75.30257 
1 1 1 -7  4  20 o 874.4049 27.31893 149.6724       9.276929      149.6724       9.276929      0.000000       0.000000  874.4049 27.31893 ?        ?        0.000000       27.31893 
1 1 1 -7  4  21 o 662.0713 23.46802 85.62242       6.034054      93.34473       8.576613      78.05368       8.490913  689.5238 32.02865 628.9504 34.89943 60.57336       47.36881 
1 1 1 -7  4  22 o 150.5568 59.22535 2.842362       5.077336      6.136214       6.908776      -1.025803      7.486891  190.3913 70.46393 151.9475 66.53187 38.44376       96.91055 
1 1 1 -7  4  23 f 502.3573 31.65460 49.87125       6.143995      48.92833       8.480567      50.91287       8.913425  493.3187 44.75298 502.7535 46.16798 -9.434845      64.29861 
1 1 1 -7  4  24 o 171.0646 64.23321 4.838032       5.781917      1.822089       7.830576      8.453459       8.573573  168.0600 70.67062 213.5249 78.59216 -45.46489      105.6933 
1 1 1 -7  4  25 o 278.3216 62.09416 16.62555       6.541079      20.68263       9.171577      12.42578       9.331460  304.8415 77.34676 242.2176 82.67104 62.62383       113.2123 
1 1 1 -7  4  26 o 693.6475 33.24012 95.50319       8.954255      95.65482       10.67940      95.14425       16.43097  689.7869 40.03836 670.7529 63.84768 19.03394       75.36310 
1 1 1 -7  4  27 o 502.5211 53.16378 52.82450       10.21770      52.82450       10.21770      0.000000       0.000000  502.5211 53.16378 ?        ?        0.000000       53.16378 
1 1 1 -7  4  28 o 251.3794 75.41712 14.86514       7.948780      -9.893872      13.28897      28.65845       9.918798  162.9534 77.40942 350.4790 75.13056 -187.5256      107.8741 
1 1 1 -7  4  29 o 149.9918 65.27187 1.142048       7.108660      -4.145535      10.13559      6.261060       9.972716  152.5544 70.90695 192.4364 80.25510 -39.88206      107.0919 
1 1 1 -7  4  30 o 130.5077 61.60648 -5.254809      8.168473      -23.67765      13.77369      4.739820       10.14508  133.8284 66.65485 180.1879 78.19317 -46.35947      102.7475 
1 1 1 -7  4  31 o 146.5361 64.52873 1.903594       7.131787      -2.968785      9.603268      7.895339       10.64940  143.8857 67.57150 187.5991 80.76043 -43.71344      105.3003 
1 1 1 -7  4  32 o 281.6270 75.33829 23.08250       8.400849      29.75737       10.04893      7.590104       15.30938  311.5211 81.95782 182.3176 85.52268 129.2034       118.4534 
1 1 1 -7  4  33 o 114.9120 55.16762 -4.211939      7.137269      -5.560376      9.946481      -2.780650      10.24750  128.3582 62.45871 136.0316 65.51028 -7.673492      90.51347 
1 1 1 -7  5  1  o 568.8087 13.81091 62.89904       3.050818      60.69840       4.248870      65.24111       4.383286  558.4358 19.59171 578.9625 19.49492 -20.52667      27.63850 
1 1 1 -7  5  2  o 235.1236 23.98982 10.88484       2.159854      8.355136       2.928078      13.90402       3.198840  203.2035 38.51386 264.8888 31.72707 -61.68527      49.89915 
1 1 1 -7  5  3  o 352.4397 18.80561 24.24404       2.564649      18.16566       3.454727      31.70619       3.827824  303.5586 29.68501 402.5394 24.60400 -98.98077      38.55589 
1 1 1 -7  5  4  o 919.0909 13.28865 164.2269       4.743156      162.5726       6.735627      165.8541       6.680385  913.8717 18.97863 923.0897 18.63501 -9.218018      26.59797 
1 1 1 -7  5  5  o 259.4585 29.96836 13.33002       2.964114      9.888020       4.970056      15.23015       3.692720  219.0404 57.64363 276.6415 35.16644 -57.60112      67.52383 
1 1 1 -7  5  6  o 346.4459 23.86652 23.52180       3.191501      13.43647       5.312044      29.21863       3.992392  255.2750 55.19063 385.8876 26.80697 -130.6126      61.35649 
1 1 1 -7  5  7  o 222.7281 34.95674 9.963328       2.924115      19.03773       5.239009      5.857324       3.524113  307.2574 45.26136 170.2645 50.00542 136.9928       67.44727 
1 1 1 -7  5  8  o 602.0552 22.38139 70.73409       5.233007      67.58142       7.479252      73.75753       7.324358  585.8831 33.00593 612.6614 30.88305 -26.77838      45.20126 
1 1 1 -7  5  9  o 198.2809 64.42390 7.830775       5.679518      0.000000       0.000000      7.830775       5.679518  ?        ?        198.2809 64.42390 0.000000       64.42390 
1 1 1 -7  5  10 o 118.2150 45.56642 1.893535       2.957126      0.8904492      4.202581      2.877216       4.161733  125.2994 52.16373 141.3949 54.16783 -16.09548      75.20112 
1 1 1 -7  5  11 o 615.4385 17.35528 73.88426       4.148053      72.63531       5.816561      75.17682       5.917200  608.8154 24.60099 619.3754 24.59995 -10.55994      34.79033 
1 1 1 -7  5  12 o 556.6223 19.06031 60.52999       4.120202      57.93700       5.754300      63.25799       5.902205  542.1414 27.41988 567.3458 26.78789 -25.20441      38.33328 
1 1 1 -7  5  13 o 244.9923 56.15967 12.75181       5.229052      19.08093       7.792684      7.567815       7.052575  295.8797 69.07366 199.1388 71.57413 96.74092       99.46873 
1 1 1 -7  5  14 o 370.9060 55.74478 28.70165       7.781278      0.000000       0.000000      28.70165       7.781278  ?        ?        370.9060 55.74478 0.000000       55.74478 
1 1 1 -7  5  15 o 511.2578 21.84497 51.16666       4.337299      57.60383       6.137559      44.74496       6.130182  539.9481 29.38009 474.4198 33.48734 65.52835       44.54876 
1 1 1 -7  5  16 o 747.5515 18.48344 109.0880       5.366016      116.7534       7.788933      102.1633       7.403142  771.3810 26.00046 721.4525 26.42289 49.92847       37.07011 
1 1 1 -7  5  17 o 282.4462 40.09488 16.12850       4.274513      17.06288       5.787948      15.00743       6.339825  286.4755 54.00537 265.9239 62.45356 20.55161       82.56529 
1 1 1 -7  5  18 f 950.4718 17.85975 176.1176       6.592383      188.3146       9.629407      165.3581       9.044166  980.8832 25.27867 919.1366 25.33731 61.74664       35.79092 
1 1 1 -7  5  19 o 290.9104 44.07097 17.14762       4.823039      18.43724       6.445166      15.50641       7.270848  297.9167 57.79237 270.2861 69.02435 27.63055       90.02399 
1 1 1 -7  5  20 o 315.7928 41.89943 20.05091       5.011651      20.68376       6.848835      19.32144       7.353091  316.2797 57.89276 303.5579 64.37003 12.72183       86.57408 
1 1 1 -7  5  21 o 622.1665 24.25045 75.64482       5.859418      73.99513       8.088629      77.46639       8.499573  612.5233 34.13929 626.5041 35.07466 -13.98083      48.94612 
1 1 1 -7  5  22 o 401.3643 35.83771 32.00564       5.527322      27.68214       7.513206      37.10618       8.160479  367.5767 54.26367 428.0788 50.03047 -60.50211      73.80782 
1 1 1 -7  5  23 o 691.3688 24.22144 93.59357       6.503359      87.68927       8.821345      100.6234       9.625449  665.6133 34.24196 713.7358 34.72606 -48.12256      48.76896 
1 1 1 -7  5  24 o 313.5301 51.56774 20.36897       6.060571      22.42375       8.245595      17.95456       8.938111  322.6768 67.94742 285.0620 78.32534 37.61487       103.6905 
1 1 1 -7  5  25 o 403.2840 41.93641 32.90116       6.471898      41.84720       8.812039      22.42465       9.536067  451.1562 51.20139 317.0622 77.98501 134.0939       93.29118 
1 1 1 -7  5  26 o 226.9902 76.13579 11.00941       7.913092      19.34566       9.251113      -11.71938      15.27555  291.8654 79.47477 177.9662 84.08206 113.8992       115.6980 
1 1 1 -7  5  27 o 303.0856 60.63877 20.00581       6.888242      16.60899       9.223075      24.29032       10.35835  267.0745 81.48882 321.4776 82.54288 -54.40305      115.9903 
1 1 1 -7  5  28 o 554.7905 71.49491 70.07352       15.04551      70.07352       15.04551      0.000000       0.000000  554.7905 71.49491 ?        ?        0.000000       71.49491 
1 1 1 -7  5  29 o 184.0694 79.06425 4.485984       10.16445      0.000000       0.000000      4.485984       10.16445  ?        ?        184.0694 79.06425 0.000000       79.06425 
1 1 1 -7  5  30 o 178.4018 73.22604 6.192801       8.123254      17.31019       13.11272      -0.7308747     10.34808  240.8761 95.04299 159.8085 73.33052 81.06763       120.0439 
1 1 1 -7  5  31 o 316.9875 62.25648 24.69939       7.390515      10.61170       9.968443      41.89410       11.01298  198.0902 81.19032 398.9024 73.80875 -200.8122      109.7251 
1 1 1 -7  5  32 o 337.5746 65.11055 29.96954       8.226556      30.75743       10.05675      28.37603       14.30211  316.3289 81.39232 252.9165 99.42957 63.41248       128.4949 
1 1 1 -7  5  33 f 143.8738 64.75940 3.393430       7.600505      2.421155       9.883745      4.800369       11.88953  147.7867 69.13044 159.0226 74.84026 -11.23586      101.8827 
1 1 1 -7  6  1  o 578.0914 14.13733 64.97886       3.173890      63.78338       4.451790      66.21467       4.526253  572.3638 20.02786 583.1737 19.98540 -10.80994      28.29366 
1 1 1 -7  6  2  o 899.8472 14.99503 157.4729       5.240154      157.6605       8.909726      157.3737       6.479244  899.0696 25.51779 899.1956 18.55420 -0.1259766     31.55021 
1 1 1 -7  6  3  o 817.7313 15.17223 130.0568       4.818234      128.9896       8.260016      130.6072       5.932017  813.0529 26.15978 819.1165 18.64785 -6.063538      32.12595 
1 1 1 -7  6  4  o 449.8080 18.82553 39.39226       3.288534      35.71939       5.650987      41.27301       4.043784  425.6342 34.48328 460.1480 22.62884 -34.51382      41.24513 
1 1 1 -7  6  5  f 73.74877 35.01308 -3.336564      2.710957      2.360472       4.806199      -5.994880      3.283073  144.8811 57.42157 72.97222 35.59040 71.90893       67.55674 
1 1 1 -7  6  6  o 366.5508 23.37006 26.31923       3.309426      30.42004       5.624353      24.14751       4.092975  391.6870 37.43045 349.9387 30.42017 41.74832       48.23303 
1 1 1 -7  6  7  o 542.3685 18.73611 57.31480       3.946407      56.31094       6.783967      57.82829       4.851831  534.7438 32.82579 544.3292 22.95177 -9.585327      40.05392 
1 1 1 -7  6  8  o 286.6938 29.92511 16.28709       3.282719      13.10706       4.037350      22.49075       5.639040  254.0875 42.41014 333.9412 44.59606 -79.85376      61.54209 
1 1 1 -7  6  9  o 580.5543 19.55137 65.76247       4.408066      62.30326       5.337579      73.18250       7.817344  564.3306 24.35470 608.8159 33.18849 -44.48535      41.16585 
1 1 1 -7  6  10 o 262.1531 31.19376 13.71310       3.113434      14.21022       4.361674      13.19665       4.445649  263.5805 44.17299 253.0105 46.97417 10.57002       64.48121 
1 1 1 -7  6  11 o 419.7464 22.35499 34.58136       3.630961      31.02738       5.096809      38.24376       5.173970  394.8350 33.55758 439.5127 30.50150 -44.67770      45.34813 
1 1 1 -7  6  12 o 587.6076 22.03989 67.60840       5.029501      66.50751       9.015409      68.10585       6.060204  575.8077 40.57578 588.6729 26.50850 -12.86511      48.46746 
1 1 1 -7  6  13 o 313.9209 44.10276 20.13503       5.228364      13.21540       7.808191      25.75924       7.039464  246.4510 74.92984 352.2106 53.11554 -105.7597      91.84629 
1 1 1 -7  6  14 o 536.2070 24.71134 56.42030       5.145844      50.00552       6.345388      68.74318       8.794751  501.8206 32.73917 586.1924 38.85298 -84.37180      50.80755 
1 1 1 -7  6  15 o 315.0719 34.44845 19.86488       4.146418      23.80779       5.696550      15.42197       6.046967  342.3463 43.85492 269.5018 59.37837 72.84448       73.81765 
1 1 1 -7  6  16 o 961.4352 16.85827 180.2368       6.294497      182.2218       8.963958      178.3060       8.840846  964.6873 23.92684 954.2894 23.85535 10.39783       33.78714 
1 1 1 -7  6  17 o 450.8162 27.51406 39.99875       4.794002      36.74035       6.667938      43.48524       6.897367  428.6058 40.54102 467.2694 38.34721 -38.66364      55.80397 
1 1 1 -7  6  18 o 336.5694 35.55965 22.56399       4.577560      21.48725       6.405779      23.68761       6.543721  323.5512 52.80162 340.6215 51.03994 -17.07031      73.43763 
1 1 1 -7  6  19 o 909.5225 18.67637 161.2447       6.596809      155.1998       9.027996      168.1697       9.662930  890.6932 26.09969 926.9653 26.84215 -36.27216      37.43921 
1 1 1 -7  6  20 o 1191.033 18.12275 276.4052       8.382547      271.3898       11.53896      282.0096       12.19788  1178.278 25.21686 1200.807 26.15672 -22.52893      36.33268 
1 1 1 -7  6  21 o 394.4634 35.65813 30.87635       5.403466      31.85303       7.183607      29.60368       8.200220  397.5045 47.47344 379.8463 57.37744 17.65823       74.47078 
1 1 1 -7  6  22 o 339.6125 42.85384 23.24844       5.526165      31.68991       7.476296      13.08182       8.204754  395.0193 49.84453 249.1153 77.00475 145.9040       91.72899 
1 1 1 -7  6  23 o 603.1937 28.09312 71.47605       6.580891      79.26028       9.099548      62.93999       9.528859  631.3931 37.27538 559.6961 44.19865 71.69696       57.81846 
1 1 1 -7  6  24 o 539.3635 48.44775 59.12584       10.03982      0.000000       0.000000      59.12584       10.03982  ?        ?        539.3635 48.44775 0.000000       48.44775 
1 1 1 -7  6  25 o 709.2917 31.47936 99.48067       8.671192      93.43700       10.13957      115.9325       16.72925  683.4518 38.35681 747.8855 58.05371 -64.43372      69.58073 
1 1 1 -7  6  26 o 312.2502 67.95975 21.43515       8.007037      29.07071       9.620113      4.218545       14.44553  363.3816 70.71407 218.5397 94.06992 144.8420       117.6844 
1 1 1 -7  6  27 o 384.1761 47.56749 30.73522       6.945178      36.78131       9.754498      24.51892       9.890852  410.9109 63.14725 323.9779 79.26260 86.93301       101.3417 
1 1 1 -7  6  28 o 359.7136 98.97382 34.68908       14.26039      34.68908       14.26039      0.000000       0.000000  359.7136 98.97382 ?        ?        0.000000       98.97382 
1 1 1 -7  6  29 o 444.4687 63.46144 45.29992       10.64314      0.000000       0.000000      45.29992       10.64314  ?        ?        444.4687 63.46144 0.000000       63.46144 
1 1 1 -7  6  30 o 158.0234 66.75111 3.635963       7.037199      -2.177123      9.485356      10.75285       10.49531  148.8652 68.98530 206.8657 83.86752 -58.00056      108.5943 
1 1 1 -7  6  31 o 168.0860 75.49617 3.996260       10.26643      0.000000       0.000000      3.996260       10.26643  ?        ?        168.0860 75.49617 0.000000       75.49617 
1 1 1 -7  6  32 o 144.2361 67.71465 -0.2129493     9.631072      -22.40339      13.82921      20.68604       13.42076  124.9490 62.87822 220.7238 92.65195 -95.77479      111.9734 
1 1 1 -7  6  33 o 134.7216 66.49673 -7.489234      12.58493      0.000000       0.000000      -7.489234      12.58493  ?        ?        134.7216 66.49673 0.000000       66.49673 
1 1 1 -7  7  1  o 496.7587 17.16921 48.02178       3.312256      50.98903       5.610950      46.43470       4.103545  510.1270 28.43549 488.1670 21.64526 21.95999       35.73646 
1 1 1 -7  7  2  o 550.4305 16.72929 58.95587       3.576086      61.28851       6.110643      57.74085       4.410168  559.4194 28.21783 544.4083 20.85943 15.01111       35.09077 
1 1 1 -7  7  3  o 447.7523 19.02447 39.04037       3.308098      29.44980       5.502763      44.46806       4.139672  385.6080 37.20768 477.6085 22.31855 -92.00052      43.38812 
1 1 1 -7  7  4  o 233.0842 32.99557 10.85048       2.903296      19.09646       4.965185      6.566283       3.578892  308.4987 42.57804 179.3252 49.67970 129.1735       65.42905 
1 1 1 -7  7  5  o 733.6630 16.28220 104.7678       4.639143      100.6782       7.854064      106.9591       5.749234  717.4958 28.18688 740.8493 19.98261 -23.35352      34.55148 
1 1 1 -7  7  6  o 310.3637 26.62483 18.97033       3.178049      22.21875       5.688669      17.49649       3.831769  332.0588 45.29469 296.6452 33.86799 35.41360       56.55660 
1 1 1 -7  7  7  o 585.0076 15.80412 66.63655       3.590542      65.18553       5.081329      68.08354       5.074265  577.7703 22.64614 590.5491 22.12530 -12.77887      31.66033 
1 1 1 -7  7  8  o 408.8158 23.96684 32.79347       3.788474      30.42929       4.574508      37.95533       6.759387  392.5223 30.24199 435.9861 40.37994 -43.46384      50.44917 
1 1 1 -7  7  9  o 490.1070 21.12611 46.93145       4.021040      52.36947       5.083986      37.84645       6.571227  517.0290 25.31987 435.1794 39.30640 81.84961       46.75563 
1 1 1 -7  7  10 o 169.3525 45.35352 5.944430       3.042492      0.7952716      4.361982      10.82303       4.245835  126.2098 52.89163 227.7405 49.42515 -101.5307      72.39040 
1 1 1 -7  7  11 o 409.9532 22.63429 33.01044       3.589578      39.89134       5.264383      27.03141       4.907269  448.8251 30.38141 367.8786 34.76040 80.94647       46.16617 
1 1 1 -7  7  12 o 147.2291 58.86757 2.578318       5.093520      3.755412       7.390929      1.513588       7.029317  175.0864 70.59057 158.7430 66.86581 16.34338       97.23201 
1 1 1 -7  7  13 o 508.9387 31.31751 51.32999       6.159811      45.76972       8.871667      56.50560       8.559302  473.5982 48.94141 529.9518 41.93100 -56.35358      64.44742 
1 1 1 -7  7  14 o 762.0290 20.07315 113.5056       5.940391      115.1432       7.303441      110.3045       10.21127  766.2557 24.54290 746.0963 35.24171 20.15936       42.94568 
1 1 1 -7  7  15 o 449.2647 25.23765 39.69196       4.385475      34.43633       6.171267      45.05361       6.233192  414.7407 38.76460 476.4109 33.91138 -61.67023      51.50414 
1 1 1 -7  7  16 o 355.1048 31.89618 25.01688       4.351773      27.83535       6.129318      22.15191       6.179664  371.5756 43.28665 328.8621 49.95795 42.71350       66.10242 
1 1 1 -7  7  17 o 256.6873 45.66590 13.48546       4.385399      12.79533       6.045752      14.25179       6.370787  246.1410 62.98610 259.5717 63.67916 -13.43066      89.56721 
1 1 1 -7  7  18 o 257.5423 49.19080 13.64103       4.740530      9.708498       6.624217      17.76920       6.786989  218.4267 69.43639 291.1953 61.92126 -72.76857      93.03577 
1 1 1 -7  7  19 o 493.6526 27.42344 47.83839       5.236692      44.61662       7.231135      51.39141       7.593767  473.8564 39.65918 509.0475 38.70222 -35.19113      55.41401 
1 1 1 -7  7  20 o 143.5314 57.45198 2.193372       4.857328      4.365292       6.704732      -0.2056895     7.046610  176.6223 68.46252 151.9247 65.54742 24.69760       94.78175 
1 1 1 -7  7  21 o 416.1729 34.95887 34.32699       5.597795      34.93785       7.859303      33.69803       7.974917  415.7077 49.66523 407.5619 51.53727 8.145874       71.57322 
1 1 1 -7  7  22 o 216.5591 63.51133 9.804177       5.688427      13.62755       7.774683      5.399458       8.344850  252.7616 74.28461 194.1169 76.06150 58.64473       106.3182 
1 1 1 -7  7  23 o 182.8325 64.76414 6.241981       5.754405      3.793972       7.527816      9.683372       8.925437  177.2568 71.32013 223.8510 80.51213 -46.59415      107.5582 
1 1 1 -7  7  24 o 193.5593 66.98565 7.352981       6.133625      -0.7815083     8.221563      17.56327       9.211034  158.2277 69.48958 281.0272 80.35865 -122.7995      106.2371 
1 1 1 -7  7  25 o 220.4563 75.88954 10.04508       7.867533      15.57418       9.180470      -5.245142      15.26669  264.2379 81.41780 195.2289 89.39401 69.00900       120.9138 
1 1 1 -7  7  26 o 181.5070 68.29216 5.860615       6.542161      -0.4891527     8.742053      13.94330       9.863076  161.9929 71.38359 249.9609 84.99487 -87.96796      110.9943 
1 1 1 -7  7  27 o 337.3956 55.18666 24.43794       6.980994      27.90757       10.25273      21.43906       9.531870  345.5974 78.21481 300.6811 80.16527 44.91635       112.0001 
1 1 1 -7  7  28 o 239.5800 83.65516 14.03528       9.576434      0.000000       0.000000      14.03528       9.576434  ?        ?        239.5800 83.65516 0.000000       83.65516 
1 1 1 -7  7  29 o 214.7312 82.28242 11.21838       9.604401      0.000000       0.000000      11.21838       9.604401  ?        ?        214.7312 82.28242 0.000000       82.28242 
1 1 1 -7  7  30 o 259.4812 70.25214 17.27175       7.253078      13.37421       10.63314      20.66324       9.918869  218.6423 85.80370 267.5745 84.95726 -48.93217      120.7477 
1 1 1 -7  7  31 o 183.1790 73.26669 8.736331       7.892989      13.66594       13.89184      6.386302       9.591579  205.6559 90.32320 173.8382 75.73169 31.81772       117.8710 
1 1 1 -7  7  32 o 139.1851 63.83865 1.160850       7.830554      3.254961       9.928577      -2.285447      12.73690  154.7887 71.32269 149.6282 72.30074 5.160553       101.5594 
1 1 1 -7  7  33 o 133.2284 61.86811 0.9287151      7.688150      -4.894818      9.549267      11.65834       12.96191  126.0194 61.29242 175.7621 81.16462 -49.74267      101.7077 
1 1 1 -7  8  1  o 672.6354 26.20815 88.36309       6.846112      0.000000       0.000000      88.36309       6.846112  ?        ?        672.6354 26.20815 0.000000       26.20815 
1 1 1 -7  8  2  o 376.3448 21.22939 27.69663       3.090115      27.62294       5.228920      27.73617       3.830580  373.2932 36.53742 375.8976 26.40779 -2.604401      45.08164 
1 1 1 -7  8  3  f 575.3590 17.11352 64.45044       3.823897      63.19811       6.397339      65.14660       4.769762  567.5926 29.12052 578.0444 21.24748 -10.45178      36.04803 
1 1 1 -7  8  4  o 1062.913 13.69509 219.7731       5.653151      220.1552       7.970217      219.3861       8.019536  1062.894 19.30867 1061.005 19.46273 1.888550       27.41574 
1 1 1 -7  8  5  o 882.1352 13.84088 151.4011       4.741621      153.9344       6.699461      148.8585       6.711885  888.6340 19.41284 873.7954 19.77911 14.83856       27.71410 
1 1 1 -7  8  6  o 407.7281 19.10364 32.41484       3.024925      35.24622       4.361305      29.79017       4.199087  423.5160 26.65260 388.9721 27.98468 34.54385       38.64587 
1 1 1 -7  8  7  f 109.6836 43.08022 1.434558       2.682549      3.636420       3.828811      -0.6883454     3.759533  145.8156 52.69408 107.8467 47.18592 37.96887       70.73315 
1 1 1 -7  8  8  o 537.3157 19.97343 56.36856       4.167831      52.38919       5.082016      64.54316       7.283867  517.1484 25.30421 571.3654 32.96617 -54.21704      41.55805 
1 1 1 -7  8  9  o 435.2849 20.34788 37.02184       3.439702      37.15388       4.852766      36.88853       4.876265  433.7457 28.97559 432.1242 29.22887 1.621490       41.15716 
1 1 1 -7  8  10 o 284.6555 30.43493 16.14343       3.312354      18.06749       4.709385      14.25970       4.659761  298.1825 41.81807 262.6053 47.43692 35.57718       63.23774 
1 1 1 -7  8  11 o 210.5456 42.52868 9.165937       3.357692      9.174739       4.779367      9.157360       4.718209  208.2261 57.30029 208.0490 56.80112 0.1770325      80.68266 
1 1 1 -7  8  12 o 351.2598 40.33585 24.91322       5.402533      20.26607       7.866192      29.06250       7.432879  306.0728 67.94941 375.0948 52.46110 -69.02191      85.84457 
1 1 1 -7  8  13 o 201.3655 54.06646 8.536346       4.317138      5.234599       5.266630      15.29886       7.537286  170.7444 61.78600 265.0403 71.55592 -94.29588      94.53972 
1 1 1 -7  8  14 o 240.9910 45.79540 11.99076       4.129295      8.400052       5.685684      15.99874       6.006962  202.1644 64.33634 275.3948 57.99806 -73.23038      86.61951 
1 1 1 -7  8  15 o 421.5723 26.94369 34.99781       4.388143      39.26973       6.262535      30.87734       6.150524  444.1281 36.63594 392.2031 40.98607 51.92499       54.97318 
1 1 1 -7  8  16 o 715.5490 19.82921 99.91486       5.510268      108.4764       7.751428      91.16858       7.834630  744.0500 26.82574 681.4454 29.60462 62.60461       39.95064 
1 1 1 -7  8  17 o 97.38556 45.66346 -4.286930      4.356853      -7.359589      5.929305      -0.6808982     6.423347  107.6220 51.28940 142.3568 61.99695 -34.73479      80.46257 
1 1 1 -7  8  18 o 469.5321 28.54646 43.33754       5.180595      43.61562       7.416230      43.07253       7.239889  467.9760 41.22781 465.2406 40.47390 2.735474       57.77430 
1 1 1 -7  8  19 o 532.3210 27.08134 55.57705       5.580029      69.02554       8.140231      43.65612       7.663988  591.3540 35.61161 467.9880 42.63668 123.3660       55.55244 
1 1 1 -7  8  20 o 809.7008 20.93931 127.8983       6.584381      137.9223       9.279198      117.7325       9.344587  839.1830 28.47251 774.7039 31.05964 64.47913       42.13531 
1 1 1 -7  8  21 o 1071.344 19.41352 223.8709       8.077211      233.2866       11.30072      214.0366       11.54913  1091.488 26.65994 1044.874 28.46147 46.61365       38.99754 
1 1 1 -7  8  22 o 270.8437 56.47418 15.37375       5.747736      14.29075       7.602340      16.81882       8.781660  257.9079 72.74805 278.1856 78.08893 -20.27774      106.7247 
1 1 1 -7  8  23 o 436.2416 36.16064 37.96407       6.070967      37.26149       8.107115      38.86105       9.160324  427.1577 49.80605 433.7779 55.66107 -6.620178      74.69135 
1 1 1 -7  8  24 o 200.4374 72.54799 7.590357       7.261741      7.129489       8.501087      8.834390       13.96696  203.5335 77.54951 239.0506 96.80742 -35.51712      124.0387 
1 1 1 -7  8  25 o 349.5031 61.34088 26.06099       8.022165      26.67232       9.248035      24.20268       16.12390  348.8532 70.68360 316.0981 108.6518 32.75504       129.6201 
1 1 1 -7  8  26 o 175.6174 67.97356 5.082829       6.601808      10.43923       9.587341      0.2527641      9.104122  225.0081 83.06046 167.5441 73.36364 57.46394       110.8209 
1 1 1 -7  8  27 o 158.0404 66.19164 2.482124       6.824859      1.554766       9.456785      3.490130       9.859418  172.7617 75.23203 184.0444 78.42793 -11.28278      108.6775 
1 1 1 -7  8  28 o 237.1723 77.38995 13.74522       8.192454      9.460797       15.36346      15.44753       9.684184  223.9756 96.70917 247.2822 84.21988 -23.30655      128.2406 
1 1 1 -7  8  29 o 192.3395 74.01796 8.351995       7.792981      17.69530       13.79024      3.968313       9.445848  245.6839 97.29981 174.6633 75.62288 71.02065       123.2318 
1 1 1 -7  8  30 o 132.3936 60.19286 -0.7949188     6.765418      -10.88315      9.914162      7.996963       9.255278  126.9764 61.91149 186.8867 77.57447 -59.91028      99.25135 
1 1 1 -7  8  31 o 128.6226 59.45377 -1.169300      6.979887      4.668970       10.04961      -6.610310      9.701680  165.9977 74.61529 130.7234 63.15020 35.27438       97.75167 
1 1 1 -7  8  32 o 364.5801 51.18263 32.18723       7.047111      38.39931       10.16986      26.44916       9.774152  360.4354 75.09120 278.3574 83.65623 82.07797       112.4147 
1 1 1 -7  9  1  o 876.7974 13.83588 149.5619       4.711227      151.2408       5.618755      145.5867       8.645582  881.3646 16.41559 863.0435 25.79488 18.32104       30.57528 
1 1 1 -7  9  2  o 103.6992 39.46863 1.498022       2.200534      2.373258       3.056767      0.5565093      3.170392  125.0344 46.75209 108.6601 45.27782 16.37424       65.08332 
1 1 1 -7  9  3  o 443.1091 16.87504 38.24165       2.903912      37.54449       3.993528      39.02390       4.230185  437.7973 23.57540 446.2096 24.50525 -8.412292      34.00451 
1 1 1 -7  9  4  o 257.0144 25.75125 13.04817       2.535722      13.27449       3.448474      12.78176       3.741532  257.3496 35.44491 251.4748 39.62277 5.874771       53.16301 
1 1 1 -7  9  5  o 221.3248 32.28362 9.824369       2.693176      9.956574       3.696310      9.674763       3.932065  220.0444 44.77764 216.2029 48.07479 3.841492       65.69796 
1 1 1 -7  9  6  o 162.0750 43.17132 5.405896       2.766013      2.602915       3.818975      8.498758       4.011596  135.3716 51.88242 202.0005 51.09977 -66.62891      72.82150 
1 1 1 -7  9  7  o 332.1263 27.29802 21.78365       3.489811      20.46686       4.365369      24.11538       5.809014  319.9311 35.74574 345.0957 44.37252 -25.16458      56.97963 
1 1 1 -7  9  8  o 497.7849 20.83712 48.42889       4.028167      47.63865       4.970730      49.94062       6.875079  492.1311 26.10158 501.2164 35.55095 -9.085327      44.10400 
1 1 1 -7  9  9  o 226.8566 36.36004 10.44147       3.095149      18.01584       4.490698      3.587211       4.271898  298.4488 39.73226 148.4439 55.31531 150.0049       68.10606 
1 1 1 -7  9  10 o 751.4017 16.23715 110.1105       4.738163      114.5025       6.786595      105.9338       6.618129  764.6168 22.85494 735.3624 23.17426 29.25439       32.54834 
1 1 1 -7  9  11 o 963.9492 22.55803 181.9521       8.444681      183.3841       12.08310      180.5848       11.80685  963.5132 32.29184 956.3824 31.78884 7.130798       45.31328 
1 1 1 -7  9  12 o 315.9428 46.22221 20.42497       5.503611      22.47690       8.075577      18.64539       7.520588  323.8687 66.43474 294.0697 67.30704 29.79898       94.57172 
1 1 1 -7  9  13 o 451.4266 28.25574 40.20366       4.928664      40.58397       6.212380      39.55771       8.096359  451.4622 35.72486 441.3280 48.01364 10.13422       59.84626 
1 1 1 -7  9  14 o 673.8926 19.32462 88.64594       5.057427      93.35893       7.185505      84.01911       7.119515  689.9048 26.81885 654.1845 28.02349 35.72028       38.78874 
1 1 1 -7  9  15 o 1016.637 17.19053 201.4489       6.787084      199.3903       9.531928      203.5660       9.666252  1009.533 24.31264 1020.021 24.40174 -10.48810      34.44633 
1 1 1 -7  9  16 f 386.7755 44.56699 30.08600       6.571768      30.08600       6.571768      0.000000       0.000000  386.7755 44.56699 ?        ?        0.000000       44.56699 
1 1 1 -7  9  17 o 660.7972 21.89250 85.22925       5.618127      87.97900       7.869653      82.37125       8.023030  669.7966 30.25413 647.7441 31.89385 22.05255       43.96055 
1 1 1 -7  9  18 o 631.6175 23.41886 77.89789       5.744441      83.27707       7.943158      71.99974       8.317498  651.6215 31.38845 604.0275 35.61507 47.59399       47.47282 
1 1 1 -7  9  19 o 623.0332 24.16020 75.82254       5.845743      78.11100       7.979300      73.17129       8.588534  629.9905 32.72662 608.6920 36.50088 21.29852       49.02393 
1 1 1 -7  9  20 o 460.9254 32.10976 41.91473       5.711821      32.96319       7.465351      54.55370       8.870685  404.1645 48.53295 522.7569 44.10667 -118.5924      65.58083 
1 1 1 -7  9  21 f 855.7568 21.22405 143.0137       7.053531      147.1183       9.726786      138.4613       10.24367  865.8396 28.92704 839.1815 31.43198 26.65808       42.71701 
1 1 1 -7  9  22 o 253.9694 59.40744 13.65867       5.755029      5.201266       7.851158      23.48018       8.460656  188.7547 73.82788 331.4865 68.00278 -142.7318      100.3740 
1 1 1 -7  9  23 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -7  9  24 o 244.3144 72.62625 12.99871       7.396491      12.99833       8.439566      12.99996       15.35906  244.8870 78.43142 262.2359 103.0557 -17.34894      129.5066 
1 1 1 -7  9  25 o 257.5213 82.49026 14.87986       9.335400      14.87986       9.335400      0.000000       0.000000  257.5213 82.49026 ?        ?        0.000000       82.49026 
1 1 1 -7  9  26 o 169.8440 66.45602 4.596387       6.363341      14.43974       8.758909      -6.406049      9.260252  250.5045 79.86686 143.4199 67.03219 107.0845       104.2690 
1 1 1 -7  9  27 o 341.9699 54.54008 25.32109       6.999887      19.40417       9.765420      31.57408       10.03891  280.3065 83.47836 368.9899 72.64170 -88.68344      110.6592 
1 1 1 -7  9  28 o 378.7669 70.31966 33.93291       9.962910      0.000000       0.000000      33.93291       9.962910  ?        ?        378.7669 70.31966 0.000000       70.31966 
1 1 1 -7  9  29 o 214.5441 75.23155 11.73160       7.748860      4.485517       12.58242      16.15898       9.835265  187.6850 83.98887 241.2991 84.74869 -53.61411      119.3167 
1 1 1 -7  9  30 o 282.8599 62.70457 19.81170       6.707267      22.06091       9.630745      17.69323       9.346650  273.1689 83.25296 243.4726 82.74004 29.69630       117.3753 
1 1 1 -7  9  31 o 120.6405 56.44288 -2.232616      6.594083      -7.871120      9.543102      2.919283       9.122025  125.5979 61.12999 154.3253 70.06010 -28.72733      92.98007 
1 1 1 -7  9  32 o 142.4929 66.88997 0.8509442      9.394148      0.8509442      9.394148      0.000000       0.000000  142.4929 66.88997 ?        ?        0.000000       66.88997 
1 1 1 -7  10 1  o 621.6056 14.95163 75.22163       3.609371      77.58596       4.346365      69.96841       6.478662  630.9695 17.73740 597.6059 27.91531 33.36359       33.07386 
1 1 1 -7  10 2  o 584.3491 15.96828 66.50372       3.623752      66.65839       4.272499      66.10720       6.840572  584.6882 18.81610 579.5333 30.50123 5.154907       35.83812 
1 1 1 -7  10 3  o 734.9914 14.21918 105.1557       4.058679      103.7172       5.615654      106.7289       5.872644  729.0988 19.83289 739.4973 20.44886 -10.39850      28.48683 
1 1 1 -7  10 4  o 700.3315 14.63293 95.49832       3.979816      97.74479       5.600743      93.20708       5.656289  707.6110 20.38089 690.8627 21.08200 16.74835       29.32288 
1 1 1 -7  10 5  o 250.8890 28.91639 12.51834       2.765864      11.42140       3.762185      13.80856       4.080183  236.2824 42.56532 260.5999 41.72366 -24.31749      59.60428 
1 1 1 -7  10 6  o 499.7133 17.85967 48.70954       3.465950      56.19471       4.897358      41.19841       4.905841  535.8431 23.53403 457.2953 27.75544 78.54779       36.38977 
1 1 1 -7  10 7  o 250.9719 35.43135 12.69183       3.357301      14.00935       4.135942      10.14657       5.748590  262.1190 42.05186 219.2295 63.71852 42.88943       76.34402 
1 1 1 -7  10 8  o 368.6165 26.75074 26.81595       3.803388      28.02167       4.829926      24.84790       6.170706  375.1785 33.50174 349.0370 46.69375 26.14148       57.46889 
1 1 1 -7  10 9  o 582.0130 18.15978 66.12393       4.104603      63.84363       5.771438      68.45770       5.838719  570.2997 26.05871 590.6950 25.45225 -20.39532      36.42628 
1 1 1 -7  10 10 o 794.4283 18.82222 123.2467       5.807022      121.8818       7.044010      126.1422       10.25939  788.9178 22.99112 798.9981 33.06344 -10.08026      40.27136 
1 1 1 -7  10 11 o 163.2205 60.68251 4.449777       5.135322      0.5577921      7.621913      7.685308       6.949463  159.6848 68.52423 200.6185 71.16060 -40.93365      98.78968 
1 1 1 -7  10 12 o 1103.983 18.83967 237.9127       8.077251      260.4574       10.46806      204.7389       12.69815  1153.470 23.36855 1019.035 32.08656 134.4348       39.69429 
1 1 1 -7  10 13 o 621.4711 19.73369 75.40228       4.762745      74.56249       6.598107      76.31587       6.881932  616.4249 27.56203 623.4234 28.42492 -6.998535      39.59346 
1 1 1 -7  10 14 o 341.2074 33.05509 23.12603       4.325185      24.74180       6.228891      21.62162       6.010427  349.1711 47.14008 325.4471 49.08062 23.72400       68.05214 
1 1 1 -7  10 15 o 867.3723 18.03766 146.6416       6.075945      141.6837       8.441938      151.9702       8.751803  850.9642 25.54482 881.3068 25.57069 -30.34265      36.14413 
1 1 1 -7  10 16 o 825.3452 19.03590 132.7940       6.101506      121.3317       8.366560      145.8154       8.917426  787.2737 27.36486 863.2512 26.59955 -75.97748      38.16244 
1 1 1 -7  10 17 o 594.9233 23.58685 69.11470       5.449529      70.92400       7.505136      67.09696       7.925641  600.3408 32.30978 583.1552 35.16074 17.18555       47.75144 
1 1 1 -7  10 18 o 798.4388 20.84503 124.3231       6.463566      129.4882       9.110004      119.0875       9.172036  813.2587 28.84443 779.5845 30.29525 33.67419       41.83065 
1 1 1 -7  10 19 o 216.3978 59.04483 9.730290       5.100126      14.28814       7.108117      4.894058       7.321971  260.2346 69.15337 185.0703 71.59831 75.16437       99.54149 
1 1 1 -7  10 20 o 228.4445 58.60252 10.92964       5.224438      9.587575       7.077940      12.53610       7.743824  218.6107 71.96268 244.6627 74.67256 -26.05197      103.7045 
1 1 1 -7  10 21 o 442.8381 34.84426 38.93394       5.944043      38.93201       8.026853      38.93629       8.844847  438.6268 47.90052 436.6074 53.26850 2.019348       71.63793 
1 1 1 -7  10 22 o 287.2232 54.16104 17.22186       5.819803      12.98982       7.770734      22.62799       8.782761  246.0340 74.73807 323.2600 71.82557 -77.22601      103.6566 
1 1 1 -7  10 23 f 522.9352 33.20645 54.29603       6.708733      52.36873       8.857875      56.88884       10.27402  508.7505 45.30706 527.7689 50.75247 -19.01834      68.03339 
1 1 1 -7  10 24 o 276.8032 69.74731 16.83057       7.494540      28.23819       8.559382      -20.65106      15.51509  363.8857 62.84078 162.6731 78.88971 201.2125       100.8591 
1 1 1 -7  10 25 f 332.8894 53.48259 23.35102       6.680066      31.19289       9.040542      13.92100       9.913815  380.2184 63.46259 249.7474 85.21179 130.4710       106.2476 
1 1 1 -7  10 26 o 511.0405 40.91246 53.37823       8.051599      59.55531       12.55297      49.06067       10.49481  522.9020 63.09032 478.3910 57.65020 44.51102       85.46305 
1 1 1 -7  10 27 o 291.2443 74.64672 20.35123       8.481964      1.644822       15.67066      28.10242       10.08734  202.7590 91.96274 341.1176 77.86095 -138.3587      120.4968 
1 1 1 -7  10 28 o 131.5254 61.91197 -5.327025      8.144227      -19.34905      14.81891      0.7410116      9.748441  148.3427 73.01518 164.7515 73.81258 -16.40883      103.8244 
1 1 1 -7  10 29 o 599.7963 38.12004 75.58616       8.833331      89.05943       15.11332      68.59550       10.88636  610.1860 64.76804 555.0135 51.08018 55.17242       82.48687 
1 1 1 -7  10 30 o 194.8054 69.59811 10.12630       6.659069      2.743556       9.709677      16.68237       9.149923  160.7773 72.70406 233.6021 81.75960 -72.82487      109.4098 
1 1 1 -7  10 31 o 271.0025 71.52776 21.12940       7.638034      16.91600       9.325109      29.71866       13.31420  222.0394 81.92619 264.1366 97.80683 -42.09724      127.5856 
1 1 1 -7  10 32 o 117.9156 55.52186 -1.815582      6.558634      0.8649227      9.085828      -4.731964      9.477163  140.1334 65.78262 127.1027 61.64352 13.03078       90.15141 
1 1 1 -7  11 1  o 608.3627 15.44757 72.08663       3.649647      72.97877       4.384471      70.07379       6.585778  611.7154 18.45610 597.6409 28.37519 14.07452       33.84936 
1 1 1 -7  11 2  o 388.2130 20.71268 29.51187       3.111447      25.91319       3.664478      38.80903       5.890004  362.7578 26.18765 442.3123 34.56394 -79.55453      43.36426 
1 1 1 -7  11 3  o 222.9272 35.33498 10.04101       2.957091      10.76384       3.592788      8.522970       5.206605  229.3844 41.87407 202.9213 61.07334 26.46313       74.04992 
1 1 1 -7  11 4  o 782.8848 14.55875 119.3664       4.426393      122.6027       6.215693      116.0364       6.304990  792.3422 20.19988 770.6399 21.06711 21.70227       29.18661 
1 1 1 -7  11 5  o 625.9945 15.82973 76.36885       3.848327      80.57130       5.418388      72.09120       5.466646  641.9586 21.73377 606.9500 23.19210 35.00861       31.78412 
1 1 1 -7  11 6  o 642.0651 15.73164 80.34610       3.922663      79.16026       5.438542      81.63195       5.663245  636.1835 22.01263 645.9184 22.57666 -9.734863      31.53192 
1 1 1 -7  11 7  o 155.6984 49.38822 4.836064       3.352648      6.221017       4.048111      1.811515       5.982259  174.7831 54.09941 151.1926 62.53040 23.59047       82.68493 
1 1 1 -7  11 8  o 629.4004 19.80872 77.39085       4.841850      76.82492       5.909350      78.54687       8.445760  626.1381 24.30198 629.2551 34.69489 -3.117004      42.35943 
1 1 1 -7  11 9  o 516.3459 22.18188 52.16369       4.448024      54.38436       5.420778      47.58700       7.782066  525.6944 26.63919 486.9656 41.54739 38.72882       49.35415 
1 1 1 -7  11 10 f 393.3260 29.20843 30.58685       4.429729      35.07637       5.428612      21.64072       7.663137  420.2000 33.54593 319.2434 64.03748 100.9566       72.29196 
1 1 1 -7  11 11 o 382.4808 39.32685 29.31777       5.758319      27.76092       8.371226      30.71602       7.933388  364.2323 61.36217 386.3554 54.37899 -22.12311      81.99019 
1 1 1 -7  11 12 o 736.7210 18.05111 105.8526       5.164580      104.3251       7.222149      107.4512       7.388324  729.8087 25.48176 740.6102 25.68788 -10.80151      36.18269 
1 1 1 -7  11 13 o 834.7718 17.39570 135.8202       5.639462      138.9060       8.010756      132.7883       7.940516  842.6549 24.47911 823.8043 24.81971 18.85059       34.86036 
1 1 1 -7  11 14 o 276.7330 40.41545 15.44797       4.215383      12.88634       5.947828      18.03321       5.975169  247.5027 62.00859 295.6220 54.03704 -48.11935      82.25003 
1 1 1 -7  11 15 o 196.7785 55.55396 7.985277       4.431361      14.00997       6.232326      1.825053       6.302038  258.2463 62.75795 155.8693 64.29776 102.3771       89.84856 
1 1 1 -7  11 16 o 129.9217 54.27006 0.8082911      4.570589      5.743366       6.443852      -4.188334      6.483911  185.0743 68.13290 126.8929 58.16014 58.18140       89.58066 
1 1 1 -7  11 17 f 422.0960 31.29865 35.11042       5.094013      37.69256       7.085599      32.34813       7.328588  434.8260 42.50327 401.0333 48.01007 33.79276       64.12094 
1 1 1 -7  11 18 o 687.4473 22.73490 92.23787       6.069604      90.33838       8.355534      94.36002       8.831677  678.6910 31.70108 693.3914 32.79720 -14.70038      45.61376 
1 1 1 -7  11 19 o 143.0770 58.46418 1.718806       5.149267      5.684092       7.121228      -2.626347      7.454528  188.8683 71.21201 144.5129 64.65988 44.35542       96.18758 
1 1 1 -7  11 20 o 480.2830 32.26772 45.57685       5.983630      42.39078       8.141013      49.32036       8.824513  458.9139 46.31273 495.2823 46.42013 -36.36835      65.57208 
1 1 1 -7  11 21 f 266.5266 58.38998 14.97910       5.876650      11.53862       7.962738      19.09467       8.708985  235.1500 76.27526 296.1190 75.50033 -60.96904      107.3229 
1 1 1 -7  11 22 o 554.6895 30.78299 60.83115       6.605106      66.07071       9.304564      55.50865       9.377931  573.8211 42.04612 523.7612 46.59128 50.05994       62.75846 
1 1 1 -7  11 23 o 905.6614 27.09495 161.3263       9.529764      154.0739       10.98787      183.3419       19.14419  882.8261 32.04870 947.9966 52.20104 -65.17053      61.25412 
1 1 1 -7  11 24 o 109.3428 53.96983 -16.71268      8.289618      -16.71268      8.289618      0.000000       0.000000  109.3428 53.96983 ?        ?        0.000000       53.96983 
1 1 1 -7  11 25 o 409.0359 50.85588 34.97138       7.904109      40.47262       12.46603      31.27288       10.22140  420.9714 79.15699 373.0001 73.17635 47.97131       107.7989 
1 1 1 -7  11 26 o 311.4174 59.88110 21.40661       6.979012      30.36366       9.686208      11.73669       10.06427  364.1010 71.05275 228.7232 84.96803 135.3779       110.7613 
1 1 1 -7  11 27 o 385.8060 60.05260 33.33552       8.704950      35.41165       15.44268      32.36858       10.53889  348.0183 105.2791 365.2144 76.74370 -17.19617      130.2815 
1 1 1 -7  11 28 o 386.8668 49.91983 32.81225       7.325059      37.75303       9.890596      26.80998       10.90141  399.3757 66.08022 312.9356 86.70918 86.44016       109.0187 
1 1 1 -7  11 29 o 154.6101 67.42674 2.777409       7.621349      9.784686       11.95857      -2.015411      9.890084  199.5723 85.74195 149.5313 69.68189 50.04100       110.4864 
1 1 1 -7  11 30 o 177.1446 72.85364 7.967373       8.060591      10.23689       9.768473      3.124748       14.26923  189.9480 79.34110 173.1187 81.63046 16.82932       113.8356 
1 1 1 -7  11 31 o 222.2622 66.89252 14.16609       6.246129      18.99822       8.545938      8.624418       9.151880  239.3892 79.08712 173.5264 74.78410 65.86288       108.8459 
1 1 1 -7  12 1  o 535.4775 18.09281 55.92330       3.762489      56.14984       4.647935      55.49266       6.408337  535.9451 22.33118 530.2194 31.25987 5.725769       38.41694 
1 1 1 -7  12 2  o 447.5816 20.65834 39.12780       3.590837      40.08208       4.406969      37.24271       6.193983  451.6752 25.22460 432.3290 37.25540 19.34616       44.99161 
1 1 1 -7  12 3  o 376.5406 23.92417 27.86152       3.480303      28.91243       4.266138      25.77047       6.017764  382.5760 28.92742 356.8904 44.37638 25.68570       52.97224 
1 1 1 -7  12 4  o 585.9702 18.53119 67.00105       4.217030      62.34420       5.072270      77.42505       7.588808  564.4674 23.13852 627.1049 31.16057 -62.63745      38.81201 
1 1 1 -7  12 5  o 518.6086 20.21622 52.53591       4.071625      54.44653       4.979652      48.68201       7.072327  527.2574 24.31915 494.4663 37.10011 32.79111       44.36033 
1 1 1 -7  12 6  o 229.1212 47.84366 10.89892       4.119726      10.89892       4.119726      0.000000       0.000000  229.1212 47.84366 ?        ?        0.000000       47.84366 
1 1 1 -7  12 7  o 948.5945 20.91401 175.8543       7.704524      175.8543       7.704524      0.000000       0.000000  948.5945 20.91401 ?        ?        0.000000       20.91401 
1 1 1 -7  12 8  o 724.7111 18.58405 102.4954       5.230381      104.9880       6.354712      97.26030       9.209422  732.6570 22.33404 701.9281 33.78406 30.72888       40.49903 
1 1 1 -7  12 9  o 376.8349 28.99885 28.06140       4.211258      31.01476       5.193460      22.39126       7.196074  394.9892 34.19392 327.3558 58.76354 67.63339       67.98808 
1 1 1 -7  12 10 o 836.2737 23.82332 136.8368       7.737110      136.4039       11.02739      137.2565       10.85841  831.6306 34.14400 834.4640 33.50664 -2.833435      47.83834 
1 1 1 -7  12 11 o 410.2015 29.95232 33.21437       4.738523      31.73137       8.942541      33.79333       5.587425  391.2127 60.83666 412.5113 35.21506 -21.29865      70.29367 
1 1 1 -7  12 12 o 588.2927 20.41208 67.53369       4.663464      73.75474       6.752777      61.86146       6.448039  613.3964 28.34740 560.7471 29.71563 52.64935       41.06816 
1 1 1 -7  12 13 o 721.2498 18.98146 101.4150       5.316714      103.4460       7.689765      99.55489       7.359071  726.9045 27.24004 713.2441 26.56787 13.66040       38.05091 
1 1 1 -7  12 14 o 130.0627 52.76367 1.508852       4.156955      3.356673       6.012407      -0.1834072     5.753763  163.5814 64.41685 137.7729 59.33632 25.80853       87.58042 
1 1 1 -7  12 15 o 1122.567 17.13317 245.4008       7.469265      238.8882       10.34363      252.4971       10.79724  1106.017 24.08147 1136.984 24.45291 -30.96680      34.31999 
1 1 1 -7  12 16 o 1127.281 17.55106 247.4747       7.683577      243.2680       10.71057      251.9352       11.02885  1116.060 24.71138 1135.689 25.00592 -19.62915      35.15606 
1 1 1 -7  12 17 f 857.4557 19.84021 143.3073       6.606722      147.8001       9.285697      138.7012       9.402020  869.2775 27.50604 841.8111 28.75932 27.46637       39.79548 
1 1 1 -7  12 18 o 592.2389 25.18672 68.55603       5.792907      66.40684       8.058067      70.85477       8.333698  579.8455 35.96154 599.0120 35.99099 -19.16656      50.87812 
1 1 1 -7  12 19 o 856.0227 21.19246 143.0489       7.045221      144.5420       9.719105      141.3956       10.22720  858.4440 29.15321 848.4821 31.03745 9.961853       42.58207 
1 1 1 -7  12 20 o 827.6038 22.54853 133.9200       7.247175      121.6010       9.808656      148.7298       10.75465  785.8332 32.14039 869.1866 31.86069 -83.35339      45.25603 
1 1 1 -7  12 21 o 204.1702 66.92605 8.473404       6.124232      6.471154       8.576197      10.55683       8.748311  201.1228 77.57796 229.3912 79.96429 -28.26837      111.4120 
1 1 1 -7  12 22 o 431.3290 38.61810 37.29221       6.400388      45.89233       8.813471      27.69587       9.309951  474.7923 48.47866 358.7097 69.33949 116.0826       84.60583 
1 1 1 -7  12 23 o 290.8514 78.91328 18.97058       9.140247      18.77410       11.43147      19.31884       15.21918  286.8420 91.21925 291.9261 105.1193 -5.084106      139.1798 
1 1 1 -7  12 24 o 507.0302 36.64014 51.63905       7.166136      57.92737       9.893324      44.69800       10.39410  530.6938 48.54081 459.1504 59.70395 71.54346       76.94655 
1 1 1 -7  12 25 o 263.9424 67.09537 15.72817       6.892390      16.07692       9.550364      15.34910       9.956968  260.6855 83.42730 255.2223 85.40520 5.463120       119.3908 
1 1 1 -7  12 26 o 146.0656 66.97302 -3.079710      8.608907      -3.974404      15.04936      -2.644527      10.49582  185.6434 86.32500 162.0729 74.17883 23.57050       113.8179 
1 1 1 -7  12 27 o 139.7725 64.54606 -3.157999      8.197838      -17.37085      14.67236      3.292639       9.884633  151.4050 74.14133 176.6783 76.92688 -25.27327      106.8395 
1 1 1 -7  12 28 o 247.6061 74.29276 15.96632       7.713243      23.55990       9.689116      2.827587       12.74494  294.2895 81.81838 181.8892 82.66535 112.4003       116.3091 
1 1 1 -7  12 29 o 230.5624 76.68663 15.09647       8.030073      22.99592       13.22873      10.48748       10.10468  253.2782 96.68263 197.1156 81.37495 56.16257       126.3701 
1 1 1 -7  12 30 o 125.2924 58.01791 -1.171355      6.690647      -21.99651      9.730301      17.50544       9.214744  103.0015 51.94795 230.0567 81.90551 -127.0552      96.99021 
1 1 1 -7  12 31 o 368.3866 47.83698 32.22702       6.682234      30.46002       9.338494      34.08109       9.565819  313.5443 77.20518 337.1697 74.99215 -23.62549      107.6311 
1 1 1 -7  13 1  o 207.6765 49.16745 8.970123       3.904042      10.99282       5.991348      7.477533       5.146708  228.4353 64.63332 192.4040 61.20901 36.03130       89.01690 
1 1 1 -7  13 2  o 929.5599 16.25175 168.3751       5.866859      160.9760       7.036167      185.2548       10.62751  908.0995 19.95146 971.6364 28.16435 -63.53687      34.51509 
1 1 1 -7  13 3  o 567.0944 18.91743 62.74898       4.166252      60.22486       5.001691      68.46921       7.529551  554.8963 23.21010 588.5817 33.07487 -33.68542      40.40614 
1 1 1 -7  13 4  o 418.8199 23.75566 34.43048       3.847961      35.62263       4.631134      31.77231       6.915353  425.1088 28.21196 396.4885 45.75105 28.62036       53.75010 
1 1 1 -7  13 5  o 146.0631 50.32018 3.950177       3.459399      4.781124       4.209740      2.222079       6.070901  160.2867 55.49326 155.2619 63.46642 5.024811       84.30592 
1 1 1 -7  13 6  f 373.4744 32.15140 27.65926       4.617796      27.65926       4.617796      0.000000       0.000000  373.4744 32.15140 ?        ?        0.000000       32.15140 
1 1 1 -7  13 7  o 1385.618 17.81730 374.3972       9.587679      368.2113       11.47901      388.6688       17.43557  1372.783 21.53152 1405.187 31.95022 -32.40454      38.52820 
1 1 1 -7  13 8  o 353.1962 30.02478 24.67567       4.079301      26.04548       4.927530      21.69202       7.272311  361.6439 35.54411 322.1454 60.34655 39.49854       70.03635 
1 1 1 -7  13 9  o 536.2258 28.34997 56.54577       5.882777      56.54577       5.882777      0.000000       0.000000  536.2258 28.34997 ?        ?        0.000000       28.34997 
1 1 1 -7  13 10 o 422.2987 28.47758 35.11419       4.643090      26.82073       8.276545      38.92291       5.608817  359.3123 61.52559 443.7452 32.77891 -84.43292      69.71265 
1 1 1 -7  13 11 o 324.8415 43.29533 21.26075       5.325866      0.000000       0.000000      21.26075       5.325866  ?        ?        324.8415 43.29533 0.000000       43.29533 
1 1 1 -7  13 12 o 391.1783 28.59731 30.12532       4.314273      35.81337       6.168278      24.67777       6.036465  424.6658 37.79659 349.9575 45.49176 74.70828       59.14459 
1 1 1 -7  13 13 o 460.1894 25.36236 41.51038       4.515171      40.81100       6.573498      42.13507       6.212606  453.7384 37.64463 461.7431 34.90315 -8.004669      51.33564 
1 1 1 -7  13 14 o 378.5022 31.74671 28.27698       4.623438      35.70446       6.727846      21.63041       6.364345  423.4343 41.44440 325.8492 52.04442 97.58511       66.53014 
1 1 1 -7  13 15 o 596.6089 23.06148 69.45544       5.343243      73.04152       7.587166      65.92678       7.526176  609.5864 32.16298 578.7180 33.63230 30.86835       46.53589 
1 1 1 -7  13 16 o 528.9185 26.01498 54.66677       5.343677      62.42666       7.678194      47.37781       7.441562  562.6521 35.31828 488.8586 39.53545 73.79352       53.01351 
1 1 1 -7  13 17 f 128.2938 54.93111 -0.4771073E-02 4.878387      1.150577       6.836443      -1.203455      6.963475  157.4004 66.10210 146.1099 64.06514 11.29048       92.05341 
1 1 1 -7  13 18 o 250.9018 56.78591 13.14076       5.404145      10.83832       7.579880      15.52103       7.706935  230.5624 74.38068 270.0617 72.12280 -39.49930      103.6059 
1 1 1 -7  13 19 o 717.9926 24.16729 100.8608       6.738697      106.1012       9.410454      95.34544       9.654130  734.0182 33.01229 694.0439 35.94092 39.97437       48.80124 
1 1 1 -7  13 20 o 334.5526 48.45122 22.88675       6.111766      23.08816       8.402455      22.66045       8.906212  328.7265 68.05891 323.8253 72.61192 4.901215       99.52138 
1 1 1 -7  13 21 o 716.0223 25.82744 100.6063       7.181844      97.09507       10.03095      104.2993       10.28722  698.6157 37.10529 724.3254 36.69067 -25.70978      52.18245 
1 1 1 -7  13 22 o 242.9535 81.85235 12.53899       9.146392      3.182341       11.19187      31.35429       15.87078  198.9807 84.12310 360.8985 106.1542 -161.9178      135.4452 
1 1 1 -7  13 23 o 478.3115 39.14195 46.07556       7.207098      46.63001       9.593822      45.35735       10.91904  474.3185 52.98824 462.2700 62.41801 12.04855       81.87650 
1 1 1 -7  13 24 o 301.9003 60.27201 19.81447       6.819068      20.56042       9.465826      19.00973       9.831821  297.0149 80.18989 284.2097 83.53878 12.80524       115.7979 
1 1 1 -7  13 25 o 510.0439 37.52904 52.94427       7.381450      47.73883       9.996803      59.18455       10.94547  471.5772 55.65857 526.7148 54.28753 -55.13763      77.74968 
1 1 1 -7  13 26 o 246.9038 100.4378 15.48886       15.11136      15.48886       15.11136      0.000000       0.000000  246.9038 100.4378 ?        ?        0.000000       100.4378 
1 1 1 -7  13 27 o 206.3698 74.45988 10.31320       7.640770      5.086221       9.261128      21.45559       13.52159  179.4745 76.23438 266.2512 98.57043 -86.77670      124.6106 
1 1 1 -7  13 28 o 185.1081 68.19806 8.268516       6.457955      3.017527       9.014323      13.80524       9.256339  163.6452 72.27976 221.9092 81.66412 -58.26401      109.0568 
1 1 1 -7  13 29 o 414.7714 48.75402 39.31147       7.703374      39.21624       13.21824      39.36044       9.479592  341.0175 95.83263 395.2699 63.93759 -54.25238      115.2038 
1 1 1 -7  13 30 o 87.36230 43.71063 -13.14487      6.224184      -15.42388      9.170973      -11.19872      8.474835  107.5359 53.69143 110.0702 54.37387 -2.534309      76.41522 
1 1 1 -7  14 1  o 391.2404 25.15873 30.06703       3.802345      24.92147       4.812543      38.61533       6.202948  353.9181 35.49239 441.0143 36.54675 -87.09622      50.94482 
1 1 1 -7  14 2  o 953.1797 17.91746 177.1051       6.632531      169.4510       8.422486      189.6000       10.76113  931.1130 23.29217 983.4323 28.17640 -52.31927      36.55728 
1 1 1 -7  14 3  o 440.2329 21.18957 37.83901       3.622703      36.16223       4.306034      41.90069       6.701818  429.0162 25.96728 459.0242 37.93484 -30.00800      45.97121 
1 1 1 -7  14 4  o 124.0646 47.26910 2.199609       3.158364      4.283523       3.722972      -3.150771      5.965436  151.9781 52.21087 124.5973 56.59962 27.38079       77.00320 
1 1 1 -7  14 5  o 289.2299 41.57821 16.89847       4.535952      16.89847       4.535952      0.000000       0.000000  289.2299 41.57821 ?        ?        0.000000       41.57821 
1 1 1 -7  14 6  f 421.6075 25.62164 34.91183       4.175221      39.34406       5.157323      26.48190       7.112552  446.7787 29.89630 360.0481 52.40463 86.73062       60.33269 
1 1 1 -7  14 7  o 245.7690 36.47766 12.15643       3.375974      17.21873       4.654699      6.537968       4.903727  291.9262 42.28890 182.5166 59.88985 109.4096       73.31538 
1 1 1 -7  14 8  o 701.5869 17.09407 95.89275       4.657522      92.17204       6.529502      99.74681       6.645491  686.6595 24.48559 714.4208 23.95218 -27.76123      34.25275 
1 1 1 -7  14 9  o 1117.470 31.26385 245.0320       13.56771      245.0320       13.56771      0.000000       0.000000  1117.470 31.26385 ?        ?        0.000000       31.26385 
1 1 1 -7  14 10 o 977.2351 18.96484 186.1268       7.197411      213.1068       13.66230      175.7629       8.467699  1041.482 33.77882 948.8152 22.98030 92.66638       40.85466 
1 1 1 -7  14 11 o 616.7057 19.72352 74.13505       4.723787      69.51934       6.770035      78.51426       6.594318  595.8283 29.25781 633.6314 26.79817 -37.80310      39.67570 
1 1 1 -7  14 12 o 443.1201 25.31331 38.48225       4.338035      42.99802       6.442688      34.73692       5.867404  466.4113 35.84311 418.8030 36.43829 47.60831       51.11240 
1 1 1 -7  14 13 o 1055.263 16.98676 216.8002       6.961444      217.6640       9.812171      215.9247       9.878098  1056.002 23.92613 1051.715 24.18507 4.286865       34.02025 
1 1 1 -7  14 14 o 241.1387 48.63713 11.92213       4.397571      18.82514       6.487032      6.052425       5.981848  302.3397 57.34705 185.0076 65.97839 117.3321       87.41757 
1 1 1 -7  14 15 o 863.7818 19.18865 145.3667       6.436894      160.4404       9.587379      132.9954       8.685573  905.9183 27.25103 824.8314 27.11473 81.08698       38.44252 
1 1 1 -7  14 16 o 493.0576 28.41390 47.73164       5.417680      45.46313       7.668205      49.99253       7.655324  478.1030 41.71736 502.0909 39.58126 -23.98785      57.50665 
1 1 1 -7  14 17 o 793.9588 21.18723 123.0071       6.532810      126.7260       9.466160      119.6252       9.027052  803.8064 30.32455 781.1066 29.75827 22.69977       42.48685 
1 1 1 -7  14 18 o 875.4211 20.86164 149.6196       7.092406      149.8731       10.11226      149.3742       9.950057  873.7053 29.80269 872.3883 29.36890 1.316956       41.84176 
1 1 1 -7  14 19 f 124.0845 55.84056 -2.346154      5.647766      -2.529999      7.754399      -2.138451      8.242194  147.0926 65.87134 153.6596 68.42571 -6.567047      94.97953 
1 1 1 -7  14 20 o 471.7467 39.80605 44.54816       7.224545      61.74265       11.39206      32.98084       9.343811  549.4522 54.08929 396.3906 62.79029 153.0616       82.87504 
1 1 1 -7  14 21 o 313.8741 54.98972 20.58875       6.458634      30.47362       8.879311      9.482982       9.411698  380.0322 62.32432 223.5353 82.33391 156.4969       103.2627 
1 1 1 -7  14 22 o 396.6008 52.85443 32.62419       7.938067      31.26642       9.067842      37.07731       16.42188  383.1193 63.14590 389.9213 105.7674 -6.802002      123.1834 
1 1 1 -7  14 23 o 279.0241 62.97786 17.01977       6.662405      14.96550       8.982647      19.53170       9.932996  256.7066 80.77424 289.8360 83.61902 -33.12939      116.2610 
1 1 1 -7  14 24 o 398.8166 47.51971 33.20333       7.215043      34.02920       9.813670      32.23179       10.64406  391.1607 67.01315 373.9337 75.88988 17.22705       101.2425 
1 1 1 -7  14 25 o 529.7936 53.82518 60.34420       10.92061      53.13012       16.46706      66.00797       14.59077  451.5986 96.80224 535.0012 72.05841 -83.40262      120.6776 
1 1 1 -7  14 26 o 482.0804 48.04865 49.83499       8.875718      55.63335       16.35130      47.41284       10.56818  451.9321 96.12096 457.5629 60.99219 -5.630829      113.8389 
1 1 1 -7  14 27 o 299.5211 58.86692 20.91754       6.603251      25.64636       9.559971      16.60304       9.131566  311.6685 78.90672 245.9849 81.77540 65.68353       113.6375 
1 1 1 -7  14 28 o 223.5517 68.48035 13.17273       6.505505      11.20708       9.572944      14.85947       8.867811  201.4355 80.64571 225.5335 80.34312 -24.09799      113.8365 
1 1 1 -7  14 29 o 119.6573 56.86287 -3.972025      7.183501      -14.24684      12.38592      1.235881       8.818054  130.4058 64.65585 147.4318 67.66654 -17.02603      93.59027 
1 1 1 -7  14 30 o 137.4878 60.78639 2.646085       6.390893      9.359818       9.527829      -2.845188      8.616849  175.9830 76.07243 129.3590 61.69870 46.62402       97.94766 
1 1 1 -7  15 1  o 590.4086 18.35684 67.91988       4.208997      65.04335       5.835676      71.03870       6.076465  576.7675 26.05328 602.7785 25.95764 -26.01105      36.77734 
1 1 1 -7  15 2  o 960.2076 15.21390 179.4621       5.673275      182.0262       6.750486      173.2953       10.46868  966.5821 17.98326 940.6921 28.65605 25.88995       33.83144 
1 1 1 -7  15 3  o 357.8686 25.83494 25.16947       3.566399      24.46275       4.270214      26.79923       6.484644  351.7301 31.59883 364.5441 46.89164 -12.81400      56.54478 
1 1 1 -7  15 4  o 441.1216 26.89896 38.20943       4.586078      33.58093       6.020704      44.60679       7.078277  411.0515 38.15074 474.0596 38.78701 -63.00812      54.40506 
1 1 1 -7  15 5  o 105.7778 47.39390 -1.677267      4.019682      -1.677267      4.019682      0.000000       0.000000  105.7778 47.39390 ?        ?        0.000000       47.39390 
1 1 1 -7  15 6  o 100.9615 44.41695 -0.8353688     3.371888      1.838475       4.801941      -3.436156      4.735886  140.2645 56.77685 107.1162 49.32021 33.14833       75.20701 
1 1 1 -7  15 7  o 537.1708 19.99771 56.25471       4.171773      61.79846       5.846083      50.50250       5.954980  562.1285 26.77943 506.7596 30.39918 55.36899       40.51232 
1 1 1 -7  15 8  o 454.8932 22.71953 40.38288       4.013625      34.00544       5.451099      47.93401       5.931532  414.7727 34.14453 493.5737 31.10384 -78.80093      46.18764 
1 1 1 -7  15 9  o 257.4408 45.16288 13.48003       4.350637      12.71923       7.358784      13.88886       5.394381  247.0911 72.17149 259.0730 55.29903 -11.98189      90.92143 
1 1 1 -7  15 10 o 368.3240 29.02984 26.70753       4.118773      23.04607       5.875718      30.24482       5.775232  338.3413 45.90265 390.1663 38.62189 -51.82498      59.98920 
1 1 1 -7  15 11 o 238.2990 45.42082 11.58433       4.049992      17.45863       5.839827      6.141014       5.621517  291.8983 53.48690 183.5422 64.09370 108.3560       83.47964 
1 1 1 -7  15 12 o 671.4483 19.73885 87.83801       5.147097      89.28066       7.447177      86.51864       7.121901  675.7316 28.37850 665.3273 27.56339 10.40430       39.56109 
1 1 1 -7  15 13 o 513.6661 35.69151 52.04023       7.075693      52.04023       7.075693      0.000000       0.000000  513.6661 35.69151 ?        ?        0.000000       35.69151 
1 1 1 -7  15 14 o 1178.662 17.42557 270.4920       7.976347      276.9648       11.60864      264.7032       10.97826  1190.948 25.09922 1164.498 24.27542 26.45007       34.91800 
1 1 1 -7  15 15 o 179.8910 58.81833 6.296627       4.731387      2.804396       7.032877      9.184021       6.394912  169.3950 68.66141 213.9411 68.24667 -44.54605      96.80907 
1 1 1 -7  15 16 o 876.1149 19.87054 149.6812       6.760812      146.7032       9.737116      152.4533       9.394547  865.2899 28.97615 882.5010 27.41149 -17.21118      39.88743 
1 1 1 -7  15 17 o 746.8920 22.51930 108.9907       6.531917      96.50933       9.169945      121.8470       9.306623  700.1584 33.72426 787.7216 30.42225 -87.56311      45.41849 
1 1 1 -7  15 18 o 816.7150 22.68759 130.4246       7.195930      134.2031       10.47041      127.0424       9.906176  825.3976 32.66425 803.3915 31.75052 22.00616       45.55270 
1 1 1 -7  15 19 o 667.0818 28.76553 87.46537       7.452114      108.3172       12.38627      75.63536       9.329545  735.4517 43.56099 615.9927 39.20319 119.4590       58.60418 
1 1 1 -7  15 20 o 626.0551 28.48371 77.09691       6.925276      73.57957       9.453121      81.17133       10.17423  606.4628 40.36744 636.6365 41.37568 -30.17365      57.80550 
1 1 1 -7  15 21 o 427.2071 48.34735 37.33697       7.880001      33.81230       8.897763      50.15406       16.96745  401.5231 58.80418 464.4131 97.19702 -62.89005      113.6010 
1 1 1 -7  15 22 o 142.9858 62.74503 -0.5794672     6.691148      1.520638       9.185829      -2.953351      9.766244  175.0953 75.18436 161.2756 72.92374 13.81967       104.7404 
1 1 1 -7  15 23 o 133.4618 60.23395 -2.166660      6.626880      0.4550672      9.077117      -5.158838      9.697233  167.1587 73.22329 151.0812 69.92016 16.07758       101.2446 
1 1 1 -7  15 24 o 174.8842 69.98659 4.913136       7.206329      -1.336541      8.787438      17.74746       12.59273  154.9760 69.70623 264.8928 95.58801 -109.9168      118.3048 
1 1 1 -7  15 25 o 475.7569 50.43185 48.63144       9.175826      29.70464       16.02786      57.85894       11.19126  312.3285 108.2721 512.4744 57.20760 -200.1460      122.4564 
1 1 1 -7  15 26 o 368.3606 50.12826 29.78294       6.984826      47.38300       9.993756      12.97511       9.766243  457.8608 57.47026 223.6250 83.57655 234.2358       101.4291 
1 1 1 -7  15 27 o 167.2539 65.53311 5.978135       6.194371      20.44072       9.187326      -6.075996      8.387531  269.2751 81.14651 127.5772 60.85533 141.6979       101.4304 
1 1 1 -7  15 28 o 353.8026 47.24046 28.40847       6.328737      39.25644       10.38091      21.99154       7.984081  382.6842 72.50418 283.0326 72.35835 99.65161       102.4333 
1 1 1 -7  15 29 o 149.2876 64.64378 4.131531       6.903850      17.24519       13.09396      -0.9177083     8.124973  207.7507 89.49300 134.3070 62.77831 73.44370       109.3166 
1 1 1 -7  16 1  o 784.5405 16.64867 119.8049       5.072510      118.4901       7.025182      121.2370       7.331866  779.3396 23.21148 788.2020 23.95240 -8.862366      33.35402 
1 1 1 -7  16 2  o 1375.830 15.68985 368.3613       8.383235      367.9742       9.838282      369.3871       16.01770  1374.539 18.43037 1373.772 30.02324 0.7677002      35.22888 
1 1 1 -7  16 3  o 1190.945 15.52750 276.0077       7.181605      273.4135       8.376970      283.2020       13.94997  1184.856 18.20512 1202.865 29.86267 -18.00891      34.97436 
1 1 1 -7  16 4  o 639.0337 21.99333 79.64005       5.458117      79.64005       5.458117      0.000000       0.000000  639.0337 21.99333 ?        ?        0.000000       21.99333 
1 1 1 -7  16 5  o 1211.496 24.10869 286.4853       11.34289      286.4853       11.34289      0.000000       0.000000  1211.496 24.10869 ?        ?        0.000000       24.10869 
1 1 1 -7  16 6  o 641.2221 19.46802 80.10773       4.847952      84.74008       5.810839      69.49970       8.793371  659.1036 22.70164 593.2056 38.37561 65.89807       44.58757 
1 1 1 -7  16 7  o 463.4948 22.43107 41.89975       4.037597      46.97321       5.754046      36.97864       5.666996  488.9222 30.45562 432.8990 33.98145 56.02322       45.63205 
1 1 1 -7  16 8  o 503.5202 24.80821 49.49138       4.851100      54.46089       8.195866      46.81148       6.018629  524.3869 40.56071 487.8365 31.94480 36.55035       51.62985 
1 1 1 -7  16 9  o 469.5837 27.58589 43.23843       5.008603      35.30982       8.514404      47.43379       6.193563  418.2174 53.66102 490.9854 32.66856 -72.76791      62.82309 
1 1 1 -7  16 10 o 911.9425 16.90119 161.8668       5.985670      163.9877       8.483814      159.7646       8.446342  916.8312 23.82724 904.9118 24.03446 11.91937       33.84365 
1 1 1 -7  16 11 o 829.7408 18.04254 134.0441       5.813907      147.5353       8.520519      122.2903       7.953001  869.3828 25.23638 791.4083 25.87631 77.97443       36.14497 
1 1 1 -7  16 12 f 868.5308 18.19764 146.8854       6.138020      140.6577       8.620634      153.2891       8.741570  848.6613 26.15633 886.0923 25.40285 -37.43097      36.46174 
1 1 1 -7  16 13 o 793.5310 19.04327 122.6636       5.868584      137.5264       8.832218      110.9145       7.852725  838.8569 27.11152 753.3851 26.83956 85.47174       38.14966 
1 1 1 -7  16 14 o 640.3987 22.22876 80.01123       5.528327      95.47919       8.395912      68.17175       7.345439  698.0199 30.97220 588.7360 32.24960 109.2839       44.71369 
1 1 1 -7  16 15 o 211.6157 58.15382 9.298913       4.926726      -1.758581      7.135931      19.37042       6.810351  145.0765 64.18221 305.3145 59.57612 -160.2380      87.57095 
1 1 1 -7  16 16 o 347.7614 40.66988 24.25474       5.388911      31.78046       8.038175      18.11086       7.262815  394.4802 53.87796 292.6567 65.53303 101.8235       84.83756 
1 1 1 -7  16 17 o 355.1260 45.41256 25.52921       6.119622      32.33008       9.876003      21.29040       7.796872  391.8466 67.32497 317.1081 65.48073 74.73843       93.91687 
1 1 1 -7  16 18 o 105.0925 50.18320 -7.238347      5.735353      -8.253738      8.145165      -6.239808      8.077291  130.1742 61.47031 136.0380 63.25309 -5.863770      88.20177 
1 1 1 -7  16 19 o 622.5242 27.82520 76.15694       6.727018      75.91251       9.744177      76.37951       9.298354  616.0137 40.96469 618.8037 38.89016 -2.789978      56.48495 
1 1 1 -7  16 20 o 976.1545 22.41942 186.6454       8.499061      182.6197       11.98894      190.7124       12.05027  961.1946 32.11747 982.5486 31.58019 -21.35400      45.04265 
1 1 1 -7  16 21 o 182.9005 72.59764 4.876522       7.692944      0.8194058      8.946468      16.38803       15.06985  170.4678 73.70166 274.4567 103.5664 -103.9889      127.1139 
1 1 1 -7  16 22 o 318.9546 60.39015 22.05299       7.206464      28.71431       9.168379      11.28469       11.65698  360.4047 67.99814 235.3136 90.53510 125.0911       113.2270 
1 1 1 -7  16 23 o 169.8173 67.85555 4.436573       6.762855      7.881474       9.018168      0.9724613E-02  10.22297  203.0508 79.20641 171.7695 76.36476 31.28123       110.0238 
1 1 1 -7  16 24 o 246.3426 76.94627 14.76261       8.168206      14.48071       15.00130      14.88141       9.738420  244.5745 99.84635 244.6715 84.42015 -0.9701538E-01 130.7519 
1 1 1 -7  16 25 o 155.0891 67.72205 1.593423       7.710183      -8.751102      14.47695      5.689398       9.109625  165.4835 79.21355 183.2268 76.58347 -17.74326      110.1808 
1 1 1 -7  16 26 o 216.4413 68.71292 11.79327       6.488569      10.61271       9.235704      12.94390       9.117875  204.8960 80.09222 219.4192 81.00053 -14.52321      113.9116 
1 1 1 -7  16 27 f 262.3278 62.39473 17.20694       6.263888      23.06180       9.289247      12.32481       8.482563  282.0265 80.71802 208.4234 77.89138 73.60304       112.1716 
1 1 1 -7  16 28 o 197.1546 68.69460 10.91058       6.455842      -0.4002382     11.88012      15.65033       7.690436  155.0592 73.52302 228.3935 75.00351 -73.33424      105.0293 
1 1 1 -7  16 29 o 136.0284 59.76343 2.597865       6.086352      14.41388       12.40658      -1.147087      6.984573  194.2456 85.33395 125.1305 58.39380 69.11513       103.4008 
1 1 1 -7  17 1  o 882.9297 19.92965 151.8300       6.833665      149.2427       7.792189      160.4483       14.22169  874.9487 22.93237 903.3936 40.53649 -28.44482      46.57360 
1 1 1 -7  17 2  o 582.9882 19.37771 66.18753       4.387228      67.82830       5.149513      61.84334       8.379108  589.8750 22.47906 559.8103 38.78046 30.06470       44.82446 
1 1 1 -7  17 3  o 683.7668 17.69732 91.00755       4.699410      91.80190       5.588485      89.08961       8.683705  686.4061 20.96452 674.4572 33.15299 11.94885       39.22540 
1 1 1 -7  17 4  o 456.9099 28.41306 40.94957       5.016726      40.94957       5.016726      0.000000       0.000000  456.9099 28.41306 ?        ?        0.000000       28.41306 
1 1 1 -7  17 5  o 544.9406 21.40014 57.87082       4.528912      59.63884       5.309132      53.14640       8.678691  552.8695 24.72709 517.5550 43.58439 35.31451       50.11016 
1 1 1 -7  17 6  o 396.5619 27.88617 30.87169       4.267325      31.91648       5.027219      28.17792       8.072218  402.4915 32.43736 372.0707 57.73606 30.42072       66.22413 
1 1 1 -7  17 7  o 1262.650 22.54987 310.8054       11.05745      316.7086       15.86309      305.2263       15.42146  1271.997 32.11247 1248.823 31.79776 23.17358       45.19191 
1 1 1 -7  17 8  o 929.2353 19.15861 168.1464       6.913814      149.9540       11.08484      179.7300       8.845156  875.1663 32.61452 959.9808 23.72548 -84.81451      40.33120 
1 1 1 -7  17 9  o 1063.955 16.49833 220.2776       6.816967      222.7830       9.561383      217.6873       9.721917  1068.909 23.03308 1056.486 23.69518 12.42273       33.04519 
1 1 1 -7  17 10 o 708.1398 19.00846 97.65426       5.227499      93.49889       7.210749      102.2575       7.589374  691.9189 26.83473 723.5747 27.00813 -31.65576      38.07285 
1 1 1 -7  17 11 o 932.7572 17.63087 169.3789       6.386609      170.2662       9.237331      168.5663       8.839832  933.8863 25.46974 929.4011 24.49136 4.485168       35.33460 
1 1 1 -7  17 12 o 896.8430 18.34673 156.6488       6.390032      157.1479       9.161891      156.1761       8.916830  896.8608 26.30462 894.2121 25.67686 2.648682       36.75914 
1 1 1 -7  17 13 o 403.5560 31.97052 32.13228       4.969497      33.49794       7.125007      30.83859       6.934716  408.8260 45.65620 391.8406 46.47738 16.98535       65.15087 
1 1 1 -7  17 14 o 896.4416 26.26275 157.2107       9.143031      0.000000       0.000000      157.2107       9.143031  ?        ?        896.4416 26.26275 0.000000       26.26275 
1 1 1 -7  17 15 o 250.9715 54.72246 13.12453       5.183215      10.07221       7.799016      15.53930       6.936844  224.7382 75.58400 270.6821 66.47424 -45.94391      100.6567 
1 1 1 -7  17 16 o 429.6062 63.45029 38.39108       10.26742      38.39108       10.26742      0.000000       0.000000  429.6062 63.45029 ?        ?        0.000000       63.45029 
1 1 1 -7  17 17 o 264.0022 58.09564 14.67585       5.794744      22.81336       8.218189      6.629522       8.172016  327.4801 66.88063 200.4414 76.11425 127.0387       101.3232 
1 1 1 -7  17 18 f 209.5607 65.81417 9.108512       5.966618      1.318844       8.529762      16.57202       8.349277  171.7981 73.07232 275.6187 75.68932 -103.8206      105.2066 
1 1 1 -7  17 19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -7  17 20 o 709.1095 32.13739 99.62082       8.850174      101.3507       10.63269      95.71927       15.96806  711.1420 38.64492 675.2289 61.57077 35.91309       72.69380 
1 1 1 -7  17 21 o 243.2002 72.97952 13.25864       7.442639      21.24840       9.501509      0.5722253      11.97279  303.2634 79.65041 189.1982 83.44676 114.0652       115.3584 
1 1 1 -7  17 22 o 210.3081 79.84064 8.937930       8.990332      8.937930       8.990332      0.000000       0.000000  210.3081 79.84064 ?        ?        0.000000       79.84064 
1 1 1 -7  17 23 o 244.0489 68.62211 13.89750       6.775548      8.193197       9.275207      20.42453       9.921561  203.0285 79.99023 285.6078 83.91046 -82.57933      115.9284 
1 1 1 -7  17 24 o 192.8462 74.36259 7.912201       7.878126      22.66518       14.43444      1.653039       9.401956  276.9315 101.9692 167.4440 73.89466 109.4875       125.9291 
1 1 1 -7  17 25 o 106.7164 51.66504 -8.213020      6.582958      -2.350689      9.179450      -14.42032      9.445674  147.4175 68.15531 118.5380 58.33518 28.87954       89.71143 
1 1 1 -7  17 26 o 198.1768 68.52617 10.06369       6.418340      15.82073       9.523200      5.272176       8.687992  231.7907 83.18596 170.8694 73.23718 60.92136       110.8314 
1 1 1 -7  17 27 o 77.72108 39.38622 -18.30542      6.012502      -13.97578      9.054766      -21.71994      8.041123  111.4913 55.27864 91.47242 46.26322 20.01888       72.08338 
1 1 1 -7  17 28 o 174.8173 80.02156 7.632453       12.21950      7.632453       12.21950      0.000000       0.000000  174.8173 80.02156 ?        ?        0.000000       80.02156 
1 1 1 -7  18 1  o 969.3625 16.58068 182.7984       6.241895      186.5615       8.712981      178.8309       8.946392  978.4663 22.92941 957.8102 24.05140 20.65607       33.22993 
1 1 1 -7  18 2  o 511.1170 24.14186 50.92966       4.792026      52.18196       6.172815      49.03026       7.602169  515.7935 30.95948 498.3007 39.61110 17.49286       50.27454 
1 1 1 -7  18 3  o 870.8060 19.61096 147.6399       6.632059      147.6399       6.632059      0.000000       0.000000  870.8060 19.61096 ?        ?        0.000000       19.61096 
1 1 1 -7  18 4  o 1059.849 19.09856 218.6787       7.860909      218.6787       7.860909      0.000000       0.000000  1059.849 19.09856 ?        ?        0.000000       19.09856 
1 1 1 -7  18 5  o 789.0177 18.01120 121.1659       5.518961      122.7346       6.509978      117.1578       10.40597  793.7636 21.11837 773.4382 34.64408 20.32538       40.57336 
1 1 1 -7  18 6  o 1217.890 16.77295 288.6059       7.933147      286.8498       9.251890      293.4824       15.41774  1213.720 19.62836 1224.709 32.41601 -10.98926      37.89552 
1 1 1 -7  18 7  o 1668.176 20.72457 542.0876       13.42626      526.7009       16.32014      574.3087       23.61684  1642.959 25.57815 1711.751 35.52656 -68.79187      43.77646 
1 1 1 -7  18 8  o 657.4850 28.00728 84.44516       7.151298      0.000000       0.000000      84.44516       7.151298  ?        ?        657.4850 28.00728 0.000000       28.00728 
1 1 1 -7  18 9  o 456.0073 30.16795 40.84533       5.312329      61.13902       9.465541      31.51419       6.418483  555.1101 44.27576 397.9057 42.17907 157.2044       61.15078 
1 1 1 -7  18 10 o 179.7295 54.94938 6.465792       4.190985      8.436174       6.002446      4.591518       5.854227  206.3294 66.15112 172.2902 64.64532 34.03926       92.49318 
1 1 1 -7  18 11 o 396.1316 30.79788 30.91617       4.700681      34.83725       6.849100      27.42450       6.463206  417.9939 42.79594 369.5521 46.03225 48.44180       62.85269 
1 1 1 -7  18 12 f 983.6091 18.08068 188.4837       6.906617      191.1827       9.952251      185.9763       9.592541  988.9134 25.91404 975.5038 25.32076 13.40955       36.23090 
1 1 1 -7  18 13 o 516.5289 26.67770 52.35085       5.333174      47.63733       7.706150      56.68366       7.388377  489.1724 40.94110 535.3781 35.74073 -46.20575      54.34679 
1 1 1 -7  18 14 o 394.8925 38.55890 31.09797       5.837868      32.30472       9.551353      30.37831       7.375984  393.6847 64.72222 386.7479 50.29986 6.936768       81.96976 
1 1 1 -7  18 15 o 190.4142 62.07590 7.227292       5.271423      13.10160       7.637216      1.882196       7.285081  248.4269 73.78721 164.8194 68.65331 83.60753       100.7860 
1 1 1 -7  18 16 o 848.6936 21.83522 140.7865       7.196750      142.0677       10.27941      139.5548       10.07903  849.6628 31.15256 842.2351 30.81466 7.427673       43.81809 
1 1 1 -7  18 17 o 205.8130 66.03439 8.690467       5.980440      17.08085       8.572594      0.7355787      8.347150  279.6559 76.65232 167.4290 71.77505 112.2269       105.0106 
1 1 1 -7  18 18 o 859.5663 23.15943 144.7588       7.730991      146.5879       10.99301      142.9689       10.87450  861.0946 32.87288 850.3729 32.92849 10.72174       46.52861 
1 1 1 -7  18 19 o 762.7177 36.39503 115.8565       10.78038      115.8565       10.78038      0.000000       0.000000  762.7177 36.39503 ?        ?        0.000000       36.39503 
1 1 1 -7  18 20 o 314.3407 67.12592 21.80058       7.945307      14.85219       9.366372      39.63063       15.00395  255.4878 82.70998 403.8035 96.91073 -148.3156      127.4073 
1 1 1 -7  18 21 o 146.9495 63.25797 0.8293136      6.533056      2.054703       9.383040      -0.3236824     9.101658  175.7146 75.72492 163.3014 72.35314 12.41318       104.7341 
1 1 1 -7  18 22 o 363.0852 48.24604 27.92040       6.634524      29.91603       9.468453      25.99552       9.299105  360.4934 70.15675 332.5212 73.92495 27.97220       101.9160 
1 1 1 -7  18 23 o 157.9474 68.24105 1.925197       7.659161      -15.03826      14.50509      8.483494       9.019010  155.6825 75.67830 200.7319 78.94386 -45.04936      109.3588 
1 1 1 -7  18 24 o 153.0428 64.30176 3.037315       6.473968      3.118804       9.214172      2.957867       9.098077  169.7743 74.08656 168.4500 73.56051 1.324326       104.4029 
1 1 1 -7  18 25 o 156.9544 63.90701 4.496253       6.125174      3.109352       8.493618      5.999074       8.841457  161.5490 70.79669 176.7275 74.74541 -15.17853      102.9517 
1 1 1 -7  18 26 o 128.3884 57.65888 0.2168300      5.986352      4.508862       8.841618      -3.416120      8.134483  164.1858 72.08535 130.6654 61.61892 33.52040       94.83243 
1 1 1 -7  18 27 f 272.1475 59.88204 18.87736       6.157137      11.12732       8.877050      26.06235       8.547321  191.4069 77.29517 302.5637 73.47512 -111.1568      106.6449 
1 1 1 -7  19 1  o 743.7247 18.28564 107.6398       5.281416      103.3257       7.173245      112.7468       7.804751  727.9326 25.37444 760.2587 26.43441 -32.32611      36.64206 
1 1 1 -7  19 2  o 819.0433 19.62824 130.5959       6.243328      131.2924       7.909474      129.4447       10.16918  820.5928 24.81944 813.6611 32.18210 6.931641       40.64101 
1 1 1 -7  19 3  o 986.3865 19.42338 189.4143       7.440462      189.4143       7.440462      0.000000       0.000000  986.3865 19.42338 ?        ?        0.000000       19.42338 
1 1 1 -7  19 4  o 681.2050 19.65951 90.35072       5.200900      89.56187       6.050835      92.58199       10.17633  677.8879 22.98420 685.9248 38.35571 -8.036865      44.71503 
1 1 1 -7  19 5  o 430.1388 31.94428 36.38681       5.298070      36.38681       5.298070      0.000000       0.000000  430.1388 31.94428 ?        ?        0.000000       31.94428 
1 1 1 -7  19 6  o 904.0242 21.41001 159.2397       7.516661      159.9224       9.647237      158.1850       11.99144  904.9607 27.45018 898.5984 34.36195 6.362244       43.98018 
1 1 1 -7  19 7  o 618.9359 27.50717 74.82827       6.611796      73.44641       8.359607      77.13685       10.80505  611.0223 35.38045 623.8138 44.90125 -12.79156      57.16553 
1 1 1 -7  19 8  f 1327.018 17.44100 342.8082       8.988273      330.4969       10.17490      386.5476       19.17855  1302.428 20.11631 1403.700 35.18144 -101.2717      40.52654 
1 1 1 -7  19 9  f 1178.348 16.90388 270.3077       7.735494      263.1758       10.63956      278.3051       11.26664  1161.291 23.59144 1194.025 24.29702 -32.73328      33.86593 
1 1 1 -7  19 10 o 504.0378 29.93237 49.93080       5.832832      38.83283       10.33233      55.12189       7.066523  434.9362 63.00579 528.6423 34.61147 -93.70605      71.88660 
1 1 1 -7  19 11 o 255.2354 49.59974 13.39011       4.739284      12.49586       6.926021      14.17750       6.499054  244.1468 69.63670 259.6244 64.69283 -15.47766      95.04963 
1 1 1 -7  19 12 o 429.1738 34.79986 36.48331       5.750200      41.03116       9.931669      34.19009       7.052479  447.7511 58.51570 412.7206 44.71564 35.03052       73.64494 
1 1 1 -7  19 13 o 335.3135 45.97584 22.77345       5.829355      24.95307       10.09111      21.68181       7.141464  340.0598 78.06209 322.8807 59.13221 17.17905       97.93012 
1 1 1 -7  19 14 o 168.2299 62.04486 4.753450       5.347187      -2.766941      7.650792      11.93482       7.476355  145.3341 65.23229 238.4725 73.47284 -93.13841      98.25227 
1 1 1 -7  19 15 o 574.5631 27.89635 64.79011       6.224623      67.88920       8.935384      61.86818       8.676228  583.7375 39.65065 556.8673 40.39387 26.87024       56.60246 
1 1 1 -7  19 16 o 1322.585 19.15848 341.5341       9.840397      347.7766       14.16828      335.7167       13.67754  1330.799 27.41427 1307.776 26.93063 23.02246       38.42916 
1 1 1 -7  19 17 o 285.3060 56.85169 17.16725       6.077988      17.97084       8.709292      16.40429       8.486197  285.2688 76.87673 272.9432 76.81569 12.32559       108.6770 
1 1 1 -7  19 18 o 627.9448 32.12722 78.29150       7.808472      91.95618       9.843139      55.09330       12.82510  678.0042 37.52905 508.0583 66.60534 169.9460       76.45065 
1 1 1 -7  19 19 o 362.7666 54.52252 27.76630       7.443645      28.68507       8.998061      25.77439       13.24883  362.2406 66.40960 324.2723 97.38441 37.96832       117.8726 
1 1 1 -7  19 20 o 264.7859 62.70453 15.57791       6.348423      24.99829       9.347319      7.511940       8.649306  329.5597 74.75222 200.8695 77.78785 128.6901       107.8835 
1 1 1 -7  19 21 o 154.9627 64.04394 2.819741       6.268911      8.608030       9.214325      -2.168257      8.553652  206.5703 80.20650 149.6272 67.89461 56.94310       105.0845 
1 1 1 -7  19 22 o 131.2971 59.50003 -1.782778      6.543295      -12.22807      9.453663      7.822907       9.065754  125.9594 61.19874 197.7416 78.70802 -71.78219      99.70074 
1 1 1 -7  19 23 o 118.1875 56.56503 -7.246413      7.375527      1.885327       13.01608      -11.56525      8.951314  184.3011 83.67612 121.3913 59.10914 62.90983       102.4480 
1 1 1 -7  19 24 o 608.6877 29.39624 75.33852       6.948871      77.26704       9.852953      73.43004       9.801621  600.7916 42.50369 584.3569 43.50246 16.43463       60.81964 
1 1 1 -7  19 25 o 156.8529 63.42515 4.978532       5.985592      -2.103841      8.550745      11.78348       8.381601  138.6445 64.66995 204.8603 77.25351 -66.21582      100.7487 
1 1 1 -7  19 26 o 170.1571 64.52924 7.330697       5.868814      15.40259       8.504338      -0.8644450E-02 8.109261  222.2979 78.73381 139.7498 64.41660 82.54811       101.7276 
1 1 1 -7  20 1  f 524.8676 22.82772 53.69135       4.653078      58.46694       6.491617      48.64511       6.673023  546.0458 30.73731 497.1996 34.77824 48.84613       46.41453 
1 1 1 -7  20 2  o 159.9028 60.45933 3.766662       5.142139      2.899433       5.679891      7.706975       12.10705  158.1665 62.50650 234.9869 91.74360 -76.82039      111.0133 
1 1 1 -7  20 3  o 789.7992 18.30807 121.4285       5.615486      122.5373       6.644945      118.6584       10.50319  793.0106 21.57667 778.2047 34.75356 14.80585       40.90676 
1 1 1 -7  20 4  o 347.6985 32.02596 23.85772       4.275859      24.94455       5.078812      21.21233       7.923668  354.5781 37.44926 319.6936 66.00792 34.88446       75.89132 
1 1 1 -7  20 5  o 927.2538 17.76088 167.3824       6.395746      169.7676       7.483628      160.9208       12.31765  933.4170 20.64470 905.8347 35.01473 27.58228       40.64769 
1 1 1 -7  20 6  o 586.7656 35.65347 67.82164       8.085959      67.82164       8.085959      0.000000       0.000000  586.7656 35.65347 ?        ?        0.000000       35.65347 
1 1 1 -7  20 7  o 681.2193 22.11895 90.50956       5.851665      87.71969       6.684405      99.66065       12.10617  670.1227 25.68505 708.8584 44.19647 -38.73572      51.11800 
1 1 1 -7  20 8  o 810.2529 20.10299 127.9753       6.325709      123.2129       7.306064      142.2350       12.64226  794.4372 23.68077 849.8804 38.30355 -55.44324      45.03267 
1 1 1 -7  20 9  o 486.9742 30.31614 46.65594       5.704906      50.53352       6.923553      38.45564       10.06846  505.6942 35.47900 432.8649 61.63468 72.82922       71.11676 
1 1 1 -7  20 10 o 316.6602 39.96390 20.10527       4.805171      16.32084       6.612533      24.33970       6.994630  278.8976 62.58873 344.8712 53.99697 -65.97366      82.66210 
1 1 1 -7  20 11 o 249.3992 58.62839 13.03179       5.582726      13.51290       9.143048      12.74578       7.049425  254.7550 81.63936 245.8359 70.30143 8.919128       107.7371 
1 1 1 -7  20 12 o 273.7703 58.61240 15.69024       6.043644      29.62067       11.48473      10.35524       7.107322  369.3552 82.18503 224.8148 71.97232 144.5404       109.2447 
1 1 1 -7  20 13 o 424.3831 34.55775 35.73523       5.646034      25.91708       8.035003      45.31129       7.935326  352.6499 60.86966 475.4516 43.45696 -122.8016      74.79052 
1 1 1 -7  20 14 o 322.9745 44.75459 21.17714       5.462638      25.08365       7.819063      17.45248       7.634903  346.4753 60.30083 285.0309 69.58124 61.44449       92.07464 
1 1 1 -7  20 15 o 297.9334 53.33624 18.45577       5.944594      20.54506       8.636495      16.57475       8.194741  307.3108 73.37830 275.7896 74.67590 31.52121       104.6941 
1 1 1 -7  20 16 f 228.0186 68.69944 11.11914       6.585505      17.10366       8.307073      0.9960217      10.80414  278.6070 75.08018 187.1171 80.94629 91.48991       110.4053 
1 1 1 -7  20 17 o 864.6487 23.50644 146.7658       7.893226      168.9577       11.59331      127.5898       10.77678  923.2526 32.33397 801.1005 34.63968 122.1521       47.38558 
1 1 1 -7  20 18 o 144.8564 64.15605 -1.009688      7.149450      -4.720518      8.688137      6.773850       12.58287  144.5848 66.65605 217.9554 90.45930 -73.37059      112.3651 
1 1 1 -7  20 19 o 442.7436 44.52095 40.44986       7.551212      46.39721       9.252021      28.58376       13.06860  469.9008 51.54570 336.8961 95.50478 133.0046       108.5271 
1 1 1 -7  20 20 f 319.4084 53.33889 22.02795       6.383022      24.53409       9.187790      19.68992       8.874283  322.8156 74.75848 286.3699 77.78146 36.44571       107.8832 
1 1 1 -7  20 21 o 244.7253 65.46341 13.97505       6.343104      14.07389       9.034923      13.87898       8.907444  238.6269 81.34734 237.3628 80.77212 1.264130       114.6365 
1 1 1 -7  20 22 o 216.2277 73.41368 11.45270       7.358250      11.83676       13.94452      11.30449       8.662439  223.2248 94.11047 214.7115 79.00301 8.513367       122.8750 
1 1 1 -7  20 23 o 209.2660 66.67101 10.85519       6.104511      4.582544       8.630456      17.13547       8.635710  170.8745 73.11021 251.0971 79.22353 -80.22258      107.8029 
1 1 1 -7  20 24 o 174.8844 65.72013 7.310776       6.055062      7.545516       8.383497      7.054777       8.754872  180.4337 74.26324 178.6315 74.90009 1.802170       105.4754 
1 1 1 -7  20 25 o 99.81301 48.27692 -6.304711      5.713706      -2.992208      8.054163      -9.660731      8.106895  130.1519 61.35758 112.7927 55.20732 17.35915       82.53848 
1 1 1 -7  21 1  o 776.6171 23.53689 117.6521       7.098783      114.7986       8.001024      128.2066       15.38801  766.6103 26.87466 802.9886 49.58789 -36.37836      56.40218 
1 1 1 -7  21 2  o 810.3613 23.21417 128.0953       7.305666      120.5143       8.155398      158.8934       16.43782  785.4337 26.73669 894.9083 47.46717 -109.4745      54.47919 
1 1 1 -7  21 3  o 530.1826 23.50937 54.84483       4.840547      53.01867       5.769091      59.18819       8.897136  519.8989 28.68429 546.3061 42.26475 -26.40717      51.07933 
1 1 1 -7  21 4  o 579.2258 22.55650 65.44543       5.073967      67.39388       5.997941      60.54195       9.514999  587.3041 26.29730 551.6964 44.79684 35.60767       51.94521 
1 1 1 -7  21 5  o 246.9572 58.25580 12.68618       5.496664      20.67989       7.344819      2.509814       8.287118  315.6805 62.12314 178.7779 73.73814 136.9026       96.41887 
1 1 1 -7  21 6  o 144.3934 59.81310 1.332215       5.486122      -5.022737      7.198328      10.13896       8.473898  132.0478 60.80165 229.1551 78.76684 -97.10733      99.50404 
1 1 1 -7  21 7  o 353.5729 36.86559 24.86676       4.987627      32.00920       5.853837      5.946641       9.527503  401.3410 38.01069 207.0875 81.23592 194.2535       89.68884 
1 1 1 -7  21 8  o 565.9463 33.46862 63.15232       7.323282      63.15232       7.323282      0.000000       0.000000  565.9463 33.46862 ?        ?        0.000000       33.46862 
1 1 1 -7  21 9  f 786.7464 27.81081 121.2344       8.497211      126.5775       11.59903      115.0454       12.48338  801.1507 37.28032 760.9608 42.41035 40.18988       56.46645 
1 1 1 -7  21 10 o 1233.552 20.66020 296.9521       9.897367      298.5562       12.06466      293.6507       17.30772  1235.395 25.14671 1220.219 36.52365 15.17603       44.34337 
1 1 1 -7  21 11 f 831.7446 20.66964 135.0422       6.676532      134.3596       9.245509      135.7861       9.651666  827.6021 28.76612 831.6501 29.88365 -4.047974      41.47918 
1 1 1 -7  21 12 o 822.9359 20.93162 132.2621       6.689550      126.5708       9.231720      138.5546       9.707075  802.7266 29.61331 839.8200 29.76283 -37.09344      41.98540 
1 1 1 -7  21 13 o 554.9681 28.44597 60.65038       6.110191      50.65011       8.520978      71.23519       8.766480  501.9932 44.15753 598.4292 37.91706 -96.43604      58.20301 
1 1 1 -7  21 14 o 238.3554 69.25725 12.17656       6.792300      10.29799       12.75488      12.92017       8.024796  242.7965 94.33994 245.4371 76.20313 -2.640579      121.2722 
1 1 1 -7  21 15 o 728.5650 27.63616 104.4805       7.819410      95.89349       9.374622      124.1153       14.17569  695.2758 34.71912 783.0217 46.83158 -87.74597      58.29763 
1 1 1 -7  21 16 o 112.6897 52.72206 -4.950797      5.752908      -1.862074      8.321316      -7.778707      7.962240  153.0888 68.41933 128.0817 60.57215 25.00711       91.37937 
1 1 1 -7  21 17 o 297.4044 76.53894 20.27012       8.891851      20.27012       8.891851      0.000000       0.000000  297.4044 76.53894 ?        ?        0.000000       76.53894 
1 1 1 -7  21 18 o 235.3519 72.42720 12.61280       7.267468      20.88850       9.120422      -1.781258      12.02830  298.2946 77.88818 178.6387 80.83811 119.6559       112.2558 
1 1 1 -7  21 19 o 161.7872 64.56245 4.019637       6.114344      15.05896       9.262401      -4.506161      8.139916  249.6248 82.32920 137.4282 63.76312 112.1966       104.1337 
1 1 1 -7  21 20 o 505.2126 46.05128 53.83298       8.936070      0.000000       0.000000      53.83298       8.936070  ?        ?        505.2126 46.05128 0.000000       46.05128 
1 1 1 -7  21 21 o 119.5299 56.82405 -6.284371      7.187018      1.815016       13.16915      -9.719934      8.576902  185.5755 84.22084 122.8221 59.34372 62.75340       103.0283 
1 1 1 -7  21 22 o 166.7759 68.42284 5.055102       7.088481      -1.934366      12.45127      8.406610       8.622077  166.4677 77.77876 191.6700 76.60665 -25.20221      109.1701 
1 1 1 -7  21 23 o 225.8340 64.85659 12.97940       5.987883      17.31739       8.448509      8.600843       8.487919  247.1432 78.40122 187.3028 75.60161 59.84039       108.9144 
1 1 1 -7  21 24 o 91.91496 45.10270 -8.438618      5.516835      -8.361583      7.791314      -8.516077      7.812696  113.7001 55.31530 113.4992 55.25657 0.2008667      78.18613 
1 1 1 -7  22 1  o 413.5234 36.67321 33.87050       5.828376      31.59245       6.445565      44.08591       13.64921  397.9402 42.35876 457.7350 79.67750 -59.79474      90.23729 
1 1 1 -7  22 2  o 848.9586 19.35971 140.4447       6.382832      143.8966       8.910565      136.8067       9.147470  857.9555 26.74315 836.2461 28.16689 21.70941       38.84031 
1 1 1 -7  22 3  o 1011.684 19.95024 199.5071       7.838283      203.7370       9.984025      192.7116       12.65481  1021.191 25.17506 991.0446 32.88021 30.14673       41.41125 
1 1 1 -7  22 4  o 772.3933 24.53909 116.5396       7.360800      125.8334       9.810173      104.5669       11.13466  801.0459 31.53489 727.1518 39.57875 73.89410       50.60559 
1 1 1 -7  22 5  o 1046.690 21.77200 213.7698       8.850027      214.8236       11.46154      212.2137       13.92740  1047.555 28.17332 1039.068 34.51423 8.487305       44.55297 
1 1 1 -7  22 6  o 1178.408 17.92090 270.5637       8.201317      273.8878       9.626292      261.7625       15.66363  1184.894 20.91951 1153.589 34.96337 31.30469       40.74387 
1 1 1 -7  22 7  o 249.6685 56.31385 12.99152       5.330105      15.91405       6.514280      7.071801       9.271242  275.3441 62.36710 211.6678 80.90573 63.67627       102.1538 
1 1 1 -7  22 8  o 323.2949 50.21910 21.32912       6.100561      19.16231       7.859186      24.61391       9.676581  300.5596 68.81505 339.1975 75.41138 -38.63794      102.0901 
1 1 1 -7  22 9  o 562.0378 27.50998 61.89947       6.004596      68.94749       7.135329      44.79610       11.11530  591.6229 31.16562 465.6287 63.09357 125.9942       70.37112 
1 1 1 -7  22 10 o 483.5558 36.36866 46.42273       6.779685      46.42273       6.779685      0.000000       0.000000  483.5558 36.36866 ?        ?        0.000000       36.36866 
1 1 1 -7  22 11 o 440.4470 37.93913 38.68568       6.426147      31.76225       7.763490      53.75204       11.45250  394.1211 51.99146 511.1879 58.75723 -117.0668      78.45715 
1 1 1 -7  22 12 o 660.4528 24.57043 85.47412       6.302061      87.66058       8.854660      83.22962       8.971408  665.1215 34.39784 647.5031 35.81639 17.61835       49.65909 
1 1 1 -7  22 13 o 290.5701 59.25645 17.90378       6.460099      24.28422       8.059192      6.435196       10.80491  337.6451 63.79945 212.6668 85.48833 124.9783       106.6706 
1 1 1 -7  22 14 o 558.0021 28.73042 61.57027       6.204822      74.70747       8.768627      48.39516       8.781273  611.2249 37.11619 487.0610 47.00839 124.1639       59.89491 
1 1 1 -7  22 15 o 129.0609 59.35037 -3.959197      6.829049      -26.71211      13.27511      4.228796       7.963578  135.2219 67.02444 180.0092 73.02859 -44.78732      99.12341 
1 1 1 -7  22 16 o 317.6057 62.29818 22.03906       7.409545      6.937095       15.20670      26.74081       8.484929  228.2215 97.33066 349.0375 64.98764 -120.8161      117.0327 
1 1 1 -7  22 17 o 449.0118 42.79456 41.51443       7.372017      37.81414       8.960735      49.26444       12.96812  419.8537 56.38110 465.0412 74.30698 -45.18756      93.27570 
1 1 1 -7  22 18 o 210.5608 67.43160 10.03661       6.238415      11.30612       8.617435      8.638673       9.042832  222.2274 79.19702 205.7044 79.57199 16.52307       112.2670 
1 1 1 -7  22 19 o 366.7316 44.57763 28.39817       6.218266      31.68591       8.653889      24.88861       8.941051  374.9131 61.57470 322.2048 73.12852 52.70828       95.59929 
1 1 1 -7  22 20 o 277.1089 58.18875 17.58271       6.062726      19.31025       8.331603      15.63842       8.838842  276.6121 75.46355 245.2342 80.40279 31.37790       110.2695 
1 1 1 -7  22 21 f 146.6120 63.48613 1.961326       6.658982      -12.29555      10.35113      12.02724       8.697658  129.0090 62.98140 214.3268 79.11369 -85.31772      101.1219 
1 1 1 -7  22 22 o 220.8952 65.58669 12.46070       6.034778      10.10157       8.345005      15.04692       8.737444  196.6182 76.33291 229.1252 79.91217 -32.50694      110.5109 
1 1 1 -7  22 23 o 116.3501 53.87054 -1.974436      5.765717      -7.790720      7.979959      4.378304       8.339853  116.9213 56.67294 161.2183 70.41486 -44.29707      90.38847 
1 1 1 -7  23 1  f 179.7443 58.00921 6.347159       4.610031      14.95796       6.290277      -3.644547      6.775912  267.4619 61.80083 132.7124 60.29990 134.7495       86.34477 
1 1 1 -7  23 2  o 400.9218 32.88794 31.75924       5.075546      27.74122       6.909644      36.46804       7.480055  370.4346 49.25117 426.5281 45.87888 -56.09357      67.30936 
1 1 1 -7  23 3  f 498.0175 26.33167 48.64103       5.074636      55.35208       6.047116      32.66215       9.330954  530.7154 29.45562 397.9219 62.43585 132.7935       69.03528 
1 1 1 -7  23 4  o 346.8357 44.99522 24.23650       5.917828      27.77929       8.131440      20.24702       8.628834  367.3345 58.99734 308.3984 73.15204 58.93607       93.97823 
1 1 1 -7  23 5  o 436.6936 36.78005 37.84156       6.179521      44.01355       8.390905      30.52684       9.134722  468.2629 46.76696 383.5455 63.55195 84.71747       78.90500 
1 1 1 -7  23 6  o 392.9911 43.29045 30.98625       6.497382      25.48902       8.945464      37.12482       9.452889  347.6073 68.70085 425.2626 58.81140 -77.65524      90.43555 
1 1 1 -7  23 7  o 799.4689 25.72556 125.1129       7.987195      118.2746       10.32083      135.3240       12.61165  774.8991 34.29584 827.0500 39.26558 -52.15094      52.13435 
1 1 1 -7  23 8  o 535.6932 32.38679 56.67693       6.706028      53.46620       8.455322      62.12111       11.01020  517.1049 42.47947 553.9095 51.78412 -36.80463      66.97836 
1 1 1 -7  23 9  o 609.0532 25.89094 72.69849       6.123942      78.95670       7.319611      58.09735       11.18038  633.7962 29.73790 533.5837 54.72895 100.2125       62.28644 
1 1 1 -7  23 10 o 146.7253 59.87995 2.018118       5.393189      2.502721       6.411347      0.8453457      9.973853  159.8279 65.26453 181.4154 78.12746 -21.58755      101.8006 
1 1 1 -7  23 11 f 237.3367 62.79235 12.06850       5.877224      19.11634       6.785252      -9.104522      11.76060  300.1918 60.29572 160.7181 75.25231 139.4738       96.42865 
1 1 1 -7  23 12 o 308.5935 66.14647 20.61734       7.689004      20.61734       7.689004      0.000000       0.000000  308.5935 66.14647 ?        ?        0.000000       66.14647 
1 1 1 -7  23 13 o 230.2369 61.79617 11.49687       5.640996      -3.128711      7.915735      26.58857       8.040885  143.9753 65.32379 352.7462 60.89788 -208.7709      89.30705 
1 1 1 -7  23 14 o 120.1956 54.72688 -2.697206      5.618503      -0.6396697     8.046266      -4.655059      7.848935  154.8706 68.35216 136.6910 63.13517 18.17960       93.04874 
1 1 1 -7  23 15 o 255.5385 58.32496 14.28491       5.660576      18.28702       8.073532      10.41537       7.938699  282.3342 73.06919 218.8613 76.18106 63.47282       105.5588 
1 1 1 -7  23 16 o 282.2554 63.06863 17.83836       6.739148      22.27326       8.247630      8.929008       11.68988  311.9412 69.82268 218.4410 88.52877 93.50014       112.7499 
1 1 1 -7  23 17 o 365.1391 65.77560 30.24081       8.984138      39.03396       13.77256      23.72759       11.85332  389.6961 92.40649 300.9021 92.48061 88.79407       130.7349 
1 1 1 -7  23 18 o 459.6795 35.73796 43.30663       6.329736      47.67696       9.286315      39.51414       8.650647  469.4348 51.80051 425.5887 53.52350 43.84619       74.48528 
1 1 1 -7  23 19 o 236.0110 62.53050 13.19239       5.822953      17.19066       7.928460      8.510144       8.579860  260.6716 74.55996 195.9530 77.01913 64.71861       107.1967 
1 1 1 -7  23 20 o 91.74615 45.54843 -12.60562      6.226694      -10.19752      9.234326      -14.61345      8.432014  124.9245 60.64714 108.9748 53.90755 15.94971       81.14246 
1 1 1 -7  23 21 o 96.28682 46.87659 -7.677834      5.622536      -11.01624      7.573694      -3.578985      8.392066  107.4390 52.74569 134.0614 63.02477 -26.62248      82.18411 
1 1 1 -7  23 22 o 210.2600 64.23761 11.51809       5.728730      0.9465014      7.968466      22.82719       8.241737  144.9416 65.67408 288.3372 73.40954 -143.3956      98.49896 
1 1 1 -7  24 1  o 131.9966 55.14569 0.8757581      4.720354      2.893903       6.365058      -1.590631      7.036506  163.2705 65.62040 144.6037 63.86515 18.66681       91.56853 
1 1 1 -7  24 2  o 734.2294 21.68046 105.2512       6.181991      107.7909       8.542149      102.4581       8.957977  741.2794 29.67271 722.1296 31.94235 19.14978       43.59797 
1 1 1 -7  24 3  o 941.9119 28.25928 173.9202       10.33711      152.7995       15.82826      189.6280       13.65016  874.5498 46.77322 980.7068 35.84020 -106.1570      58.92583 
1 1 1 -7  24 4  o 504.0333 53.79718 51.61094       10.36775      0.000000       0.000000      51.61094       10.36775  ?        ?        504.0333 53.79718 0.000000       53.79718 
1 1 1 -7  24 5  o 708.2561 25.49563 98.22803       7.012681      99.18967       8.916935      96.66904       11.35362  709.9034 32.34360 696.3754 42.18095 13.52795       53.15393 
1 1 1 -7  24 6  o 583.6490 25.52179 66.73701       5.784833      69.88270       6.921545      59.44872       10.53557  595.5072 30.02536 541.7406 50.66536 53.76660       58.89398 
1 1 1 -7  24 7  o 158.7623 60.20033 3.913861       5.107404      -1.630544      5.962385      19.19514       9.898568  131.3654 58.36467 295.0243 82.93818 -163.6589      101.4159 
1 1 1 -7  24 8  o 83.15073 41.24496 -11.70537      5.062121      -13.51757      6.052782      -7.487995      9.233628  91.71410 45.42310 143.1994 66.93135 -51.48530      80.88921 
1 1 1 -7  24 9  o 395.4113 37.02203 31.32226       5.618910      31.90761       6.711090      29.94991       10.27582  396.5393 44.33810 370.6068 73.98738 25.93246       86.25543 
1 1 1 -7  24 10 o 140.6028 58.70237 1.335787       5.343866      4.091441       6.372520      -5.193611      9.809242  168.8983 66.37928 154.8729 71.18744 14.02542       97.33376 
1 1 1 -7  24 11 o 319.0389 48.01467 21.09236       5.764666      27.88332       6.797848      3.705302       10.87724  367.2502 48.87676 197.1062 83.10954 170.1440       96.41646 
1 1 1 -7  24 12 o 213.0838 64.40035 9.843817       5.780458      12.10138       6.821052      4.091252       10.88834  233.9296 69.79061 197.4443 83.19666 36.48526       108.5929 
1 1 1 -7  24 13 o 261.1300 61.92096 15.02938       6.184171      13.43196       7.473672      18.49815       11.01320  243.5177 73.14433 277.9040 89.65772 -34.38635      115.7091 
1 1 1 -7  24 14 o 469.6516 33.53068 44.39520       6.075501      49.97744       8.485611      38.52381       8.702611  491.7627 44.92867 425.7581 53.83625 66.00467       70.12081 
1 1 1 -7  24 15 o 128.6789 56.69250 -0.4366264     5.511382      -0.7020652E-01 7.813090      -0.7995371     7.775588  152.3600 67.29366 148.7826 66.34197 3.577393       94.49706 
1 1 1 -7  24 16 o 188.2179 68.50181 7.514781       6.487222      11.80879       8.031595      -0.5445089     11.00320  223.5387 76.69237 171.5374 77.49852 52.00133       109.0309 
1 1 1 -7  24 17 o 256.3958 58.71940 15.01675       5.721037      6.800447       8.266788      22.56872       7.925535  187.1418 74.93551 308.6960 67.95141 -121.5543      101.1569 
1 1 1 -7  24 18 o 291.1657 54.03772 19.11053       5.885371      22.42955       8.012041      15.22078       8.673611  302.6684 69.61405 240.4543 79.68707 62.21408       105.8118 
1 1 1 -7  24 19 o 136.5938 60.36253 0.6798935      6.294780      14.62486       9.614207      -9.783509      8.328011  228.3953 83.35198 118.1710 57.42045 110.2243       101.2159 
1 1 1 -7  24 20 f 180.6628 67.01337 7.958491       6.255643      0.5034372      9.038779      14.81222       8.666585  151.9299 69.26793 227.2534 79.56898 -75.32353      105.4954 
1 1 1 -7  24 21 o 150.9781 60.29374 4.657896       5.336223      10.09525       6.892821      -3.475775      8.430367  193.8130 70.59971 132.5450 62.57372 61.26801       94.33869 
1 1 1 -7  25 1  o 512.7321 27.25561 51.72238       5.407690      50.97306       7.324956      52.62000       8.017079  506.0535 37.53940 513.1719 40.55825 -7.118408      55.26462 
1 1 1 -7  25 2  o 386.5068 53.67990 30.70536       7.839900      0.000000       0.000000      30.70536       7.839900  ?        ?        386.5068 53.67990 0.000000       53.67990 
1 1 1 -7  25 3  o 575.7892 39.05081 66.11592       8.680529      64.30962       14.84430      67.05458       10.70088  551.7500 70.91878 575.9310 48.28898 -24.18103      85.79801 
1 1 1 -7  25 4  o 536.3348 27.05604 56.62777       5.617274      59.60506       6.670595      49.36945       10.41530  549.0032 31.41730 489.8926 55.73703 59.11057       63.98175 
1 1 1 -7  25 5  o 406.3091 34.11790 32.87878       5.333688      32.60408       6.297562      33.57581       10.03175  402.4385 40.86109 397.0464 67.47354 5.392120       78.88161 
1 1 1 -7  25 6  o 384.9646 35.78435 29.64518       5.288620      27.78266       6.283514      34.16993       9.793770  369.5607 44.68922 401.0945 65.10704 -31.53378      78.96869 
1 1 1 -7  25 7  f 284.4852 53.24398 16.98756       5.666233      24.28300       7.130662      4.488795       9.333352  340.3194 55.89398 192.5767 78.70326 147.7427       96.53155 
1 1 1 -7  25 8  o 167.3391 60.80375 5.075536       5.108109      13.27262       6.187744      -12.46263      9.050958  247.1220 63.97509 126.4880 61.07804 120.6340       88.44964 
1 1 1 -7  25 9  o 489.3439 30.92300 47.61823       5.846344      48.52140       6.868355      45.24261       11.13926  491.8542 36.21208 459.7924 64.12871 32.06177       73.64649 
1 1 1 -7  25 10 o 559.3480 28.31337 62.02937       6.130343      73.38917       7.351035      36.08758       11.10870  607.1796 31.28107 402.1888 73.84341 204.9908       80.19572 
1 1 1 -7  25 11 o 492.1516 32.31031 48.46402       6.141143      46.70555       7.189211      53.21086       11.81177  479.9373 38.90653 496.6870 62.62791 -16.74963      73.72905 
1 1 1 -7  25 12 o 185.0647 65.34932 6.988135       5.854443      4.977430       6.886097      12.23135       11.11982  175.0203 68.93306 236.2296 89.00475 -61.20924      112.5771 
1 1 1 -7  25 13 o 168.7277 64.63366 5.068110       5.924980      5.925478       7.000175      2.902314       11.12588  180.8897 69.99992 188.3563 81.81190 -7.466568      107.6716 
1 1 1 -7  25 14 o 828.9985 32.63048 138.3272       10.50522      0.000000       0.000000      138.3272       10.50522  ?        ?        828.9985 32.63048 0.000000       32.63048 
1 1 1 -7  25 15 o 197.6914 69.09647 8.821814       6.534026      4.528679       8.119756      16.70964       11.00612  174.7510 72.60873 252.7896 89.56528 -78.03862      115.2995 
1 1 1 -7  25 16 o 105.2051 50.08649 -5.580749      5.624213      -3.611054      7.774781      -7.742955      8.145864  133.9763 62.21549 124.2752 59.46996 9.701042       86.06651 
1 1 1 -7  25 17 o 430.3914 35.09776 38.38252       5.815310      31.84029       7.944829      45.93287       8.535033  374.0684 56.44590 458.3193 48.69830 -84.25089      74.54974 
1 1 1 -7  25 18 o 475.6104 32.60706 46.73451       5.986334      44.35331       8.075710      49.63889       8.918855  449.2279 46.98507 472.6924 49.31095 -23.46454      68.11143 
1 1 1 -7  25 19 o 166.6459 65.53223 6.137549       6.214314      1.953130       9.626016      9.127651       8.137145  159.8897 72.33849 189.6194 74.85387 -29.72972      104.0959 
1 1 1 -7  26 1  o 480.5412 32.00623 45.84020       5.938840      50.48133       9.288437      42.63089       7.723904  497.4949 48.70028 458.9488 43.86998 38.54605       65.54610 
1 1 1 -7  26 2  f 417.0605 82.43457 38.82347       12.87840      38.82347       12.87840      0.000000       0.000000  417.0605 82.43457 ?        ?        0.000000       82.43457 
1 1 1 -7  26 3  o 706.9535 25.48327 98.21939       6.996390      97.07649       8.684815      100.3324       11.80875  700.4500 31.92681 705.4205 43.31456 -4.970459      53.80959 
1 1 1 -7  26 4  o 461.4941 30.17018 42.25292       5.377434      42.17612       6.308908      42.45693       10.28264  459.1533 35.66063 448.7973 60.54148 10.35602       70.26344 
1 1 1 -7  26 5  o 444.1808 31.63442 39.27211       5.421264      38.95667       6.392768      40.07986       10.22982  440.1127 37.76810 434.1081 62.47948 6.004547       73.00764 
1 1 1 -7  26 6  o 158.9650 60.43115 4.122509       5.154911      3.776055       6.074165      5.014394       9.745812  163.4372 64.62366 196.0555 80.30844 -32.61830      103.0809 
1 1 1 -7  26 7  o 374.9272 36.87189 28.38080       5.299281      34.90690       6.331778      13.11991       9.682524  414.9030 39.78406 243.7622 84.17348 171.1409       93.10181 
1 1 1 -7  26 8  o 342.7542 41.59196 24.06534       5.422903      22.38128       6.473657      28.02718       9.929335  325.2303 53.08603 351.7872 74.97214 -26.55682      91.86375 
1 1 1 -7  26 9  o 750.8130 23.20481 111.0002       6.766090      121.4600       8.135028      87.52551       12.18697  783.6180 26.73170 650.1352 48.62049 133.4828       55.48456 
1 1 1 -7  26 10 o 194.8748 64.52235 8.158298       5.686973      6.694922       6.582081      12.46784       11.29538  185.5484 68.75665 237.5525 89.65786 -52.00406      112.9868 
1 1 1 -7  26 11 o 211.4039 64.21957 10.01089       5.737337      10.33513       6.646661      9.063120       11.36382  214.2905 69.69695 217.3037 87.55897 -3.013184      111.9117 
1 1 1 -7  26 12 o 114.3306 53.19952 -3.911340      5.730768      -3.482261      6.631614      -5.176688      11.38822  126.0295 58.14843 160.5325 74.79678 -34.50302      94.74069 
1 1 1 -7  26 13 o 217.5982 66.28620 11.02012       6.106323      7.736183       7.140974      19.95384       11.77814  191.1412 71.46013 272.5912 92.87964 -81.45003      117.1886 
1 1 1 -7  26 14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -7  26 15 o 183.1293 67.20893 7.527769       6.263374      7.323203       7.830909      7.891007       10.43495  185.8010 73.40472 196.5153 82.03673 -10.71425      110.0830 
1 1 1 -7  26 16 f 191.5747 63.64881 8.805472       5.532283      26.17911       7.923883      -7.717559      7.727474  330.2876 64.08756 118.5890 57.05413 211.6985       85.80437 
1 1 1 -7  26 17 o 92.87424 45.78502 -10.30215      5.903366      -4.821742      7.505418      -19.19307      9.559642  123.9328 58.66975 109.3854 54.64523 14.54742       80.17631 
1 1 1 -7  26 18 o 124.9040 56.73355 -0.7761518     5.991889      -2.377844      9.397559      0.3210365      7.777967  143.7520 67.29570 143.0636 64.84825 0.6883392      93.45592 
1 1 1 -7  27 1  o 421.1379 46.82612 36.46144       7.528772      22.79506       12.65081      43.95602       9.368392  308.0718 95.68334 459.0984 53.55127 -151.0266      109.6496 
1 1 1 -7  27 2  o 824.3561 21.49618 133.3201       6.881834      132.5916       9.434865      134.1482       10.05995  818.3098 29.68862 822.0943 31.50983 -3.784546      43.29299 
1 1 1 -7  27 3  f 489.5174 32.62994 47.86714       6.167607      38.68064       7.690533      64.42483       10.32479  433.5938 46.39131 559.6163 47.97132 -126.0226      66.73381 
1 1 1 -7  27 4  o 410.7250 33.10378 33.81322       5.235445      35.54512       6.188991      29.45554       9.817151  418.9283 38.47084 362.9586 72.18761 55.96973       81.79888 
1 1 1 -7  27 5  o 150.3227 58.90978 3.327707       5.006224      -0.7376117E-01 5.887377      12.20875       9.513070  136.2952 59.35569 235.5138 83.28768 -99.21854      102.2738 
1 1 1 -7  27 6  f 308.1331 45.26792 19.76638       5.255494      18.81773       6.190765      22.21391       9.943915  295.5007 55.99546 306.4680 81.95834 -10.96729      99.26057 
1 1 1 -7  27 7  o 185.1953 62.08643 7.218766       5.262108      13.46993       6.170700      -9.444442      10.07473  245.1989 64.08701 141.0848 67.13157 104.1141       92.81052 
1 1 1 -7  27 8  o 275.2941 52.39899 16.32709       5.397412      16.78218       6.245969      14.98523       10.72520  275.2179 60.12018 250.5994 88.45495 24.61850       106.9519 
1 1 1 -7  27 9  o 489.6918 30.74679 48.14758       5.817559      47.30805       6.810082      50.41459       11.19081  482.0834 36.64937 478.6906 61.62889 3.392822       71.70283 
1 1 1 -7  27 10 o 432.9349 35.93464 38.25505       5.987155      50.72466       7.097896      7.500730       11.14695  498.2141 36.94801 205.7609 85.24861 292.4532       92.91115 
1 1 1 -7  27 11 o 311.6745 48.85032 20.92274       5.718540      21.57206       6.704484      19.18914       10.95496  310.8494 57.66071 269.4874 89.56754 41.36203       106.5228 
1 1 1 -7  27 12 f 175.2536 64.12872 6.504458       5.696410      5.979156       6.664368      7.929111       10.97511  174.9794 68.13586 201.9072 84.19728 -26.92778      108.3129 
1 1 1 -7  27 13 o 504.7565 33.32697 52.19984       6.496129      64.00013       7.657054      21.89277       12.27120  557.1021 35.57720 273.0828 94.73360 284.0193       101.1938 
1 1 1 -7  27 14 o 450.1377 42.34720 43.19350       7.315812      43.19350       7.315812      0.000000       0.000000  450.1377 42.34720 ?        ?        0.000000       42.34720 
1 1 1 -7  27 15 o 136.8388 60.79180 0.4982225      6.467389      2.136550       7.735146      -3.307676      11.78953  153.4946 67.40699 157.8791 74.36975 -4.384430      100.3721 
1 1 1 -7  27 16 o 128.7542 56.60147 0.7493196      5.466558      -0.7144551     7.668477      2.261730       7.794833  139.3074 63.62491 152.7784 67.36004 -13.47101      92.65800 
1 1 1 -7  28 1  o 93.25774 45.23267 -7.837358      5.105524      -8.549253      6.756556      -6.889858      7.794844  111.3267 53.50720 127.5403 60.19817 -16.21359      80.54092 
1 1 1 -7  28 2  o 89.11438 43.80273 -10.03275      5.273379      -10.81184      6.752134      -8.814422      8.443649  104.9508 51.15483 128.0484 61.07413 -23.09759      79.66722 
1 1 1 -7  28 3  o 251.3315 57.71115 13.88004       5.514052      16.83870       6.992301      9.014188       8.967097  272.8586 66.57581 210.6277 79.79115 62.23080       103.9181 
1 1 1 -7  28 4  o 146.3167 60.31665 2.317702       5.541187      14.21262       7.110586      -16.07655      8.842311  248.4044 70.45700 114.2375 56.26180 134.1669       90.16418 
1 1 1 -7  28 5  o 331.2685 41.38417 22.72612       5.207901      30.47261       6.318184      6.308325       9.198081  383.1989 43.21052 194.0449 78.56814 189.1539       89.66661 
1 1 1 -7  28 6  o 137.6067 57.03753 1.897728       4.993273      1.218245       5.852878      3.714812       9.571228  141.4043 60.34625 181.8572 77.37912 -40.45291      98.12848 
1 1 1 -7  28 7  f 96.01501 46.16411 -6.471998      5.039885      -0.7973427E-01 5.929499      -23.11043      9.566361  134.3212 59.00143 107.7195 53.93889 26.60169       79.94106 
1 1 1 -7  28 8  o 125.1941 54.82956 -0.4442437E-01 5.087236      0.9948608E-01  5.890525      -0.4667720     10.09120  134.3065 58.90557 165.4165 74.52249 -31.11003      94.99193 
1 1 1 -7  28 9  o 345.9799 42.97240 25.24239       5.649542      24.19003       6.550348      28.29875       11.16308  332.4301 52.47974 329.7893 86.19817 2.640717       100.9170 
1 1 1 -7  28 10 o 145.6557 60.20643 2.746985       5.541339      4.886219       6.428369      -3.439813      10.93213  165.8874 66.19931 158.3067 73.60056 7.580643       98.99187 
1 1 1 -7  28 11 o 151.0852 61.49409 3.547830       5.668675      -3.270276      6.601947      22.67947       11.05901  123.7831 57.42938 283.7095 89.66763 -159.9264      106.4820 
1 1 1 -7  28 12 o 353.4860 44.52784 26.95533       5.977048      28.08233       7.015878      23.97238       11.41414  354.2657 52.59108 286.2797 91.16170 67.98608       105.2439 
1 1 1 -7  28 13 o 137.9671 61.67583 0.1468358      6.766162      0.1468358      6.766162      0.000000       0.000000  137.9671 61.67583 ?        ?        0.000000       61.67583 
1 1 1 -7  28 14 o 107.8692 51.18318 -4.739455      5.777199      -3.898040      6.704836      -7.164846      11.38344  120.1023 56.42112 145.2447 69.71441 -25.14243      89.68523 
1 1 1 -7  29 1  o 159.6031 60.43089 4.637849       5.141865      -0.2317225     6.600702      12.15342       8.200226  140.2340 61.89956 227.5204 77.49893 -87.28635      99.18488 
1 1 1 -7  29 2  o 335.1685 57.09741 24.72051       7.165628      24.72051       7.165628      0.000000       0.000000  335.1685 57.09741 ?        ?        0.000000       57.09741 
1 1 1 -7  29 3  o 179.3034 74.32996 4.742229       8.481441      0.000000       0.000000      4.742229       8.481441  ?        ?        179.3034 74.32996 0.000000       74.32996 
1 1 1 -7  29 4  o 356.4208 42.64338 26.61733       5.785390      33.47876       7.454422      16.22451       9.174310  395.3452 49.64721 254.4638 81.80331 140.8813       95.69027 
1 1 1 -7  29 5  o 233.7019 62.73218 12.64540       5.812848      13.14261       7.496878      11.89586       9.204705  233.0915 73.84428 222.8513 81.52273 10.24020       109.9951 
1 1 1 -7  29 6  o 136.9121 59.80607 0.5071746      6.017823      0.2324066      7.683980      0.9430391      9.677850  149.6806 66.39118 166.5564 74.15903 -16.87581      99.53568 
1 1 1 -7  29 7  o 141.0211 60.81670 1.281664       6.060856      -6.200591      7.663220      13.78011       9.904284  124.6915 59.10238 232.0051 84.61061 -107.3136      103.2088 
1 1 1 -7  29 8  o 255.7563 65.09215 15.62365       6.481514      12.45617       8.142713      21.10103       10.70775  222.7244 77.17475 276.3721 88.32641 -53.64764      117.2924 
1 1 1 -7  29 9  o 213.6499 63.03271 10.90094       5.588250      12.91457       6.570324      5.634674       10.62549  228.9690 68.53799 186.7414 80.52950 42.22768       105.7471 
1 1 1 -7  29 10 o 158.5414 62.39786 4.767145       5.638527      3.280017       6.613359      8.725791       10.79000  154.3275 64.92367 199.2142 83.31395 -44.88666      105.6234 
1 1 1 -7  29 11 o 161.7408 63.01231 5.269908       5.701975      5.290386       6.690969      5.215587       10.89759  166.1486 67.10233 182.5969 80.10210 -16.44826      104.4944 
1 1 1 -7  30 1  o 307.8317 42.57454 20.02682       4.953444      15.06319       6.892741      25.32823       7.123410  250.7816 68.73089 337.2870 56.37222 -86.50539      88.89185 
1 1 1 -7  30 2  o 218.2051 56.93431 10.84976       4.875587      6.761606       6.819678      15.12395       6.973124  181.4341 69.37981 250.4460 69.33221 -69.01198      98.08422 
1 1 1 -7  30 3  o 142.8342 57.91838 2.916323       5.006398      2.319649       6.961183      3.555591       7.205362  153.9151 65.75203 162.4113 68.01619 -8.496216      94.60196 
1 1 1 -7  30 4  o 125.8180 54.11945 0.8078980      4.774442      -3.550626      5.706844      10.97430       8.715854  113.8665 53.01852 213.0252 79.08424 -99.15865      95.21176 
1 1 1 -7  30 5  o 170.8041 59.84645 6.374369       4.903132      14.85278       5.979478      -11.02674      8.566326  251.5082 61.68736 119.3458 58.04787 132.1623       84.70470 
1 1 1 -7  30 6  o 326.6622 50.10719 23.48404       6.153736      22.63559       7.845994      24.84022       9.919590  306.2036 67.77169 306.7783 81.77401 -0.5746765     106.2073 
1 1 1 -6  0  1  o 252.4964 26.56468 12.80511       2.538902      12.80511       2.538902      12.80511       2.538902  252.4964 26.56468 252.4964 26.56468 0.000000       0.000000 
1 1 1 -6  0  2  f 106.8095 51.06107 3.269002       2.431843      3.269002       2.431843      3.269002       2.431843  106.8095 51.06107 106.8095 51.06107 0.000000       0.000000 
1 1 1 -6  0  3  o 798.3256 17.43185 124.0165       5.398633      124.0165       5.398633      124.0165       5.398633  798.3256 17.43185 798.3256 17.43185 0.000000       0.000000 
1 1 1 -6  0  4  o 301.8015 27.33433 18.14709       3.143312      18.14709       3.143312      18.14709       3.143312  301.8015 27.33433 301.8015 27.33433 0.000000       0.000000 
1 1 1 -6  0  5  o 330.7850 25.79134 21.66334       3.266874      21.66334       3.266874      21.66334       3.266874  330.7850 25.79134 330.7850 25.79134 0.000000       0.000000 
1 1 1 -6  0  6  o 50.55695 35.81620 -3.774924      2.920746      -3.774924      2.920746      -3.774924      2.920746  50.55695 35.81620 50.55695 35.81620 0.000000       0.000000 
1 1 1 -6  0  7  o 102.5575 57.15142 2.797739       3.383118      2.797739       3.383118      2.797739       3.383118  102.5575 57.15142 102.5575 57.15142 0.000000       0.000000 
1 1 1 -6  0  8  o 687.7926 20.35490 92.20079       5.426165      92.20079       5.426165      92.20079       5.426165  687.7926 20.35490 687.7926 20.35490 0.000000       0.000000 
1 1 1 -6  0  9  o 233.2090 48.01399 11.86469       3.840736      11.86469       3.840736      11.86469       3.840736  233.2090 48.01399 233.2090 48.01399 0.000000       0.000000 
1 1 1 -6  0  10 o 651.7073 31.40271 83.31426       7.905746      83.31426       7.905746      83.31426       7.905746  651.7073 31.40271 651.7073 31.40271 0.000000       0.000000 
1 1 1 -6  0  11 o 481.0167 38.14932 46.01752       7.023365      46.01752       7.023365      46.01752       7.023365  481.0167 38.14932 481.0167 38.14932 0.000000       0.000000 
1 1 1 -6  0  12 o 111.2869 63.27428 3.213670       4.255894      3.213670       4.255894      3.213670       4.255894  111.2869 63.27428 111.2869 63.27428 0.000000       0.000000 
1 1 1 -6  0  13 o 1055.895 21.13728 217.2849       8.659745      217.2849       8.659745      217.2849       8.659745  1055.895 21.13728 1055.895 21.13728 0.000000       0.000000 
1 1 1 -6  0  14 o 111.0815 65.27161 2.921468       4.763772      2.921468       4.763772      2.921468       4.763772  111.0815 65.27161 111.0815 65.27161 0.000000       0.000000 
1 1 1 -6  0  15 o 294.0450 75.58598 20.25994       7.460593      20.25994       7.460593      20.25994       7.460593  294.0450 75.58598 294.0450 75.58598 0.000000       0.000000 
1 1 1 -6  0  16 o 301.7837 51.60258 19.42312       5.516875      19.42312       5.516875      19.42312       5.516875  301.7837 51.60258 301.7837 51.60258 0.000000       0.000000 
1 1 1 -6  0  17 o 430.7684 35.72509 37.04479       5.881905      37.04479       5.881905      37.04479       5.881905  430.7684 35.72509 430.7684 35.72509 0.000000       0.000000 
1 1 1 -6  0  18 o 95.56276 62.15417 -0.2835330     5.552004      -0.2835330     5.552004      -0.2835330     5.552004  95.56276 62.15417 95.56276 62.15417 0.000000       0.000000 
1 1 1 -6  0  19 o 578.6047 31.75228 65.89808       7.085738      65.89808       7.085738      65.89808       7.085738  578.6047 31.75228 578.6047 31.75228 0.000000       0.000000 
1 1 1 -6  0  20 o 829.3829 26.34316 134.3639       8.465595      134.3639       8.465595      134.3639       8.465595  829.3829 26.34316 829.3829 26.34316 0.000000       0.000000 
1 1 1 -6  0  21 o 897.1138 26.19009 157.0840       9.106976      157.0840       9.106976      157.0840       9.106976  897.1138 26.19009 897.1138 26.19009 0.000000       0.000000 
1 1 1 -6  0  22 o 805.0298 28.54833 126.6970       8.899800      126.6970       8.899800      126.6970       8.899800  805.0298 28.54833 805.0298 28.54833 0.000000       0.000000 
1 1 1 -6  0  23 o 622.1664 34.88171 76.23756       8.367571      76.23756       8.367571      76.23756       8.367571  622.1664 34.88171 622.1664 34.88171 0.000000       0.000000 
1 1 1 -6  0  24 o 484.3277 45.32903 47.16740       8.354333      47.16740       8.354333      47.16740       8.354333  484.3277 45.32903 484.3277 45.32903 0.000000       0.000000 
1 1 1 -6  0  25 o 166.7325 89.88745 8.111265       8.081109      8.111265       8.081109      8.111265       8.081109  166.7325 89.88745 166.7325 89.88745 0.000000       0.000000 
1 1 1 -6  0  26 o 229.0961 96.97645 15.03908       8.732461      15.03908       8.732461      15.03908       8.732461  229.0961 96.97645 229.0961 96.97645 0.000000       0.000000 
1 1 1 -6  0  27 f 172.2733 95.12437 8.686590       9.276056      8.686590       9.276056      8.686590       9.276056  172.2733 95.12437 172.2733 95.12437 0.000000       0.000000 
1 1 1 -6  0  28 o 835.9491 52.59082 140.4539       16.91842      140.4539       16.91842      140.4539       16.91842  835.9491 52.59082 835.9491 52.59082 0.000000       0.000000 
1 1 1 -6  0  29 o 185.7228 100.1542 10.90725       10.03524      10.90725       10.03524      10.90725       10.03524  185.7228 100.1542 185.7228 100.1542 0.000000       0.000000 
1 1 1 -6  0  30 o 330.4215 94.33259 27.75039       10.49100      27.75039       10.49100      27.75039       10.49100  330.4215 94.33259 330.4215 94.33259 0.000000       0.000000 
1 1 1 -6  0  31 o 262.8141 108.8638 21.60078       11.04748      21.60078       11.04748      21.60078       11.04748  262.8141 108.8638 262.8141 108.8638 0.000000       0.000000 
1 1 1 -6  0  32 o 126.9929 87.81976 -5.777566      14.73500      -5.777566      14.73500      -5.777566      14.73500  126.9929 87.81976 126.9929 87.81976 0.000000       0.000000 
1 1 1 -6  0  33 o 167.2412 98.13779 10.48592       10.74284      10.48592       10.74284      10.48592       10.74284  167.2412 98.13779 167.2412 98.13779 0.000000       0.000000 
1 1 1 -6  0  34 o 100.2811 70.30434 -6.353803      10.36199      -6.353803      10.36199      -6.353803      10.36199  100.2811 70.30434 100.2811 70.30434 0.000000       0.000000 
1 1 1 -6  1  1  o 703.4127 11.91948 96.14420       3.256083      93.59533       4.545419      98.83075       4.666564  693.7818 16.87031 712.9227 16.85493 -19.14093      23.84734 
1 1 1 -6  1  2  o 689.9487 12.11707 92.50201       3.246702      91.23372       4.558236      93.80805       4.625564  684.9506 17.13600 694.5462 17.14887 -9.595581      24.24307 
1 1 1 -6  1  3  o 498.4789 13.30009 48.29273       2.574717      50.88523       3.722823      45.91576       3.564721  511.4577 18.74281 485.8347 18.89335 25.62302       26.61300 
1 1 1 -6  1  4  o 496.8096 14.10120 47.97600       2.720659      46.71496       3.835055      49.25367       3.860254  489.9745 20.15441 503.1328 19.75628 -13.15829      28.22252 
1 1 1 -6  1  5  o 251.3097 23.08880 12.40115       2.228202      10.92483       3.136208      13.90595       3.166314  233.7901 35.67208 265.0994 31.36294 -31.30927      47.49875 
1 1 1 -6  1  6  o 248.2105 24.84901 12.12267       2.363107      10.15535       3.274269      14.26147       3.413986  224.6031 38.94983 268.1304 33.51820 -43.52730      51.38637 
1 1 1 -6  1  7  o 159.0518 37.93348 5.151600       2.310208      1.700734       3.242190      8.710714       3.292648  120.8405 47.39353 207.0137 42.38277 -86.17319      63.58023 
1 1 1 -6  1  8  o 506.0381 16.42360 49.81097       3.227599      46.64084       4.545379      53.03506       4.583893  489.1905 23.92567 521.7490 22.62272 -32.55853      32.92757 
1 1 1 -6  1  9  o 250.4084 27.81977 12.39234       2.659664      15.66227       3.844696      9.391412       3.683167  280.4328 36.14373 214.3605 45.64277 66.07231       58.22055 
1 1 1 -6  1  10 o 320.8530 34.72364 20.41808       4.257700      28.26880       6.245302      13.60070       5.819787  376.2160 43.55051 255.9906 59.64637 120.2254       73.85348 
1 1 1 -6  1  11 o 667.2436 22.86040 86.89069       5.923744      92.48595       8.501139      81.60966       8.258986  686.7507 31.87498 644.0316 33.13336 42.71912       45.97645 
1 1 1 -6  1  12 f 167.6517 44.63135 5.781215       2.957350      5.048570       4.249798      6.469110       4.117967  163.7758 55.79134 178.6962 54.43432 -14.92039      77.94722 
1 1 1 -6  1  13 o 959.7858 15.18934 179.4558       5.661624      175.4500       7.805824      183.9024       8.224029  947.5540 21.21225 969.9283 21.83318 -22.37433      30.44088 
1 1 1 -6  1  14 o 402.1333 27.21189 31.91739       4.224673      38.18428       7.165240      28.57785       5.230559  435.0597 42.97010 378.0587 36.06278 57.00098       56.09772 
1 1 1 -6  1  15 o 575.5818 26.33347 65.10562       5.886311      58.53284       8.001136      72.85985       8.690532  540.9122 38.33712 604.2579 37.21463 -63.34576      53.42905 
1 1 1 -6  1  16 o 692.0273 25.63235 94.04592       6.888736      94.04592       6.888736      0.000000       0.000000  692.0273 25.63235 ?        ?        0.000000       25.63235 
1 1 1 -6  1  17 o 369.2513 28.53242 26.97582       4.059813      26.97447       5.593281      26.97732       5.902040  366.0238 39.99972 365.2516 42.39711 0.7721558      58.28802 
1 1 1 -6  1  18 o 292.9203 37.18085 17.24265       4.134319      11.90763       5.723018      23.06559       5.978999  236.9425 61.61664 336.4517 47.04593 -99.50922      77.52374 
1 1 1 -6  1  19 o 507.9329 23.92040 50.45438       4.718487      47.84029       6.540457      53.29155       6.813833  491.5768 34.47828 519.0882 33.98809 -27.51135      48.41428 
1 1 1 -6  1  20 o 614.4634 22.06616 73.71599       5.265636      72.40810       7.448649      75.02252       7.444822  606.4252 31.73837 617.4597 31.14728 -11.03448      44.46883 
1 1 1 -6  1  21 o 595.2654 23.37497 69.18969       5.403681      60.48808       7.456033      78.81680       7.842526  553.6435 34.85559 633.0089 32.00594 -79.36536      47.32116 
1 1 1 -6  1  22 o 1113.819 18.12085 241.6943       7.838292      223.2623       10.61130      263.8292       11.62844  1068.757 25.56592 1161.742 25.77411 -92.98425      36.30318 
1 1 1 -6  1  23 o 530.9697 27.46552 55.34429       5.644127      56.45514       7.932248      54.20512       8.032703  533.5201 38.54340 522.3292 39.90134 11.19086       55.47712 
1 1 1 -6  1  24 o 353.1405 41.61429 25.08125       5.597560      24.21281       7.878541      25.96647       7.954293  340.0975 61.93226 353.1548 60.15344 -13.05722      86.33679 
1 1 1 -6  1  25 o 267.9036 57.22359 15.12361       5.772758      16.31854       8.292009      13.99977       8.041574  273.6296 75.54739 254.6658 75.73251 18.96379       106.9711 
1 1 1 -6  1  26 o 407.5800 41.17380 33.47990       6.427856      27.27910       8.980338      39.99417       9.204531  356.7881 67.27914 439.8843 55.08910 -83.09613      86.95570 
1 1 1 -6  1  27 o 434.3273 40.91437 38.10302       6.819811      35.64557       9.498977      40.71725       9.797277  410.3128 61.50740 440.5076 58.73291 -30.19482      85.04537 
1 1 1 -6  1  28 o 167.8140 74.85181 -1.241578      9.906753      -23.22145      13.53412      24.12854       14.54048  142.0139 69.87656 310.9137 103.1823 -168.8998      124.6167 
1 1 1 -6  1  29 o 376.2754 60.98642 31.07839       8.606798      32.20559       15.03177      30.52861       10.49798  345.8857 103.6976 360.7585 77.25979 -14.87286      129.3146 
1 1 1 -6  1  30 o 163.3427 67.90211 3.555652       7.106210      -5.221521      10.00810      12.48028       10.09182  148.5895 69.52438 227.3528 84.96049 -78.76335      109.7813 
1 1 1 -6  1  31 o 144.2620 65.66256 -1.167970      8.079614      -0.8351845E-01 13.26116      -1.808179      10.18914  177.7217 82.07887 156.4071 72.13371 21.31459       109.2713 
1 1 1 -6  1  32 o 189.7001 79.72482 8.576427       9.956355      5.032377       13.72390      12.51424       14.46623  185.0976 84.75565 209.8323 92.16419 -24.73471      125.2109 
1 1 1 -6  1  33 o 167.3848 69.81320 6.656182       7.547357      14.33809       10.56870      -1.338379      10.78163  207.0363 84.08210 148.6775 70.36497 58.35878       109.6405 
1 1 1 -6  1  34 o 124.7926 58.91749 -2.011931      7.476037      2.953175       10.73802      -6.682643      10.41481  154.1986 72.10632 129.4550 63.19374 24.74359       95.87894 
1 1 1 -6  2  1  o 1155.346 12.71189 259.3976       5.703612      255.5075       7.934816      263.5563       8.204179  1146.212 17.82560 1164.093 18.14762 -17.88086      25.43792 
1 1 1 -6  2  2  o 222.6292 20.69967 9.727498       1.769175      9.162482       2.508488      10.28670       2.495545  214.5259 31.00945 227.9016 28.84173 -13.37563      42.34893 
1 1 1 -6  2  3  o 774.5696 12.28154 116.5872       3.694377      114.0227       5.151990      119.3017       5.300447  765.7134 17.32530 783.2313 17.42587 -17.51788      24.57289 
1 1 1 -6  2  4  o 749.0676 12.64857 109.0434       3.679514      108.9754       5.206047      109.1112       5.201193  748.5232 17.90914 748.9913 17.88126 -0.4681396     25.30765 
1 1 1 -6  2  5  o 396.0170 16.59885 30.49744       2.552818      28.83241       3.561349      32.25712       3.661180  384.0048 24.00125 406.3304 23.29866 -22.32568      33.44978 
1 1 1 -6  2  6  o 160.8129 37.49357 5.262723       2.298420      4.614154       3.211061      5.944125       3.291338  153.9033 48.27273 171.3763 47.70083 -17.47299      67.86476 
1 1 1 -6  2  7  o 480.7096 16.21395 44.94202       3.026911      44.07307       4.257430      45.83023       4.304351  475.6551 23.04769 485.0577 22.85001 -9.402557      32.45487 
1 1 1 -6  2  8  o 317.1616 22.69536 19.69855       2.776937      18.52055       3.975637      20.82083       3.880458  305.8155 34.05318 324.9503 31.13049 -19.13486      46.13813 
1 1 1 -6  2  9  o 272.3744 38.62460 14.84408       3.971173      14.84408       3.971173      0.000000       0.000000  272.3744 38.62460 ?        ?        0.000000       38.62460 
1 1 1 -6  2  10 o 275.9052 39.95867 15.27882       4.156886      12.63551       5.674874      18.33927       6.106248  246.5989 59.85977 299.2213 54.55796 -52.62238      80.99236 
1 1 1 -6  2  11 o 613.4553 23.57855 73.48004       5.617306      78.92900       8.009133      68.20462       7.880568  633.3719 32.67238 588.1588 34.65438 45.21307       47.62783 
1 1 1 -6  2  12 o 570.4492 17.71541 63.42877       3.924607      66.01431       5.629051      60.98314       5.474633  580.8740 24.95315 558.2496 25.25216 22.62433       35.50114 
1 1 1 -6  2  13 o 171.0108 46.40695 6.048886       3.160650      9.623584       4.394392      2.217722       4.549299  214.2323 53.08836 139.5351 55.68767 74.69719       76.93822 
1 1 1 -6  2  14 o 154.6661 53.04928 4.532352       3.842754      -0.5480258     6.395411      7.402913       4.807328  141.4239 61.71864 189.5503 59.00160 -48.12637      85.38372 
1 1 1 -6  2  15 o 224.0551 56.17773 10.66386       4.879138      8.202885       6.871446      13.16638       6.929201  203.5823 70.87482 246.3479 69.44060 -42.76555      99.22317 
1 1 1 -6  2  16 o 364.3541 28.16212 26.27707       3.953958      25.58037       5.413852      27.07350       5.788404  356.1188 39.82768 365.9194 41.46486 -9.800629      57.49416 
1 1 1 -6  2  17 o 418.9021 25.89353 34.56324       4.191768      36.51027       5.720284      32.30518       6.160246  428.2273 34.69479 400.9615 40.09865 27.26575       53.02481 
1 1 1 -6  2  18 o 318.7943 34.68662 20.28951       4.225077      14.43852       5.826395      26.77871       6.135938  261.6817 58.76937 363.9383 44.32937 -102.2566      73.61340 
1 1 1 -6  2  19 o 608.2567 21.18212 72.23827       5.003619      72.60816       7.115820      71.87650       7.037206  608.1025 30.13146 605.0716 29.94784 3.030945       42.48268 
1 1 1 -6  2  20 o 508.6855 25.41364 50.60527       5.020469      43.67620       6.953603      58.15028       7.256084  468.9226 38.52450 542.5873 34.61588 -73.66464      51.79186 
1 1 1 -6  2  21 o 833.7410 19.81981 135.5145       6.417393      140.9177       9.198061      130.3899       8.957834  848.5472 27.91209 816.1544 28.26199 32.39276       39.72184 
1 1 1 -6  2  22 o 485.4312 28.25067 46.27824       5.302766      43.73707       7.331866      49.06546       7.678634  469.0213 40.65474 497.1096 40.11609 -28.08829      57.11486 
1 1 1 -6  2  23 o 379.4578 37.51822 28.66067       5.456410      29.96059       7.614399      27.28860       7.822881  383.7436 52.46822 364.4028 57.15901 19.34079       77.58908 
1 1 1 -6  2  24 o 161.5380 61.81274 3.889805       5.415437      -0.2073229E-01 7.397816      8.404803       7.949029  155.4928 67.12379 212.0265 76.01014 -56.53363      101.4058 
1 1 1 -6  2  25 o 348.5705 44.39189 24.65346       5.872896      23.89692       8.069245      25.50560       8.563863  335.6698 64.24048 346.2587 66.09668 -10.58887      92.17163 
1 1 1 -6  2  26 o 475.4554 35.17065 45.03935       6.448006      46.39536       8.936309      43.56659       9.313069  477.0785 48.92473 460.2610 53.07544 16.81747       72.18470 
1 1 1 -6  2  27 o 179.9170 71.45299 4.590964       7.456080      -4.301058      9.093612      22.83169       13.02438  151.2522 69.16000 311.1836 97.15749 -159.9315      119.2589 
1 1 1 -6  2  28 o 228.0098 83.18967 10.91430       9.575908      21.78525       13.39901      -0.4347018     13.69046  298.1166 99.05492 196.1035 87.69306 102.0131       132.2949 
1 1 1 -6  2  29 o 303.2515 70.84614 21.22404       8.192930      7.058575       14.13188      28.39558       10.05520  218.7131 93.56540 347.7795 76.52570 -129.0665      120.8746 
1 1 1 -6  2  30 o 197.6850 70.97758 8.746941       6.933795      16.20256       9.765296      1.166116       9.846950  251.5262 84.57716 169.3165 75.12605 82.20969       113.1248 
1 1 1 -6  2  31 f 184.9438 74.05416 7.187295       8.073324      16.91369       13.80981      2.137182       9.950900  240.2949 96.62868 168.7769 75.16907 71.51801       122.4234 
1 1 1 -6  2  32 o 141.9477 65.26326 -0.9084507     8.251807      -8.159156      10.17476      13.02524       14.10480  133.9045 64.68325 210.8531 91.84743 -76.94853      112.3382 
1 1 1 -6  2  33 o 116.4474 56.81738 -8.594360      8.391190      -2.659098      10.35716      -19.93260      14.31508  142.9658 68.03767 131.8762 66.02724 11.08968       94.80886 
1 1 1 -6  2  34 o 179.2315 70.80776 9.713019       7.286472      24.58694       10.55789      -3.814643      10.06876  253.8986 87.88344 133.8741 64.58861 120.0246       109.0651 
1 1 1 -6  3  1  o 745.2363 12.08333 107.9186       3.497106      100.6273       4.776904      116.3396       5.133655  719.3638 17.09897 773.4901 17.09007 -54.12628      24.17531 
1 1 1 -6  3  2  o 874.9745 12.23290 148.7689       4.156738      155.0994       6.008793      142.9592       5.756361  893.0625 17.32516 857.4013 17.28765 35.66119       24.47497 
1 1 1 -6  3  3  o 396.9527 15.36410 30.63346       2.368503      36.79986       3.415992      24.92439       3.286875  434.8839 20.22626 356.9665 23.84701 77.91736       31.26950 
1 1 1 -6  3  4  o 240.9677 22.76132 11.40541       2.104795      11.06669       3.052464      11.71245       2.906181  235.5788 34.37717 242.9650 31.54432 -7.386276      46.65656 
1 1 1 -6  3  5  o 1202.891 13.50032 281.2418       6.306647      283.6981       9.010552      278.8830       8.830078  1207.521 19.21448 1197.258 18.99105 10.26355       27.01585 
1 1 1 -6  3  6  o 332.7815 19.40738 21.62349       2.497271      21.70012       3.586108      21.55133       3.479645  332.3773 28.04394 331.3294 27.28509 1.047913       39.12721 
1 1 1 -6  3  7  o 350.3495 20.00551 23.97125       2.710654      24.57533       3.871750      23.39050       3.796253  353.7378 28.42368 345.0256 28.58949 8.712219       40.31457 
1 1 1 -6  3  8  o 646.2979 14.60847 81.22677       3.666617      80.76786       5.177624      81.68844       5.193171  643.9948 20.70238 647.6596 20.64704 -3.664795      29.23848 
1 1 1 -6  3  9  o 435.0619 18.64101 36.85203       3.149550      41.88335       4.588137      32.36838       4.331230  462.5605 25.64145 406.1673 27.62272 56.39322       37.68951 
1 1 1 -6  3  10 o 318.8477 35.56982 20.19965       4.329396      18.68440       5.996803      21.84918       6.256855  302.3644 53.00163 328.1646 50.73125 -25.80020      73.36778 
1 1 1 -6  3  11 o 1376.850 17.33316 369.2621       9.268134      368.2602       15.94433      369.7735       11.39007  1370.720 29.95225 1376.702 21.30388 -5.981323      36.75584 
1 1 1 -6  3  12 o 565.3151 17.36286 62.29173       3.811885      63.89848       5.338696      60.62065       5.444500  571.5640 24.05151 556.5151 25.19144 15.04883       34.82935 
1 1 1 -6  3  13 o 373.3495 23.92692 27.40553       3.450948      27.28683       4.705314      27.54370       5.076560  370.4727 33.05136 371.5334 35.62051 -1.060669      48.59231 
1 1 1 -6  3  14 f 139.6747 52.58863 3.057481       3.880675      1.200913       6.493571      4.088927       4.840068  152.1005 64.17814 157.5429 58.84488 -5.442398      87.07212 
1 1 1 -6  3  15 o 680.3610 25.41407 90.88912       6.714932      97.02764       9.678276      85.19141       9.324308  698.3104 35.80838 653.7389 36.87746 44.57147       51.40221 
1 1 1 -6  3  16 o 439.1606 27.34792 38.06242       4.641042      35.24876       5.525351      44.80354       8.552437  420.6501 34.11683 469.3440 47.57893 -48.69394      58.54667 
1 1 1 -6  3  17 o 986.1717 16.26508 189.6134       6.229262      190.9497       8.866561      188.3110       8.753540  987.5984 23.11782 980.7980 22.98138 6.800354       32.59720 
1 1 1 -6  3  18 f 98.44454 45.40550 -2.986593      4.038382      0.1488456      5.644353      -6.274936      5.780343  137.7014 59.02615 109.1740 51.62405 28.52744       78.41638 
1 1 1 -6  3  19 o 842.4053 18.52398 138.3668       6.060149      133.7613       8.271732      143.7030       8.903823  826.6784 25.76510 856.5797 26.76583 -29.90131      37.15172 
1 1 1 -6  3  20 o 936.7319 25.88774 171.6270       9.417540      0.000000       0.000000      171.6270       9.417540  ?        ?        936.7319 25.88774 0.000000       25.88774 
1 1 1 -6  3  21 o 209.3303 56.52079 9.077751       4.702354      15.35556       6.511151      2.233794       6.798412  270.7297 63.09609 163.5227 67.03892 107.2070       92.06157 
1 1 1 -6  3  22 f 340.4995 39.52290 23.16076       5.129078      18.92918       7.150155      27.64644       7.361692  301.0164 63.17783 368.6981 52.93185 -67.68173      82.42099 
1 1 1 -6  3  23 o 597.7014 25.80140 69.89299       5.989017      61.59249       8.173896      79.51433       8.800243  557.4293 37.98460 634.3356 35.86995 -76.90631      52.24446 
1 1 1 -6  3  24 o 526.5783 29.96387 54.66314       6.102244      48.84322       8.422255      61.09454       8.853653  493.1745 44.45213 553.0837 41.52264 -59.90915      60.82862 
1 1 1 -6  3  25 o 420.4902 37.57774 35.33942       6.071763      43.35425       8.377357      26.46991       8.812715  462.4405 47.31319 352.4665 66.82747 109.9740       81.88070 
1 1 1 -6  3  26 f 365.7979 45.38969 27.25527       6.309467      33.88093       8.882954      20.50897       8.963460  402.7081 58.51084 304.7605 75.99408 97.94763       95.90943 
1 1 1 -6  3  27 o 474.5608 78.89236 49.88597       14.02920      0.000000       0.000000      49.88597       14.02920  ?        ?        474.5608 78.89236 0.000000       78.89236 
1 1 1 -6  3  28 o 172.9673 68.19456 4.604423       6.745815      -1.849857      9.407308      11.43622       9.678518  161.0276 72.30108 231.1479 83.74076 -70.12029      110.6344 
1 1 1 -6  3  29 o 687.4205 60.48431 102.7684       15.98266      102.7684       15.98266      0.000000       0.000000  687.4205 60.48431 ?        ?        0.000000       60.48431 
1 1 1 -6  3  30 o 309.3491 61.30003 21.80834       7.104070      32.12629       10.24372      12.24781       9.860570  364.7338 74.82874 224.8063 83.98683 139.9275       112.4861 
1 1 1 -6  3  31 o 290.1760 73.59351 21.39847       8.305638      10.90762       13.84747      27.29327       10.38005  214.3102 92.17499 318.3047 83.08312 -103.9945      124.0928 
1 1 1 -6  3  32 o 178.7130 73.96571 7.228234       8.379053      7.338683       10.12150      6.987681       14.93715  183.1538 78.79035 191.7958 88.04312 -8.641968      118.1504 
1 1 1 -6  3  33 o 153.6104 68.41531 3.593323       8.243427      3.224338       10.62524      4.151246       13.06538  160.4957 73.88930 169.5364 79.36081 -9.040665      108.4332 
1 1 1 -6  3  34 o 97.57793 48.28538 -10.19445      6.785194      -13.13883      10.12114      -7.790907      9.144447  115.7801 57.57923 119.8555 58.65783 -4.075478      82.19555 
1 1 1 -6  4  1  o 919.4969 12.30102 164.2943       4.392578      171.0777       6.365938      158.1294       6.068796  937.9310 17.47687 901.7498 17.32960 36.18127       24.61211 
1 1 1 -6  4  2  o 800.5458 12.34636 124.5384       3.838425      127.6722       5.531128      121.6271       5.331102  810.2368 17.57817 790.8376 17.35808 19.39917       24.70415 
1 1 1 -6  4  3  o 937.0094 12.57229 170.6238       4.574951      173.7948       6.536139      167.5781       6.405745  945.2893 17.80445 928.2316 17.76991 17.05774       25.15489 
1 1 1 -6  4  4  o 757.8012 12.88130 111.6075       3.790905      115.7409       5.458521      107.7564       5.268809  771.3645 18.22164 744.2818 18.22834 27.08270       25.77403 
1 1 1 -6  4  5  o 463.4605 15.23677 41.76284       2.742419      41.92188       3.911782      41.60912       3.845792  464.0308 21.70700 462.3127 21.42012 1.718109       30.49616 
1 1 1 -6  4  6  o 1009.247 13.20788 197.9930       5.176769      197.1727       7.336892      198.8062       7.305323  1006.615 18.76811 1010.794 18.61009 -4.179077      26.43062 
1 1 1 -6  4  7  o 192.1564 33.85881 7.432863       2.434390      8.633570       3.548982      6.365885       3.345516  205.5294 45.65086 176.7807 47.64969 28.74863       65.98859 
1 1 1 -6  4  8  o 741.2090 14.23657 106.8348       4.098019      107.0875       5.832859      106.5885       5.758798  741.5318 20.25460 739.8247 20.04357 1.707092       28.49550 
1 1 1 -6  4  9  o 778.8887 16.81003 118.0720       5.084776      129.4761       8.953514      112.6429       6.177654  813.9202 28.32590 760.2919 20.92258 53.62830       35.21521 
1 1 1 -6  4  10 o 123.9484 50.10716 1.391330       3.734780      1.115849       5.015963      1.734069       5.594885  137.6436 57.11928 148.3990 60.82481 -10.75539      83.44022 
1 1 1 -6  4  11 o 339.4602 25.01194 22.65198       3.274117      22.10576       4.541811      23.24294       4.724173  333.2276 35.64922 341.6613 36.15349 -8.433746      50.77344 
1 1 1 -6  4  12 o 592.4275 24.44063 68.69298       5.623098      0.000000       0.000000      68.69298       5.623098  ?        ?        592.4275 24.44063 0.000000       24.44063 
1 1 1 -6  4  13 o 409.4080 23.24221 32.92078       3.680168      31.04859       5.161801      34.85629       5.248366  394.9935 33.98066 419.0880 32.50133 -24.09445      47.02150 
1 1 1 -6  4  14 o 124.5551 51.05148 1.291750       3.941329      2.214406       6.890397      0.8430642      4.805026  161.7390 67.01821 131.6667 55.36265 30.07234       86.92793 
1 1 1 -6  4  15 o 203.3019 49.45401 8.679562       3.867159      7.562741       4.704285      11.00724       6.791464  190.7380 58.19797 227.1994 70.03117 -36.46144      91.05695 
1 1 1 -6  4  16 o 433.2083 28.34613 37.07341       4.742608      36.03887       5.838296      39.08054       8.132020  424.9751 35.70578 437.8152 48.65041 -12.84012      60.34704 
1 1 1 -6  4  17 o 184.9812 53.59010 7.091619       4.072206      7.644232       5.667907      6.502010       5.854565  195.1960 64.40380 185.7920 65.37753 9.404007       91.77184 
1 1 1 -6  4  18 f 107.1437 47.34393 -1.037691      3.871505      -2.202760      5.397449      0.1969528      5.556273  121.7734 54.71450 137.0925 58.65900 -15.31914      80.21568 
1 1 1 -6  4  19 o 553.9574 22.84142 59.95016       4.913913      62.60317       6.824039      57.09296       7.081770  563.7487 31.29235 537.5635 34.09874 26.18512       46.28104 
1 1 1 -6  4  20 o 221.7738 54.86648 10.23124       4.699526      13.28276       6.560572      7.015180       6.735133  251.2366 66.28155 196.6740 70.02329 54.56258       96.41839 
1 1 1 -6  4  21 o 659.7819 23.30478 84.98322       5.971362      81.41381       8.145648      89.12974       8.779490  643.3026 32.71266 673.7513 33.55380 -30.44879      46.86124 
1 1 1 -6  4  22 o 951.0912 26.89365 176.9484       9.933446      176.9484       9.933446      0.000000       0.000000  951.0912 26.89365 ?        ?        0.000000       26.89365 
1 1 1 -6  4  23 o 842.9518 29.50799 139.3775       9.659849      139.3775       9.659849      0.000000       0.000000  842.9518 29.50799 ?        ?        0.000000       29.50799 
1 1 1 -6  4  24 o 752.4034 23.22346 110.7426       6.785873      117.3922       9.590916      104.0771       9.602443  772.1133 31.98534 726.3380 34.04199 45.77533       46.71102 
1 1 1 -6  4  25 o 437.0135 37.32388 38.14808       6.273712      40.77670       8.841053      35.48188       8.904019  446.2998 51.98326 413.8605 56.90476 32.43927       77.07407 
1 1 1 -6  4  26 o 173.8543 66.33142 4.845139       6.224784      10.64017       8.407440      -2.185724      9.260624  227.5671 78.44383 161.6293 72.21121 65.93779       106.6203 
1 1 1 -6  4  27 o 417.6611 49.31755 35.93732       7.844991      45.50436       9.380900      13.68298       14.30748  468.9048 52.41133 259.7828 100.2021 209.1221       113.0814 
1 1 1 -6  4  28 o 427.3657 43.14819 37.44933       7.063220      47.74307       9.702003      25.84111       10.30286  476.7240 53.31731 332.9207 80.55884 143.8033       96.60468 
1 1 1 -6  4  29 o 262.7648 74.04804 16.33140       7.880340      27.70632       13.65409      10.65011       9.649661  321.5497 99.32871 220.1911 82.92220 101.3586       129.3920 
1 1 1 -6  4  30 o 154.8703 68.24712 0.8792949      7.991326      -22.98984      14.39971      11.50241       9.606413  141.6174 70.12475 219.2120 82.69603 -77.59459      108.4256 
1 1 1 -6  4  31 o 254.4512 75.78748 16.97206       8.048569      25.31777       13.61257      12.48634       9.979861  280.6679 99.58995 217.4239 83.73650 63.24405       130.1152 
1 1 1 -6  4  32 o 108.4900 52.67763 -8.063284      6.974770      4.243970       9.752400      -20.94946      9.979136  168.1014 74.66717 108.6790 54.51507 59.42239       92.45042 
1 1 1 -6  4  33 f 135.1433 63.24524 -1.246682      8.288859      -6.561108      10.59666      7.130910       13.30455  134.0082 65.03626 176.9563 81.89651 -42.94812      104.5789 
1 1 1 -6  5  1  o 1116.126 12.83454 242.0961       5.563159      246.0089       7.969243      238.3770       7.769548  1124.629 18.24652 1107.064 18.07153 17.56445       25.68103 
1 1 1 -6  5  2  o 986.1942 12.65865 189.0100       4.848170      191.5476       6.919523      186.5630       6.794871  992.3741 17.95447 979.3853 17.86486 12.98889       25.32817 
1 1 1 -6  5  3  o 657.7383 12.92487 84.08015       3.301470      79.17207       4.547111      89.55209       4.801212  637.9620 18.35324 678.5038 18.22093 -40.54181      25.86201 
1 1 1 -6  5  4  o 145.6708 46.37357 4.092106       2.953813      4.092106       2.953813      0.000000       0.000000  145.6708 46.37357 ?        ?        0.000000       46.37357 
1 1 1 -6  5  5  o 1118.992 13.22602 243.3911       5.747567      236.5262       7.936275      250.9630       8.334945  1102.545 18.53500 1135.648 18.89866 -33.10364      26.47084 
1 1 1 -6  5  6  o 811.5585 13.45728 128.0381       4.241359      129.2200       5.972386      126.8357       6.024325  814.8408 18.87327 807.2546 19.21630 7.586121       26.93449 
1 1 1 -6  5  7  o 584.2515 14.76114 66.38258       3.349252      67.84079       4.765141      64.95886       4.708482  590.1953 20.78988 577.5062 20.99405 12.68909       29.54606 
1 1 1 -6  5  8  f 644.2600 15.06190 80.73889       3.768504      77.73565       5.304851      83.79854       5.354434  631.5763 21.62815 655.8086 21.02367 -24.23230      30.16242 
1 1 1 -6  5  9  o 627.0002 21.67025 76.65001       5.276665      79.65070       7.410221      73.56339       7.515558  637.9764 29.90877 612.0179 31.72941 25.95850       43.60378 
1 1 1 -6  5  10 o 187.9063 52.78564 7.251306       4.011093      1.076298       5.477254      14.39283       5.890327  142.4801 59.45358 262.7084 59.15829 -120.2283      83.87151 
1 1 1 -6  5  11 o 518.7056 17.89491 52.44859       3.604776      52.47471       5.160222      52.42370       5.037829  517.7709 25.66272 517.6147 25.06160 0.1561279      35.87003 
1 1 1 -6  5  12 o 292.5140 29.20633 16.97604       3.273458      17.44524       4.685744      16.52876       4.574979  293.2444 42.37444 285.2287 42.60787 8.015625       60.09179 
1 1 1 -6  5  13 o 781.7977 18.70405 119.3456       5.678819      109.5833       9.584064      124.6274       7.049613  744.7288 33.13780 797.8478 22.75188 -53.11902      40.19654 
1 1 1 -6  5  14 o 523.5338 23.35374 53.71426       4.748202      58.31800       8.446322      51.58713       5.741290  539.1205 40.64050 510.9937 29.05115 28.12686       49.95618 
1 1 1 -6  5  15 o 775.4154 19.70683 117.5182       5.934431      124.4815       7.324111      104.2086       10.12578  796.9111 23.66558 724.7001 35.97844 72.21106       43.06400 
1 1 1 -6  5  16 o 123.3034 51.82898 0.6716168      4.208962      1.597312       5.281683      -0.9391621     6.967167  142.4173 58.81618 145.6457 63.96640 -3.228409      86.89674 
1 1 1 -6  5  17 o 357.1172 43.94781 25.79212       5.966413      0.000000       0.000000      25.79212       5.966413  ?        ?        357.1172 43.94781 0.000000       43.94781 
1 1 1 -6  5  18 o 211.0218 53.53413 9.293394       4.394069      4.523724       6.061353      14.57628       6.379122  171.9517 65.49073 262.5011 63.30907 -90.54939      91.08828 
1 1 1 -6  5  19 o 627.6021 22.05696 76.90178       5.375986      82.31818       7.517490      71.23235       7.691065  647.8577 29.87894 601.1111 33.07331 46.74664       44.57124 
1 1 1 -6  5  20 o 137.3124 54.68669 2.068766       4.378849      3.291359       5.980261      0.6556553      6.429354  162.8996 64.21382 150.2535 63.65430 12.64606       90.41728 
1 1 1 -6  5  21 o 444.2668 30.07308 38.83886       5.158033      44.86122       7.087612      32.05791       7.520764  475.6560 38.70452 398.6647 49.65255 76.99136       62.95566 
1 1 1 -6  5  22 o 265.1105 53.75616 14.52746       5.345173      18.29152       7.239385      10.01604       7.925566  295.2132 64.91194 225.7341 76.19341 69.47913       100.0949 
1 1 1 -6  5  23 o 574.7965 27.31177 64.73283       6.096659      73.73093       8.609162      55.68093       8.634852  610.2744 36.49246 528.1781 42.45524 82.09625       55.98345 
1 1 1 -6  5  24 o 375.0668 41.32709 28.28593       5.919736      30.01548       8.241526      26.44255       8.508394  380.7070 57.53772 354.2393 64.21209 26.46765       86.21938 
1 1 1 -6  5  25 o 355.7130 47.10064 25.82383       6.346585      36.87476       8.758030      13.60325       9.209859  422.9002 54.60139 252.0856 82.04499 170.8145       98.55299 
1 1 1 -6  5  26 o 277.5895 69.88067 16.83294       7.528171      19.15755       8.878380      10.88576       14.20084  293.7679 76.91623 249.2595 98.73080 44.50844       125.1554 
1 1 1 -6  5  27 o 338.3268 52.10243 23.92106       6.626067      22.76483       9.455428      25.03674       9.288158  317.6071 77.37287 335.6205 73.31277 -18.01340      106.5895 
1 1 1 -6  5  28 o 218.8812 69.79632 10.60034       6.689103      8.691457       9.356493      12.59594       9.566648  211.5504 81.17799 237.1418 83.55855 -25.59142      116.4985 
1 1 1 -6  5  29 o 216.4453 75.13744 10.68023       7.720184      26.91547       13.48035      2.756448       9.417550  315.5562 98.89603 176.1325 75.88466 139.4236       124.6551 
1 1 1 -6  5  30 o 217.8021 83.29716 11.41321       9.830860      0.000000       0.000000      11.41321       9.830860  ?        ?        217.8021 83.29716 0.000000       83.29716 
1 1 1 -6  5  31 o 133.4008 60.73296 -1.220859      6.917070      -2.878887      9.741061      0.4654874      9.823894  148.2475 69.10745 159.8656 72.62540 -11.61815      100.2511 
1 1 1 -6  5  32 o 260.8890 76.46666 19.34932       8.248000      22.19356       14.44152      17.97243       10.04801  240.7598 98.09047 237.9017 85.44014 2.858078       130.0837 
1 1 1 -6  5  33 o 256.8224 75.23392 19.86253       7.986132      19.34912       10.37474      20.60913       12.51107  231.2911 86.20005 225.4864 91.51505 5.804749       125.7197 
1 1 1 -6  6  1  o 527.3561 13.48542 54.05493       2.761828      53.37916       3.934018      54.71166       3.878208  523.7761 19.34028 530.3012 18.83131 -6.525146      26.99379 
1 1 1 -6  6  2  o 976.1438 12.70098 185.1891       4.814809      186.0458       6.819629      184.3378       6.798757  977.9605 17.95608 973.4584 17.98391 4.502075       25.41342 
1 1 1 -6  6  3  o 620.0696 13.31267 74.73477       3.205779      75.25404       4.497262      74.19835       4.570948  621.9164 18.62037 617.5092 19.06053 4.407166       26.64623 
1 1 1 -6  6  4  o 626.6174 13.61255 76.32864       3.312608      77.71821       4.646890      74.89285       4.723521  631.9663 18.93392 620.3243 19.60736 11.64197       27.25696 
1 1 1 -6  6  5  o 1151.581 13.44787 257.8039       6.014172      267.1404       8.758647      249.4746       8.272780  1171.537 19.25098 1132.198 18.81486 39.33899       26.91839 
1 1 1 -6  6  6  o 1756.751 15.89903 600.3063       10.84698      603.9665       15.43886      596.7385       15.24292  1760.546 22.58082 1750.021 22.42834 10.52527       31.82646 
1 1 1 -6  6  7  o 511.6319 22.26056 51.02003       4.423048      0.000000       0.000000      51.02003       4.423048  ?        ?        511.6319 22.26056 0.000000       22.26056 
1 1 1 -6  6  8  o 345.2073 25.28099 23.38672       3.365664      22.01246       5.842422      24.06931       4.117535  330.5721 46.81806 349.3850 30.65610 -18.81290      55.96184 
1 1 1 -6  6  9  o 159.3801 52.45550 4.872947       3.760810      5.544343       5.537971      4.298316       5.123369  177.4897 63.46349 163.5871 60.65276 13.90260       87.78594 
1 1 1 -6  6  10 o 453.1402 26.85146 40.33429       4.704224      42.65175       6.693928      38.07296       6.612375  463.5522 37.50524 437.3084 39.35674 26.24374       54.36540 
1 1 1 -6  6  11 o 526.1292 18.53827 53.99442       3.787823      48.08092       5.233121      60.50190       5.489663  494.4361 27.35994 555.8263 25.43189 -61.39020      37.35435 
1 1 1 -6  6  12 f 245.1184 34.98660 12.10658       3.235967      15.00824       4.547681      9.130588       4.605566  270.6783 44.83128 208.3563 55.80109 62.32193       71.57937 
1 1 1 -6  6  13 o 897.1537 18.11384 157.1326       6.311105      158.1842       11.29095      156.6547       7.611079  894.8482 32.49027 894.6801 21.90536 0.1680908      39.18498 
1 1 1 -6  6  14 o 713.7667 20.50908 99.62738       5.684999      91.57256       9.821267      103.6862       6.971721  677.7963 37.45665 727.0114 24.69283 -49.21515      44.86353 
1 1 1 -6  6  15 o 297.6136 38.99091 17.90071       4.398149      20.78770       5.463164      12.58336       7.414279  319.0240 45.37402 241.8475 72.90058 77.17644       85.86790 
1 1 1 -6  6  16 o 871.3611 19.54792 148.2778       6.614953      152.2657       8.153841      140.5999       11.31392  881.7866 23.81062 843.4166 34.54163 38.37000       41.95318 
1 1 1 -6  6  17 o 314.2454 35.59267 19.73552       4.267078      16.37980       6.007022      23.15349       6.062481  279.7692 57.21776 337.2206 47.61709 -57.45145      74.43963 
1 1 1 -6  6  18 o 660.1016 20.73061 85.04369       5.314359      91.27785       7.651192      79.23256       7.387044  682.2324 28.87811 635.3921 29.93649 46.84033       41.59494 
1 1 1 -6  6  19 o 241.5868 50.19212 12.04569       4.555252      10.48542       6.308416      13.74559       6.584658  225.0117 67.11383 255.3945 65.93563 -30.38286      94.08386 
1 1 1 -6  6  20 f 419.0053 31.14562 34.60290       5.031859      29.47260       6.722278      41.14045       7.588439  382.9908 46.12355 454.0701 43.56789 -71.07925      63.44717 
1 1 1 -6  6  21 o 164.7287 59.19057 4.694217       4.822953      3.451256       6.377847      6.354316       7.370759  167.7415 66.25310 195.8714 72.72421 -28.12991      98.37827 
1 1 1 -6  6  22 o 463.9487 30.88548 42.40286       5.533036      46.51200       7.586529      37.73342       8.087237  483.5182 40.78260 432.7672 48.98154 50.75104       63.73705 
1 1 1 -6  6  23 o 582.5059 26.33965 66.46201       5.958519      57.65193       8.265701      75.99319       8.597315  538.1569 39.83260 619.6009 35.88276 -81.44397      53.61164 
1 1 1 -6  6  24 o 190.1835 64.79928 7.053134       5.732920      0.9852695      7.658608      14.78656       8.646049  162.6959 69.22151 261.6364 78.69177 -98.94054      104.8046 
1 1 1 -6  6  25 o 826.4697 23.85448 133.8502       7.656404      142.6819       10.61531      124.2741       11.05356  850.1497 32.15211 791.7954 35.94688 58.35425       48.22796 
1 1 1 -6  6  26 o 373.1341 54.63783 28.98775       7.682888      31.72726       9.233608      22.82354       13.85077  386.2372 63.78538 312.1346 100.5306 74.10266       119.0587 
1 1 1 -6  6  27 o 701.7674 27.17850 97.16453       7.407074      106.8091       10.43064      87.35349       10.52030  730.0690 36.90890 657.4075 41.41824 72.66150       55.47736 
1 1 1 -6  6  28 o 307.1437 59.59482 20.62161       6.852069      17.68559       9.466406      23.85279       9.930848  272.5366 82.42383 317.5368 80.43930 -45.00018      115.1702 
1 1 1 -6  6  29 o 117.1904 57.46557 -14.37910      8.906775      0.000000       0.000000      -14.37910      8.906775  ?        ?        117.1904 57.46557 0.000000       57.46557 
1 1 1 -6  6  30 o 221.1426 84.07763 12.18659       9.979086      0.000000       0.000000      12.18659       9.979086  ?        ?        221.1426 84.07763 0.000000       84.07763 
1 1 1 -6  6  31 o 197.4715 75.26989 9.741985       8.010648      24.12167       13.90375      2.596842       9.800828  267.1564 99.74556 166.5660 74.36150 100.5904       124.4139 
1 1 1 -6  6  32 o 205.2258 70.74991 11.60918       6.839168      6.418158       9.495741      17.20446       9.858547  173.8518 75.54664 231.7438 84.43029 -57.89201      113.2951 
1 1 1 -6  6  33 o 267.7155 72.67193 20.99665       7.749342      18.21728       9.987300      25.20153       12.28433  225.1315 84.44287 247.9220 93.51754 -22.79044      126.0005 
1 1 1 -6  7  1  o 742.6461 13.18711 107.2034       3.803292      111.2999       4.588024      98.20464       6.800009  756.5458 15.61574 709.8825 24.66579 46.66333       29.19336 
1 1 1 -6  7  2  o 789.7869 17.89867 121.3557       5.489827      121.3557       5.489827      0.000000       0.000000  789.7869 17.89867 ?        ?        0.000000       17.89867 
1 1 1 -6  7  3  o 1137.836 13.27917 251.6736       5.867847      248.3817       8.205167      255.1195       8.394862  1129.756 18.70142 1144.953 18.87982 -15.19690      26.57425 
1 1 1 -6  7  4  o 1072.021 13.25933 223.4118       5.520171      225.9090       7.835742      220.9512       7.777979  1077.377 18.72771 1065.480 18.79722 11.89673       26.53418 
1 1 1 -6  7  5  o 543.6693 14.77206 57.48218       3.118918      57.78624       4.374896      57.16792       4.447636  544.7050 20.68133 541.7465 21.14001 2.958496       29.57393 
1 1 1 -6  7  6  o 794.4203 13.71532 122.7213       4.231403      126.4621       6.057666      119.1569       5.913166  805.8661 19.35595 782.2313 19.46511 23.63483       27.45074 
1 1 1 -6  7  7  o 394.0420 21.50834 30.35562       3.278929      32.82031       5.680464      29.12405       4.015431  407.3226 36.29029 385.1772 27.01471 22.14539       45.24135 
1 1 1 -6  7  8  o 682.5901 17.14207 90.72441       4.544137      86.39275       7.501784      93.23497       5.711139  664.3688 29.07551 691.4532 21.26826 -27.08435      36.02394 
1 1 1 -6  7  9  o 458.6848 25.63817 41.27189       4.548701      36.21729       6.269470      46.88993       6.609675  426.8598 38.22440 486.9094 35.19156 -60.04953      51.95720 
1 1 1 -6  7  10 o 98.26104 42.07319 -0.5049449E-01 2.862006      0.8776136E-01  4.138812      -0.1771869     3.961953  118.6919 50.70213 114.3394 49.24091 4.352554       70.67795 
1 1 1 -6  7  11 o 895.0040 15.09937 156.0525       5.248217      162.8667       7.566857      149.7359       7.285344  912.8468 21.34468 875.2517 21.43330 37.59509       30.24867 
1 1 1 -6  7  12 o 407.7133 23.15339 32.65381       3.650923      36.05745       5.178027      29.28892       5.148469  426.4836 31.48588 383.1862 34.98291 43.29745       47.06553 
1 1 1 -6  7  13 o 1183.431 17.99160 273.4058       8.268766      249.5309       13.54902      287.5754       10.43797  1124.675 31.02077 1212.032 22.17551 -87.35706      38.13190 
1 1 1 -6  7  14 o 191.8558 54.19152 7.707286       4.215568      7.426388       5.224315      8.231503       7.136923  190.9908 61.76520 205.3438 72.18900 -14.35301      95.00627 
1 1 1 -6  7  15 o 521.6081 24.47021 53.32302       4.956898      53.99765       5.959195      51.80797       8.930294  523.0200 29.45868 506.4267 45.90574 16.59329       54.54494 
1 1 1 -6  7  16 o 1005.387 16.79180 197.0551       6.556298      190.9700       9.069334      203.7162       9.488901  987.8235 23.64112 1020.152 23.95098 -32.32806      33.65341 
1 1 1 -6  7  17 o 1240.237 16.66809 299.7165       8.028204      321.0038       11.92020      282.0448       10.86079  1281.168 23.95794 1201.146 23.28293 80.02185       33.40775 
1 1 1 -6  7  18 o 827.5150 18.45201 133.4775       5.929904      131.9343       8.243611      135.1323       8.536349  821.2127 25.84841 830.9597 26.45235 -9.746948      36.98469 
1 1 1 -6  7  19 o 984.6420 17.81988 188.8716       6.814139      194.1531       9.636103      183.5890       9.637195  996.7761 24.89292 969.1010 25.60670 27.67511       35.71219 
1 1 1 -6  7  20 o 581.9935 23.97657 66.13699       5.419175      76.04959       7.704789      56.43219       7.623599  621.9437 32.00786 534.3456 36.96467 87.59814       48.89672 
1 1 1 -6  7  21 o 467.2768 29.94828 42.94614       5.406074      42.23689       7.327629      43.79329       8.008324  460.7219 41.39585 468.3147 44.57036 -7.592743      60.82873 
1 1 1 -6  7  22 o 409.3579 35.52901 33.23369       5.592237      30.43388       7.217820      37.43843       8.845279  387.9186 49.00449 429.0407 54.30229 -41.12204      73.14491 
1 1 1 -6  7  23 o 178.6313 62.34439 5.958374       5.318498      4.028721       7.068487      8.476376       8.074487  176.1184 69.68893 213.1884 76.58846 -37.06996      103.5487 
1 1 1 -6  7  24 o 428.4232 36.71560 36.60870       6.049719      28.04725       8.213694      46.76048       8.944086  366.3932 59.78711 480.1021 48.64192 -113.7088      77.07487 
1 1 1 -6  7  25 o 531.9286 38.82382 56.58020       7.964705      48.93149       9.352899      76.76340       15.19313  489.8491 49.86009 604.8093 65.74345 -114.9602      82.51199 
1 1 1 -6  7  26 o 320.2267 61.92760 21.93051       7.422855      18.86390       8.727653      29.94859       14.11249  290.7894 76.32050 354.6561 98.79467 -63.86673      124.8407 
1 1 1 -6  7  27 o 452.6785 40.05579 41.54256       6.969097      38.09349       9.763372      45.12539       9.950884  421.7568 61.41164 462.6786 56.55763 -40.92178      83.48746 
1 1 1 -6  7  28 o 113.0912 53.80137 -6.796912      6.465028      -6.137555      9.251543      -7.426190      9.038054  142.9268 66.86532 137.1504 64.76070 5.776413       93.08555 
1 1 1 -6  7  29 o 301.7819 81.98614 22.88277       9.858344      0.000000       0.000000      22.88277       9.858344  ?        ?        301.7819 81.98614 0.000000       81.98614 
1 1 1 -6  7  30 o 255.3514 76.38345 16.73698       8.162646      8.241841       13.66694      21.44768       10.17721  207.2995 90.35190 280.4848 85.60449 -73.18524      124.4652 
1 1 1 -6  7  31 o 236.2215 70.20265 14.54623       6.911726      2.727321       9.393279      28.50047       10.20661  163.7901 72.98409 320.2697 81.77618 -156.4796      109.6085 
1 1 1 -6  7  32 f 300.9532 60.07325 22.56707       6.775205      20.12725       9.308157      25.31623       9.880620  252.8287 82.49119 285.3434 83.70994 -32.51468      117.5251 
1 1 1 -6  7  33 o 147.2740 64.65019 3.801131       7.109320      6.749944       8.895594      -1.412041      11.82775  165.5732 72.50912 148.3315 71.16041 17.24165       101.5942 
1 1 1 -6  8  1  o 307.7998 20.65112 18.53065       2.454233      18.92016       2.981796      17.71257       4.321315  310.5246 24.93632 298.2320 38.18779 12.29257       45.60842 
1 1 1 -6  8  2  o 276.0696 20.80609 14.92595       2.214283      15.19700       3.055926      14.62633       3.212906  277.5159 28.77295 271.8461 30.98686 5.669739       42.28555 
1 1 1 -6  8  3  f 236.4868 25.01252 11.02767       2.262302      9.615265       3.143613      12.54493       3.258221  218.2626 38.49388 250.8659 34.34537 -32.60332      51.58860 
1 1 1 -6  8  4  o 677.0124 15.80569 89.16495       4.155642      82.95547       6.946708      92.62550       5.185905  651.8016 27.44325 689.7062 19.36121 -37.90460      33.58554 
1 1 1 -6  8  5  o 637.3309 16.31829 79.03876       4.038942      76.29716       6.661802      80.63226       5.078843  624.9817 27.44710 643.3511 20.32772 -18.36945      34.15493 
1 1 1 -6  8  6  o 423.7935 20.17506 34.99706       3.320451      32.69932       5.595947      36.24567       4.125133  406.5974 35.80424 430.1993 24.79614 -23.60196      43.55219 
1 1 1 -6  8  7  o 173.8950 43.84774 6.209559       2.960528      13.77965       5.165570      2.506674       3.612750  258.4381 53.23944 132.7744 50.56285 125.6638       73.42371 
1 1 1 -6  8  8  o 537.2626 22.96191 56.37161       4.790961      62.24931       7.054650      51.34032       6.526961  562.0737 32.45683 510.1187 33.12605 51.95508       46.37651 
1 1 1 -6  8  9  o 204.5948 51.53341 8.713015       4.092445      14.13298       5.884921      3.637352       5.694936  259.2887 59.67981 162.2379 63.03805 97.05081       86.80712 
1 1 1 -6  8  10 o 643.6190 16.06105 80.72634       4.014494      79.25375       5.690365      82.18552       5.664429  636.5201 23.01972 648.2927 22.49868 -11.77258      32.18848 
1 1 1 -6  8  11 o 748.1221 15.91409 109.1000       4.623623      105.7227       6.479173      112.6046       6.600085  734.9837 22.69937 758.6049 22.40298 -23.62122      31.89287 
1 1 1 -6  8  12 o 191.5025 52.30556 7.680612       3.999928      7.481999       7.229344      7.768238       4.801903  200.1468 72.39470 193.4237 58.75012 6.723099       93.23395 
1 1 1 -6  8  13 o 861.0729 19.16779 144.8333       6.409731      149.9478       11.67406      142.6261       7.669120  870.3483 34.53829 853.3258 23.14210 17.02246       41.57463 
1 1 1 -6  8  14 o 589.2255 22.19198 67.93626       5.078151      66.44051       6.252930      70.83392       8.703127  581.4636 27.69065 596.2265 37.78215 -14.76294      46.84296 
1 1 1 -6  8  15 o 565.3026 23.75199 62.55790       5.214455      63.59699       6.435997      60.57262       8.896090  568.0645 29.27314 550.0963 41.95855 17.96814       51.16088 
1 1 1 -6  8  16 o 259.9379 42.10593 13.73874       4.105124      13.60791       5.668324      13.88305       5.953189  254.3768 58.58712 256.4856 60.70947 -2.108765      84.36878 
1 1 1 -6  8  17 o 362.2799 32.37977 25.99384       4.507595      22.05404       6.167450      30.51162       6.604357  328.9032 49.84687 389.5918 44.44641 -60.68863      66.78468 
1 1 1 -6  8  18 o 167.5342 57.37569 5.238784       4.494827      -2.258114      6.056417      14.43136       6.706463  130.2994 58.29235 261.6860 66.00047 -131.3866      88.05714 
1 1 1 -6  8  19 o 171.3848 57.81768 5.554715       4.563674      7.909472       6.104765      2.571764       6.870984  201.4037 66.85839 166.3880 67.71001 35.01564       95.15614 
1 1 1 -6  8  20 o 776.9202 20.53268 117.6795       6.195125      127.4833       8.648988      107.3497       8.877958  807.3295 27.58586 740.1619 30.88577 67.16760       41.41147 
1 1 1 -6  8  21 o 701.2163 22.36306 95.96490       6.089915      107.6497       8.476344      83.49834       8.755310  741.3021 29.44323 650.8574 34.76418 90.44470       45.55713 
1 1 1 -6  8  22 o 586.2235 26.14279 67.27026       5.951728      66.94855       8.116965      67.64435       8.753006  581.6396 36.11296 583.8180 38.82713 -2.178345      53.02539 
1 1 1 -6  8  23 o 209.3561 63.30592 9.104877       5.584620      9.549806       7.563216      8.571463       8.281221  218.7946 74.42844 214.4623 77.49648 4.332352       107.4490 
1 1 1 -6  8  24 o 428.9749 36.85613 36.72932       6.080394      29.50430       8.062512      46.25805       9.259081  376.9847 56.83614 476.3289 50.83874 -99.34415      76.25565 
1 1 1 -6  8  25 o 280.2108 68.87182 17.06589       7.441564      23.48919       8.813527      1.116102       13.88827  328.6685 71.11552 208.2877 90.92326 120.3808       115.4316 
1 1 1 -6  8  26 o 187.4265 66.85855 6.747892       6.142896      10.66216       8.640113      2.746809       8.735406  226.6614 79.44256 178.4443 74.81893 48.21710       109.1283 
1 1 1 -6  8  27 o 352.2939 52.11597 26.14571       6.915056      18.87146       9.403671      34.71087       10.20401  284.2610 81.16393 396.4013 68.77776 -112.1403      106.3859 
1 1 1 -6  8  28 o 295.4666 69.36543 20.10401       7.823157      51.70992       14.16984      6.245995       9.382777  467.2487 81.02583 194.4361 79.12407 272.8126       113.2511 
1 1 1 -6  8  29 o 166.0107 71.12080 2.819299       8.186111      -11.25040      14.35370      9.601566       9.965721  162.0909 77.92680 209.7150 82.82211 -47.62405      113.7193 
1 1 1 -6  8  30 o 315.8385 67.68457 24.20314       8.052320      33.25433       13.27143      18.92979       10.12998  334.4446 96.70304 260.2625 86.11125 74.18219       129.4860 
1 1 1 -6  8  31 o 105.1486 51.11274 -8.224176      6.616033      -10.49499      9.111089      -5.691108      9.622838  121.2046 59.15303 136.3828 65.09084 -15.17826      87.95396 
1 1 1 -6  8  32 o 128.4504 58.90922 -0.4971537     6.665661      -3.984199      9.096014      3.547416       9.796219  132.9744 63.41422 159.9971 72.62267 -27.02267      96.41273 
1 1 1 -6  8  33 o 157.6657 66.83298 5.971281       7.094036      7.436200       8.776958      3.211133       12.04768  167.3696 72.68034 159.0335 74.99451 8.336029       104.4347 
1 1 1 -6  9  1  o 766.3892 15.48783 114.2574       4.609651      117.1074       5.972154      110.0569       7.250206  775.4398 19.83147 751.0989 24.85566 24.34088       31.79765 
1 1 1 -6  9  2  o 706.4171 16.10341 97.09404       4.417811      93.60304       5.562614      103.0573       7.270197  693.1519 20.66439 726.6513 25.76274 -33.49939      33.02629 
1 1 1 -6  9  3  o 519.2924 17.53930 52.49260       3.537140      47.77644       5.769876      55.33212       4.477080  493.3028 30.26414 532.8087 21.63692 -39.50592      37.20316 
1 1 1 -6  9  4  o 696.6742 16.06685 94.45280       4.346989      92.23767       7.221231      95.71168       5.443834  687.0680 27.06347 700.8776 20.00022 -13.80957      33.65175 
1 1 1 -6  9  5  o 751.8069 15.97499 110.0095       4.664175      118.8617       8.189233      105.7592       5.674477  779.7661 27.04275 736.6731 19.83458 43.09302       33.53686 
1 1 1 -6  9  6  o 1227.284 16.34237 293.2650       7.789117      304.2313       13.73236      288.0633       9.457703  1246.645 28.36446 1215.528 20.03515 31.11658       34.72679 
1 1 1 -6  9  7  o 558.7762 18.30850 60.85689       3.973000      55.89294       6.589727      63.69173       4.979879  532.5199 32.01296 571.1017 22.45315 -38.58185      39.10209 
1 1 1 -6  9  8  o 257.9106 33.67638 13.31025       3.292526      10.78145       4.032884      18.36499       5.701747  228.5748 47.00140 298.9651 50.93470 -70.39038      69.30711 
1 1 1 -6  9  9  o 315.3086 25.92285 19.61226       3.146178      16.85547       4.281535      22.84806       4.638623  289.1199 39.13836 338.2317 35.86101 -49.11176      53.08317 
1 1 1 -6  9  10 o 158.9707 45.58431 5.185844       2.960033      4.803509       4.250385      5.545899       4.124683  160.4632 55.74880 167.6259 54.92322 -7.162704      78.25911 
1 1 1 -6  9  11 o 523.6860 19.09218 53.55970       3.882885      50.61569       5.405355      56.69852       5.581331  506.7933 27.56779 537.3314 26.74654 -30.53802      38.41042 
1 1 1 -6  9  12 o 138.3507 52.76397 2.847887       3.937764      5.531592       7.119279      1.664951       4.726604  185.4320 70.89246 136.8436 55.97626 48.58846       90.32764 
1 1 1 -6  9  13 o 870.1349 16.48796 147.6399       5.571621      162.7451       8.174208      134.5326       7.614462  911.7214 23.08636 828.7672 23.65804 82.95422       33.05576 
1 1 1 -6  9  14 o 197.4967 54.79333 8.149520       4.350255      0.5759625      5.207383      25.64530       7.914732  135.0871 57.26112 350.0211 60.40866 -214.9341      83.23486 
1 1 1 -6  9  15 o 880.1545 19.86049 151.2092       6.788548      151.5089       8.359223      150.6286       11.63390  879.8448 24.46425 873.9825 34.27635 5.862305       42.11137 
1 1 1 -6  9  16 o 185.4150 54.87306 7.036090       4.229361      7.575578       5.993837      6.501122       5.968680  197.0928 66.26180 187.5778 66.01100 9.515030       93.53116 
1 1 1 -6  9  17 o 178.2734 56.42641 6.324078       4.378120      -0.8374869     6.069954      14.08993       6.320857  137.7231 60.11501 258.8758 63.38090 -121.1527      87.35532 
1 1 1 -6  9  18 o 505.6646 25.99083 50.11345       5.086744      49.71219       7.230731      50.50659       7.157317  501.1595 37.42160 505.3442 36.72087 -4.184692      52.42899 
1 1 1 -6  9  19 o 121.4558 53.02676 -0.7894186     4.725350      -2.189879      6.529495      0.7506076      6.847124  136.5580 60.84968 155.4288 65.75956 -18.87083      89.59354 
1 1 1 -6  9  20 o 852.2103 20.16405 141.5768       6.673482      145.8362       9.143270      136.7209       9.762600  863.5383 27.26415 835.4678 30.08900 28.07050       40.60397 
1 1 1 -6  9  21 o 693.7379 22.96736 93.98032       6.187775      93.17595       8.329849      94.97070       9.242865  689.1446 31.12424 694.9986 34.24480 -5.854004      46.27554 
1 1 1 -6  9  22 o 598.5335 26.73781 70.18796       6.215017      78.40885       8.733198      61.75214       8.846623  629.4042 35.87716 556.5873 41.22066 72.81689       54.64718 
1 1 1 -6  9  23 o 583.4616 28.77362 66.88873       6.519807      64.42126       8.749417      69.96963       9.776670  568.2328 39.90129 591.1019 42.88107 -22.86908      58.57388 
1 1 1 -6  9  24 o 763.7818 27.96149 114.6726       8.293878      109.6642       9.672634      128.5807       16.11858  744.9690 33.43325 795.1402 52.49349 -50.17120      62.23623 
1 1 1 -6  9  25 o 165.1067 69.36331 1.878993       7.532027      -6.854342      8.800172      25.80061       14.56453  140.3347 65.50797 329.9615 102.6959 -189.6268      121.8103 
1 1 1 -6  9  26 o 441.1814 45.40184 39.80100       7.667851      44.04037       12.01830      36.89059       9.957933  448.8800 71.32825 414.7417 63.87511 34.13834       95.74837 
1 1 1 -6  9  27 o 168.0100 67.06818 4.154300       6.600189      11.39621       9.102198      -3.875624      9.584630  227.9194 81.37615 154.1251 70.66771 73.79427       107.7776 
1 1 1 -6  9  28 o 280.1567 73.69334 18.64881       8.125401      31.60040       14.41228      12.61393       9.837968  339.6201 101.4748 231.7411 84.35541 107.8790       131.9583 
1 1 1 -6  9  29 o 121.8971 57.15727 -4.645835      6.826447      -8.483582      9.790557      -1.014898      9.523106  136.6218 65.32977 157.4665 71.52371 -20.84467      96.86909 
1 1 1 -6  9  30 o 303.9113 69.07571 22.93985       7.967798      11.75780       13.17672      29.38529       10.00398  214.3367 90.98312 334.6817 78.35141 -120.3450      120.0703 
1 1 1 -6  9  31 o 228.2030 76.77643 14.94056       8.047062      7.354116       10.25953      27.06966       12.97247  181.7992 78.76256 275.1435 97.26405 -93.34431      125.1553 
1 1 1 -6  9  32 o 178.9527 68.62244 8.776027       6.683207      10.86039       9.106554      6.342975       9.838830  189.3216 77.59923 168.8824 75.00648 20.43916       107.9241 
1 1 1 -6  10 1  o 554.0557 15.20246 59.73180       3.271111      57.36483       3.880086      65.54754       6.082016  542.7049 18.40982 579.1048 27.04347 -36.39990      32.71499 
1 1 1 -6  10 2  o 661.2057 16.73260 85.11201       4.296630      86.01553       5.483029      83.67442       6.916257  664.1813 21.25719 654.2123 27.22227 9.968994       34.53868 
1 1 1 -6  10 3  o 811.1666 15.51889 128.0634       4.888759      138.5940       8.493275      122.8457       5.978459  842.1046 25.97055 793.9545 19.38946 48.15009       32.41019 
1 1 1 -6  10 4  o 798.7813 15.69872 124.2079       4.869901      123.0710       8.164097      124.8360       6.067570  793.2705 26.50079 800.2471 19.52373 -6.976563      32.91607 
1 1 1 -6  10 5  o 455.8933 19.83629 40.53149       3.511977      40.47610       5.789282      40.56374       4.417687  452.6739 33.16229 454.8091 25.10865 -2.135254      41.59546 
1 1 1 -6  10 6  o 351.6708 21.39818 24.23220       2.908514      26.37031       4.105777      22.07844       4.120783  365.5549 29.16382 333.6669 32.20079 31.88797       43.44444 
1 1 1 -6  10 7  o 1052.535 14.18917 215.6731       5.799915      210.8717       7.981688      221.0446       8.442318  1039.488 19.77185 1064.086 20.42947 -24.59802      28.43043 
1 1 1 -6  10 8  o 113.9032 45.52026 1.369982       3.043972      -2.050298      3.850942      7.065806       4.969520  100.5493 45.59841 187.3649 60.20343 -86.81557      75.52263 
1 1 1 -6  10 9  o 690.1427 15.73954 92.82679       4.218509      91.87859       5.969176      93.77290       5.962575  685.3134 22.42834 692.4000 22.17424 -7.086609      31.53930 
1 1 1 -6  10 10 o 506.3117 18.85543 50.05186       3.707510      58.79064       5.457821      42.56409       5.052078  547.4552 25.67100 464.5283 28.13734 82.92694       38.08819 
1 1 1 -6  10 11 o 237.1154 38.46801 11.43432       3.420934      13.55270       4.975472      9.535006       4.711200  254.6446 52.06870 212.5820 56.20815 42.06261       76.61922 
1 1 1 -6  10 12 o 794.8889 19.18470 123.3795       5.922287      118.7312       10.55166      125.5173       7.155671  774.7217 35.07092 800.7656 23.01002 -26.04382      41.94556 
1 1 1 -6  10 13 o 176.5258 54.73980 6.328652       4.142350      6.185163       5.186240      6.581491       6.884367  179.5754 61.62685 192.3629 70.48250 -12.78755      93.62506 
1 1 1 -6  10 14 o 767.8736 20.72217 115.1436       6.179495      120.3309       7.683197      105.6410       10.39897  783.9095 25.23760 730.2026 36.78880 53.70697       44.61336 
1 1 1 -6  10 15 o 622.7028 23.30381 75.78178       5.635542      71.48049       6.854507      84.75430       9.899978  603.6579 29.23865 653.5966 39.18366 -49.93872      48.89027 
1 1 1 -6  10 16 o 700.0933 19.74643 95.57654       5.368743      94.92957       7.530338      96.24534       7.656329  696.2643 27.84917 701.0150 28.12324 -4.750610      39.57895 
1 1 1 -6  10 17 o 247.0101 48.90422 12.53109       4.525257      20.38926       6.345101      4.396611       6.455692  315.4811 53.71363 175.0242 67.36454 140.4569       86.15762 
1 1 1 -6  10 18 o 570.5824 24.43259 63.57029       5.413971      58.03569       7.385439      69.99921       7.959805  542.4489 35.24940 596.1267 34.53025 -53.67780      49.34428 
1 1 1 -6  10 19 o 263.7191 51.59082 14.28654       5.094498      9.781520       7.186441      18.83765       7.223115  221.8528 72.48717 300.5446 63.85511 -78.69179      96.60158 
1 1 1 -6  10 20 o 590.7004 25.66886 68.19935       5.888462      55.82294       7.945736      83.27763       8.770268  530.8443 38.81146 650.0507 34.86783 -119.2064      52.17370 
1 1 1 -6  10 21 f 542.7051 27.66688 57.84164       5.811766      60.83311       7.983175      54.46846       8.477212  554.0917 37.31662 522.7198 42.11689 31.37195       56.27044 
1 1 1 -6  10 22 o 382.5781 39.58540 29.30272       5.796357      38.92849       7.795021      17.39737       8.669035  439.2608 46.39692 283.4093 76.83475 155.8515       89.75664 
1 1 1 -6  10 23 o 507.4045 46.39895 51.97932       9.041831      51.97932       9.041831      0.000000       0.000000  507.4045 46.39895 ?        ?        0.000000       46.39895 
1 1 1 -6  10 24 f 176.2772 70.16898 4.099483       7.205800      7.301504       8.193669      -6.829583      15.13763  203.7387 76.47228 192.2653 88.39639 11.47342       116.8843 
1 1 1 -6  10 25 o 176.8905 78.70425 -1.475217      10.87989      -1.475217      10.87989      0.000000       0.000000  176.8905 78.70425 ?        ?        0.000000       78.70425 
1 1 1 -6  10 26 o 176.3406 68.09123 5.142887       6.612425      5.980153       9.271641      4.276186       9.433215  197.4053 79.24813 189.2490 78.41610 8.156326       111.4870 
1 1 1 -6  10 27 o 378.5960 49.93934 30.24466       7.163347      30.29227       10.13669      30.19716       10.12432  362.3035 74.53077 361.7038 74.55370 0.5997009      105.4186 
1 1 1 -6  10 28 o 144.4914 65.49790 -1.789502      7.935450      -20.32061      14.27871      6.491866       9.545294  146.6336 72.07585 193.3988 79.37887 -46.76523      107.2191 
1 1 1 -6  10 29 o 584.3721 33.97985 69.95277       7.678207      80.54996       10.59232      58.21861       11.14608  615.9034 44.58596 509.3445 57.34608 106.5590       72.63940 
1 1 1 -6  10 30 o 117.4924 57.75090 -13.05202      9.165774      -12.03429      12.46022      -14.25212      13.53056  141.8748 69.22665 143.9563 70.63838 -2.081497      98.90455 
1 1 1 -6  10 31 o 115.6740 54.73783 -3.937086      6.520219      -9.179209      9.286817      1.158981       9.156528  123.2106 60.04134 151.4522 69.30567 -28.24158      91.69645 
1 1 1 -6  10 32 o 155.1554 65.06104 5.367644       6.606565      7.174031       9.371926      3.583318       9.314526  169.7007 74.36816 155.3415 70.62695 14.35919       102.5611 
1 1 1 -6  11 1  o 440.6870 17.03892 37.82776       2.916085      36.61965       3.490298      40.62043       5.306643  433.2683 20.74329 454.1697 30.25987 -20.90143      36.68710 
1 1 1 -6  11 2  f 713.1232 14.48888 98.97583       4.012614      98.65550       4.745961      99.77883       7.514153  711.6365 17.17268 713.9577 27.10064 -2.321228      32.08342 
1 1 1 -6  11 3  o 1364.281 14.76654 362.3138       7.823671      359.6340       9.077275      370.0557       15.42874  1358.624 17.20395 1373.956 28.91542 -15.33215      33.64635 
1 1 1 -6  11 4  o 699.5078 14.40974 95.24890       3.914502      101.1095       5.620172      89.72697       5.455389  719.8634 20.10349 678.0331 20.71795 41.83026       28.86839 
1 1 1 -6  11 5  o 889.4604 13.92717 153.9989       4.810801      156.1346       6.773860      151.8254       6.833531  894.5544 19.49851 882.0244 19.94971 12.52997       27.89593 
1 1 1 -6  11 6  o 948.8687 13.98880 175.2867       5.154834      177.4045       7.263163      173.1372       7.317209  953.3781 19.61700 941.7448 20.00711 11.63324       28.01984 
1 1 1 -6  11 7  o 545.3010 19.22676 58.04112       4.071650      57.50964       4.983493      59.10824       7.061492  542.0716 23.67278 546.4481 33.43597 -4.376465      40.96785 
1 1 1 -6  11 8  o 642.4545 18.58908 80.55534       4.637974      85.31345       5.815488      72.24029       7.687785  660.3376 22.67734 604.2836 32.88290 56.05408       39.94430 
1 1 1 -6  11 9  o 728.7029 15.63924 103.4913       4.425825      102.9372       6.243655      104.0508       6.274583  725.4023 22.16317 729.3179 22.15338 -3.915527      31.33654 
1 1 1 -6  11 10 o 632.1725 17.15084 77.94720       4.210649      78.35865       6.042354      77.55875       5.870862  632.3562 24.60460 629.2537 24.02415 3.102539       34.38818 
1 1 1 -6  11 11 o 177.2265 52.29757 6.465507       3.846514      5.988136       7.318089      6.647737       4.521475  190.5055 72.10280 181.2068 57.34148 9.298691       92.12415 
1 1 1 -6  11 12 o 415.4177 37.20647 34.41476       5.938903      37.61259       8.966882      31.91579       7.926727  427.9977 55.23659 394.6088 53.07036 33.38889       76.59990 
1 1 1 -6  11 13 o 527.7438 24.44696 54.50077       5.010442      53.88338       6.194110      55.66945       8.522024  522.7347 30.64586 527.9023 41.91302 -5.167603      51.92177 
1 1 1 -6  11 14 o 373.5067 32.74825 27.63453       4.702268      28.61909       5.833372      25.80773       7.945939  378.2670 40.33131 352.7739 60.15684 25.49310       72.42555 
1 1 1 -6  11 15 o 233.2025 49.11507 11.21941       4.307603      10.17478       6.046339      12.29611       6.138446  221.6701 65.61131 241.9886 64.24407 -20.31859      91.82671 
1 1 1 -6  11 16 f 524.4555 24.63727 53.73389       5.017984      74.77528       7.390102      35.73310       6.835325  617.6247 30.81043 423.2489 42.14536 194.3758       52.20645 
1 1 1 -6  11 17 o 489.0637 27.27653 46.90887       5.159997      43.17665       7.153628      50.95681       7.450073  466.4707 39.87187 507.4794 38.07959 -41.00867      55.13457 
1 1 1 -6  11 18 o 469.4292 29.58287 43.29699       5.365513      40.62427       7.559364      46.01058       7.616926  451.5034 43.65668 481.4068 41.13670 -29.90332      59.98445 
1 1 1 -6  11 19 o 527.5872 27.28927 54.57388       5.572185      64.88544       7.704120      43.26228       8.069061  573.7638 34.73870 465.4511 45.21004 108.3127       57.01513 
1 1 1 -6  11 20 f 284.4068 48.79135 16.52424       5.195003      6.078524       7.068854      28.79150       7.660441  191.4944 71.19546 375.7694 54.04873 -184.2749      89.38713 
1 1 1 -6  11 21 f 356.8731 41.05522 25.55696       5.586293      24.24168       7.753242      26.97691       8.055867  341.1382 60.74976 360.7210 59.58656 -19.58286      85.09460 
1 1 1 -6  11 22 o 822.6708 22.98614 132.3920       7.343788      125.6739       9.896926      140.6231       10.95483  798.8051 31.90300 844.4064 33.40613 -45.60138      46.19276 
1 1 1 -6  11 23 o 700.2543 36.17246 97.37152       9.803389      80.23537       12.08239      130.3901       16.77165  629.1664 49.85745 799.9324 54.30938 -170.7660      73.72431 
1 1 1 -6  11 24 f 415.6853 51.16498 35.50942       8.085361      36.12987       9.189017      33.38194       17.01572  415.9579 58.50094 370.5409 110.1569 45.41705       124.7273 
1 1 1 -6  11 25 o 346.6174 51.47535 25.02554       6.718650      33.00569       9.366244      16.56681       9.643011  392.6180 63.60387 270.3260 83.46850 122.2920       104.9402 
1 1 1 -6  11 26 o 390.1766 46.62032 31.55923       6.924333      22.08172       9.430960      42.64337       10.19905  308.2346 78.55565 445.3618 60.53708 -137.1273      99.17524 
1 1 1 -6  11 27 o 293.7001 72.80937 20.21299       8.263195      51.18003       15.82538      8.605525       9.688866  450.7051 93.47934 208.4253 81.86973 242.2798       124.2620 
1 1 1 -6  11 28 o 283.0992 74.07632 19.57870       8.238239      8.970757       10.43874      37.09622       13.41432  207.3326 83.78645 372.1937 93.05379 -164.8611      125.2165 
1 1 1 -6  11 29 o 253.8782 68.71273 15.96397       6.940033      14.42863       9.567230      17.66912       10.08240  231.5555 83.34880 251.8069 85.93316 -20.25139      119.7144 
1 1 1 -6  11 30 o 173.6827 71.26613 6.497240       7.691144      20.93453       13.59243      -0.3022461     9.328083  245.0475 96.74143 150.8563 69.37017 94.19127       119.0425 
1 1 1 -6  11 31 o 295.5540 68.31139 23.40792       7.683634      30.56043       13.39038      19.89671       9.381920  279.2450 98.80712 248.7615 82.89790 30.48347       128.9764 
1 1 1 -6  11 32 f 97.72301 48.18804 -9.523175      6.553576      -2.407310      9.403939      -16.24240      9.138089  135.6749 64.64029 105.6689 52.88367 30.00597       83.51676 
1 1 1 -6  12 1  o 309.8671 26.91340 18.94818       3.206543      20.71590       4.144125      16.31094       5.061763  322.7340 33.55495 282.2927 47.88267 40.44135       58.46951 
1 1 1 -6  12 2  o 667.4542 15.16828 86.75469       3.931749      84.60027       4.654251      92.12342       7.347179  658.6985 18.19429 685.5207 27.59765 -26.82214      33.05544 
1 1 1 -6  12 3  o 242.8626 30.19853 11.75914       2.786727      12.95065       3.300970      8.803407       5.199069  254.1383 34.32409 205.9934 60.80513 48.14490       69.82412 
1 1 1 -6  12 4  o 652.4249 17.18312 82.97831       4.353721      84.99705       5.313986      78.85652       7.593180  659.7230 20.74106 633.2548 30.87573 26.46814       37.19546 
1 1 1 -6  12 5  o 663.1840 15.27637 85.67641       3.934434      87.28136       5.535574      84.03793       5.593132  668.3504 21.32704 655.6906 21.96485 12.65979       30.61530 
1 1 1 -6  12 6  o 464.4821 18.42323 42.09462       3.323247      45.53671       4.668839      38.55974       4.731347  481.4843 25.05540 442.3828 27.67890 39.10156       37.33490 
1 1 1 -6  12 7  o 113.5280 46.31249 1.071507       3.224416      1.174928       3.912342      0.8524924      5.693334  123.6146 50.78753 142.3284 60.07634 -18.71388      78.66727 
1 1 1 -6  12 8  o 410.1810 21.52077 32.98009       3.416194      35.70860       4.805244      30.19177       4.857639  425.2003 29.27851 390.0572 32.36002 35.14316       43.63945 
1 1 1 -6  12 9  o 608.9293 17.15922 72.30766       4.057816      75.72449       5.876115      69.19291       5.610342  621.8141 24.33334 594.3983 24.30433 27.41577       34.39204 
1 1 1 -6  12 10 o 632.0961 17.34022 77.91132       4.256629      76.17251       6.149600      79.51067       5.897851  623.4983 25.39707 637.3577 23.82773 -13.85938      34.82487 
1 1 1 -6  12 11 f 312.1639 45.50074 19.81219       5.353870      19.89792       7.756776      19.73419       7.398926  305.7476 67.16266 305.3693 64.41642 0.3782959      93.06072 
1 1 1 -6  12 12 o 489.4993 25.57943 47.03028       4.845745      49.34153       6.037681      42.84669       8.123092  500.1201 31.24271 461.6263 45.92036 38.49380       55.54085 
1 1 1 -6  12 13 o 247.3927 48.78656 12.60344       4.520657      11.76086       5.577734      14.21651       7.717556  236.7569 60.45269 258.8928 73.39236 -22.13588      95.08400 
1 1 1 -6  12 14 o 592.4045 24.50274 68.57749       5.637168      73.25135       7.048557      60.28213       9.390315  611.3581 29.68770 549.8190 44.35516 61.53912       53.37358 
1 1 1 -6  12 15 o 289.4951 40.01152 16.82664       4.378117      18.50821       6.306961      15.26272       6.082331  299.6059 56.27161 270.7327 59.47513 28.87320       81.87666 
1 1 1 -6  12 16 o 403.9897 30.79740 32.14886       4.795436      26.36819       6.800464      37.86641       6.763230  361.2446 49.79779 436.5587 40.34823 -75.31418      64.09212 
1 1 1 -6  12 17 o 994.7194 18.05255 192.6888       6.973763      181.1849       9.519977      206.0107       10.24463  963.1952 25.45034 1027.011 25.68580 -63.81555      36.15910 
1 1 1 -6  12 18 o 805.3002 20.35052 126.4036       6.364457      134.3976       9.002344      118.4154       8.999060  828.9833 27.96288 777.7590 29.79367 51.22424       40.86056 
1 1 1 -6  12 19 o 128.3313 55.72578 -0.5721166     5.159279      -5.201945      7.254163      4.166928       7.339226  131.9189 60.84852 180.5161 71.14350 -48.59715      93.61592 
1 1 1 -6  12 20 o 452.0108 32.67307 40.36811       5.696810      41.11396       7.746665      39.48973       8.406768  452.8742 44.62623 442.0511 49.83970 10.82318       66.89915 
1 1 1 -6  12 21 o 655.8711 25.23961 84.23484       6.428788      89.20815       9.005818      79.06724       9.180044  671.6212 34.64598 631.1537 37.62349 40.46747       51.14559 
1 1 1 -6  12 22 o 109.4632 52.53323 -8.712362      6.459303      -11.57101      9.747378      -6.474175      8.624929  136.9386 65.39891 140.8263 65.44044 -3.887756      92.51740 
1 1 1 -6  12 23 o 385.3433 50.02127 30.42290       7.309089      30.02137       8.214013      31.94998       16.01855  379.6770 57.50795 366.8805 106.2873 12.79648       120.8476 
1 1 1 -6  12 24 o 428.9970 42.29119 37.23457       6.954171      44.91666       9.171525      26.84455       10.66621  467.2939 51.38756 345.6432 80.89342 121.6507       95.83542 
1 1 1 -6  12 25 o 179.6822 67.51363 5.754369       6.389621      3.085117       8.500544      9.221480       9.688039  177.0552 73.98929 218.5890 82.90560 -41.53380      111.1204 
1 1 1 -6  12 26 o 182.1564 68.87984 6.189433       6.674625      -0.6802702E-01 9.139024      13.34277       9.771361  164.3477 72.67452 240.7281 84.47713 -76.38037      111.4360 
1 1 1 -6  12 27 o 226.8039 84.77816 11.96865       10.04987      15.32402       16.45498      9.972426       12.69205  251.0464 103.7576 221.8511 91.35005 29.19536       138.2406 
1 1 1 -6  12 28 o 111.7888 53.82984 -8.019935      6.914790      -5.195209      9.400399      -11.35044      10.20735  142.3230 66.84286 132.6554 64.24998 9.667587       92.71478 
1 1 1 -6  12 29 o 330.6364 56.19663 25.16728       6.957627      20.12363       9.813827      30.26421       9.865518  266.1058 84.50784 341.4329 76.32047 -75.32709      113.8700 
1 1 1 -6  12 30 o 273.2193 69.04323 19.69996       7.328997      8.953423       12.74920      25.00413       8.956891  191.4901 85.19897 299.4199 76.68969 -107.9298      114.6306 
1 1 1 -6  12 31 o 126.5048 59.24297 -1.989869      7.294293      -6.624786      12.21991      0.5757800      9.091710  141.9643 69.11282 145.6017 67.49619 -3.637421      96.60392 
1 1 1 -6  13 1  o 1129.339 14.65965 248.3452       6.429483      247.3840       9.019290      249.3385       9.167854  1125.617 20.63258 1129.977 20.89153 -4.359253      29.36255 
1 1 1 -6  13 2  o 960.5038 14.41592 179.6330       5.377365      180.8720       6.393463      176.6376       9.941095  963.2763 17.09060 949.2213 26.96738 14.05499       31.92692 
1 1 1 -6  13 3  o 419.7479 20.09235 34.39743       3.275270      32.46555       3.915389      38.89985       5.977332  406.4556 24.92504 442.6246 35.06000 -36.16904      43.01699 
1 1 1 -6  13 4  o 610.8325 16.82319 72.73096       3.990786      70.09225       4.697553      79.57477       7.565255  599.1415 20.18898 636.0955 30.62480 -36.95392      36.68069 
1 1 1 -6  13 5  o 741.0716 15.16630 106.9792       4.364833      111.9171       6.218724      102.1844       6.127892  756.8463 21.15756 723.0464 21.82312 33.79980       30.39558 
1 1 1 -6  13 6  o 156.6226 48.98068 4.905929       3.308678      5.966382       4.029663      2.711729       5.796437  172.1539 54.08990 155.8972 62.63353 16.25668       82.75673 
1 1 1 -6  13 7  o 694.6820 18.23926 94.13879       4.920635      96.28778       6.099813      90.13477       8.326226  701.7517 22.38232 676.6204 31.68657 25.13135       38.79441 
1 1 1 -6  13 8  o 432.7028 21.21017 36.57921       3.564199      35.78539       4.999324      37.39976       5.082788  425.5626 30.45083 435.1464 30.26565 -9.583832      42.93323 
1 1 1 -6  13 9  o 397.0835 24.27330 30.96740       3.725188      32.46584       5.139738      29.30918       5.406826  404.7166 32.98807 383.4438 36.75938 21.27280       49.39094 
1 1 1 -6  13 10 o 583.3250 27.71443 66.70652       6.278335      66.17257       8.898883      67.23569       8.859064  576.7357 39.97783 581.5450 39.45974 -4.809326      56.17204 
1 1 1 -6  13 11 o 523.2765 30.46775 53.92336       6.164758      54.61462       9.014440      53.31601       8.449524  522.4288 44.86607 516.9350 42.46426 5.493774       61.77522 
1 1 1 -6  13 12 o 1417.258 18.82951 391.5333       10.36373      385.7462       12.52113      404.1228       18.46802  1405.438 22.94055 1434.083 33.16027 -28.64539      40.32211 
1 1 1 -6  13 13 o 667.8755 22.41708 87.05692       5.814368      89.00436       7.163161      83.29568       9.954935  674.4675 27.34738 648.6158 39.71179 25.85162       48.21727 
1 1 1 -6  13 14 o 265.4461 43.47995 14.27138       4.326992      10.59481       6.076135      18.05430       6.163380  226.2712 65.43488 296.1188 55.63789 -69.84760      85.89120 
1 1 1 -6  13 15 o 1077.906 17.21659 226.2122       7.207022      223.5593       10.14069      228.9199       10.24464  1070.132 24.40071 1082.895 24.36027 -12.76367      34.47924 
1 1 1 -6  13 16 o 299.9524 41.73919 18.05815       4.730337      14.91297       6.704342      21.17602       6.675166  267.1080 65.20140 321.7605 55.41973 -54.65244      85.57201 
1 1 1 -6  13 17 o 522.4919 26.80524 53.48639       5.420793      57.89363       7.800897      49.37102       7.538170  541.4420 37.32723 499.3631 39.18521 42.07889       54.11842 
1 1 1 -6  13 18 o 681.4236 32.95486 91.10976       8.720966      0.000000       0.000000      91.10976       8.720966  ?        ?        681.4236 32.95486 0.000000       32.95486 
1 1 1 -6  13 19 o 242.6193 59.36387 12.32789       5.547637      3.279240       7.654799      22.33820       8.051297  177.0668 71.68126 326.2173 65.82215 -149.1504      97.31783 
1 1 1 -6  13 20 o 641.4077 29.49679 80.76308       7.347455      86.21462       11.89099      77.39619       9.344864  655.7019 47.00837 624.3150 38.73380 31.38690       60.91054 
1 1 1 -6  13 21 o 438.5392 38.03673 38.36735       6.413820      30.13462       8.757510      47.89209       9.419665  379.9564 61.44736 485.6169 50.69482 -105.6606      79.66017 
1 1 1 -6  13 22 o 455.4837 45.79905 41.94477       7.991539      39.15694       9.193629      50.56338       16.16486  435.9272 55.56950 475.8177 90.79157 -39.89050      106.4475 
1 1 1 -6  13 23 o 565.1097 37.46862 63.76282       8.176324      64.68192       9.293133      60.61350       17.20249  566.9682 42.51570 520.4564 88.26341 46.51184       97.96946 
1 1 1 -6  13 24 o 521.1371 35.37793 54.31398       7.117581      51.57758       9.739248      57.45081       10.42752  500.1577 50.84779 527.6840 51.54186 -27.52631      72.40208 
1 1 1 -6  13 25 o 506.7918 38.62536 52.02601       7.544796      52.60600       9.250956      50.87389       13.03841  504.1817 47.81865 477.6245 72.57680 26.55719       86.91383 
1 1 1 -6  13 26 o 659.6508 37.25422 88.42008       9.504679      92.86679       16.18740      86.08038       11.74190  647.5974 65.25328 642.1201 47.42176 5.477295       80.66483 
1 1 1 -6  13 27 o 179.9755 69.96539 6.276973       7.018098      14.35482       9.633119      -2.860228      10.24533  239.1400 83.87980 157.5175 72.53230 81.62254       110.8907 
1 1 1 -6  13 28 f 268.9303 66.16142 17.48943       6.862498      20.71910       9.555355      14.04915       9.861984  277.5446 82.55738 229.7610 84.33269 47.78354       118.0158 
1 1 1 -6  13 29 o 137.5749 60.78466 0.9881452      6.380194      -3.949525      9.369504      5.257347       8.712221  140.3399 66.16600 171.5138 73.42160 -31.17383      98.83659 
1 1 1 -6  13 30 o 159.1083 66.69168 5.164689       6.937319      9.196452       12.33335      3.298709       8.390485  187.8477 83.67231 155.5483 69.16659 32.29938       108.5591 
1 1 1 -6  13 31 o 118.6571 56.34620 -3.483726      7.028408      -13.50974      12.72189      0.9207133      8.432042  131.1493 65.10979 142.2268 65.60302 -11.07748      92.42857 
1 1 1 -6  14 1  o 191.8631 53.67206 7.623829       4.156000      0.000000       0.000000      7.623829       4.156000  ?        ?        191.8631 53.67206 0.000000       53.67206 
1 1 1 -6  14 2  o 436.7258 21.03150 37.24358       3.567033      39.00673       4.429157      33.98933       6.017302  445.6074 25.70324 412.9740 37.94336 32.63342       45.82963 
1 1 1 -6  14 3  f 557.4681 19.09248 60.62710       4.133428      64.79684       5.182839      53.34022       6.851477  575.6838 23.18226 519.1633 34.17329 56.52057       41.29445 
1 1 1 -6  14 4  o 288.0970 31.24526 16.50359       3.439802      18.30712       4.223922      12.95245       5.927046  302.3252 36.73055 247.5398 61.83516 54.78540       71.92162 
1 1 1 -6  14 5  o 558.9073 19.86005 60.96481       4.310703      64.12609       5.239210      54.33997       7.584410  572.6257 23.55955 522.9886 37.59314 49.63708       44.36549 
1 1 1 -6  14 6  o 1331.916 21.38527 346.4806       11.06164      346.4806       11.06164      0.000000       0.000000  1331.916 21.38527 ?        ?        0.000000       21.38527 
1 1 1 -6  14 7  o 286.6962 34.30565 16.41343       3.743721      16.43006       4.473254      16.37455       6.839880  285.0338 41.63934 278.1128 64.56905 6.921021       76.83096 
1 1 1 -6  14 8  o 528.5045 22.49576 54.56623       4.617185      63.16660       5.730412      38.64970       7.795636  568.0598 25.97549 438.2242 46.51777 129.8356       53.27879 
1 1 1 -6  14 9  o 93.13545 43.48728 -3.597299      3.882356      -3.741929      4.727458      -3.297694      6.804115  105.3940 48.79142 134.1528 60.74499 -28.75884      77.91377 
1 1 1 -6  14 10 o 784.7881 24.38021 120.3641       7.430496      104.3885       10.08973      139.2960       10.98371  728.1927 35.67841 841.8313 33.59665 -113.6386      49.00697 
1 1 1 -6  14 11 o 544.6223 24.27719 57.94160       5.134780      57.42237       6.188177      59.08935       9.200442  540.6087 29.58710 544.6640 43.86816 -4.055298      52.91325 
1 1 1 -6  14 12 o 707.1224 21.35735 97.51926       5.865026      100.7299       7.221482      91.29756       10.05268  717.9301 25.90098 679.8964 38.22759 38.03369       46.17586 
1 1 1 -6  14 13 o 130.2673 51.91368 1.806930       3.948324      1.110065       5.834697      2.395603       5.362667  146.9420 61.34318 150.7229 60.35384 -3.780914      86.05563 
1 1 1 -6  14 14 o 506.5184 24.53152 50.07832       4.825559      52.05539       7.098861      48.37999       6.579443  513.7108 35.80688 495.4583 34.40768 18.25250       49.65905 
1 1 1 -6  14 15 f 328.8781 36.88548 21.50030       4.629873      26.02117       6.871761      17.74205       6.265422  358.8819 50.71774 293.5910 57.00674 65.29083       76.30241 
1 1 1 -6  14 16 o 346.5623 37.22359 23.86319       4.931384      27.33103       7.118439      20.66313       6.838068  367.7159 51.24002 317.1351 57.64489 50.58078       77.12635 
1 1 1 -6  14 17 o 457.6066 30.32099 41.18680       5.357917      51.28887       7.779390      32.07055       7.390069  508.7215 39.69059 399.2414 48.67078 109.4801       62.80276 
1 1 1 -6  14 18 o 632.2176 24.33973 78.10310       5.975997      73.64924       8.393990      82.68079       8.509874  610.7668 35.54240 647.7065 33.94932 -36.93970      49.15097 
1 1 1 -6  14 19 o 811.2366 24.43383 128.7144       7.697807      145.0526       12.64516      119.0950       9.702813  856.8251 38.00181 778.3051 32.10109 78.52008       49.74553 
1 1 1 -6  14 20 o 1104.186 19.97733 238.0188       8.566583      236.4037       11.83096      239.7988       12.42048  1097.707 27.75273 1105.065 28.94161 -7.357788      40.09777 
1 1 1 -6  14 21 o 173.2787 64.92950 4.942825       5.901966      -3.746452      7.907872      15.86924       8.867613  143.4406 65.16199 270.1389 79.31795 -126.6983      102.6519 
1 1 1 -6  14 22 o 948.5057 26.69091 176.7139       9.831762      171.2136       11.42266      192.4378       19.31315  931.5031 31.57584 973.7906 51.24963 -42.28754      60.19599 
1 1 1 -6  14 23 o 175.7174 68.07405 4.802540       6.626012      6.106495       9.132600      3.353214       9.628224  199.9658 79.18534 188.3755 78.73415 11.59032       111.6664 
1 1 1 -6  14 24 o 247.3413 71.42241 13.68838       7.243793      15.46849       9.114142      10.63536       11.93593  260.0668 81.28732 234.0452 91.17145 26.02159       122.1469 
1 1 1 -6  14 25 o 724.0408 28.59215 104.1769       8.039663      112.6316       11.09087      94.81468       11.67089  745.1263 38.45840 678.5642 44.53506 66.56207       58.84233 
1 1 1 -6  14 26 o 141.7675 64.58796 -2.371117      7.840697      -16.33350      13.81588      4.262156       9.522758  151.0182 73.51336 182.8698 77.47012 -31.85155      106.7981 
1 1 1 -6  14 27 o 212.5691 69.53805 10.81452       6.612835      7.603298       9.207158      14.23600       9.503819  194.1264 78.60488 235.1332 83.23708 -41.00677      114.4864 
1 1 1 -6  14 28 o 135.3987 60.30837 0.1708371      6.406760      4.869553       9.058540      -4.532005      9.062516  174.1143 74.70954 138.5389 65.24251 35.57536       99.18720 
1 1 1 -6  14 29 o 117.7056 55.05941 -3.016359      6.269742      -14.96301      9.009505      8.202038       8.730582  110.8156 54.97711 183.4267 75.67402 -72.61114      93.53630 
1 1 1 -6  14 30 o 225.3241 92.21654 19.82900       12.83620      19.82900       12.83620      0.000000       0.000000  225.3241 92.21654 ?        ?        0.000000       92.21654 
1 1 1 -6  15 1  o 486.4978 19.94714 46.16277       3.768683      38.34658       5.209084      54.74743       5.459151  441.0549 30.60100 528.2204 26.69888 -87.16553      40.61097 
1 1 1 -6  15 2  o 186.2496 52.84216 7.135911       3.999042      6.259813       5.544988      8.085506       5.772893  183.2764 63.67536 201.0613 64.91719 -17.78494      90.93291 
1 1 1 -6  15 3  o 504.7598 20.80539 49.71704       4.078388      46.87122       5.045303      55.08273       6.927819  488.6169 26.68931 528.0998 33.95952 -39.48288      43.19222 
1 1 1 -6  15 4  o 1173.631 17.02160 268.3424       7.758182      268.6327       9.539432      267.7755       13.33297  1173.278 20.93599 1168.600 29.37872 4.677979       36.07527 
1 1 1 -6  15 5  o 911.9246 20.75439 162.2621       7.350160      162.2621       7.350160      0.000000       0.000000  911.9246 20.75439 ?        ?        0.000000       20.75439 
1 1 1 -6  15 6  o 258.8133 45.82302 13.67661       4.437170      13.67661       4.437170      0.000000       0.000000  258.8133 45.82302 ?        ?        0.000000       45.82302 
1 1 1 -6  15 7  o 608.6626 20.37543 72.25625       4.816277      74.00545       5.844528      68.55477       8.501905  615.3870 24.45531 588.6651 37.38334 26.72186       44.67187 
1 1 1 -6  15 8  o 417.6236 26.62774 34.24902       4.296136      36.06914       5.109860      29.85992       7.934986  427.7971 30.96635 382.7079 54.96659 45.08926       63.08915 
1 1 1 -6  15 9  o 753.1249 24.09135 110.7655       7.046219      116.9028       9.795185      104.1838       10.14367  771.8705 32.67685 727.8932 35.88387 43.97723       48.53276 
1 1 1 -6  15 10 o 964.1090 18.93154 181.0992       7.088266      180.9847       8.630171      181.3367       12.42585  963.0161 23.07586 961.3596 33.28221 1.656494       40.49939 
1 1 1 -6  15 11 o 194.4218 51.02728 7.784586       3.901424      18.50753       5.526806      -2.866038      5.508137  301.8995 48.80458 120.7115 54.65704 181.1880       73.27537 
1 1 1 -6  15 12 o 172.2139 52.57258 5.928140       3.838100      7.056211       5.753951      5.023875       5.151644  192.5854 64.92142 170.5159 61.18440 22.06956       89.20943 
1 1 1 -6  15 13 o 852.7169 17.72565 141.5585       5.869959      141.9744       8.485259      141.1769       8.128951  852.7640 25.62172 850.5434 24.60991 2.220642       35.52633 
1 1 1 -6  15 14 o 287.6590 41.21362 16.60852       4.472553      14.18014       6.483529      18.81329       6.177828  260.8019 64.39777 303.2854 54.45247 -42.48349      84.33353 
1 1 1 -6  15 15 o 342.8549 36.33139 23.33113       4.763786      21.63810       7.051737      24.75238       6.460981  324.6856 58.05589 350.3420 48.81358 -25.65640      75.85019 
1 1 1 -6  15 16 o 558.5447 24.88582 60.92334       5.398063      68.20094       7.912620      54.58752       7.382905  588.3830 34.78295 525.8047 36.37914 62.57825       50.33185 
1 1 1 -6  15 17 o 414.2501 36.60060 34.03791       5.827576      33.09985       9.346315      34.63456       7.453947  400.7813 62.05449 415.0960 47.07135 -14.31476      77.88756 
1 1 1 -6  15 18 o 644.0987 24.75599 81.13842       6.192423      74.89007       8.714236      87.51215       8.801229  615.1441 36.64355 665.9322 34.14667 -50.78809      50.08738 
1 1 1 -6  15 19 o 1048.804 19.99244 214.7065       8.143072      203.3338       11.16556      227.6284       11.90175  1018.024 28.24192 1077.042 28.45444 -59.01807      40.09066 
1 1 1 -6  15 20 o 357.1825 45.52385 25.86714       6.171199      19.17718       8.390586      33.75057       9.108316  297.7065 73.10720 403.0859 60.01565 -105.3794      94.58616 
1 1 1 -6  15 21 o 865.1500 27.88026 147.0913       9.367339      146.7026       10.85981      148.2211       18.51475  862.1934 32.43320 851.4033 56.31371 10.79004       64.98573 
1 1 1 -6  15 22 o 342.1157 70.05038 25.41883       8.993804      25.41883       8.993804      0.000000       0.000000  342.1157 70.05038 ?        ?        0.000000       70.05038 
1 1 1 -6  15 23 o 447.9787 44.51479 40.97733       7.641877      49.11741       9.545856      26.45124       12.75189  487.1133 51.22880 332.0683 94.41167 155.0450       107.4149 
1 1 1 -6  15 24 o 166.6039 72.88043 0.5741006      8.965079      0.5741006      8.965079      0.000000       0.000000  166.6039 72.88043 ?        ?        0.000000       72.88043 
1 1 1 -6  15 25 o 355.3667 63.33058 28.21642       8.419683      14.22355       15.32358      34.26793       10.07717  248.6206 101.1389 387.4206 69.53245 -138.8000      122.7348 
1 1 1 -6  15 26 o 312.4331 58.24435 21.91389       6.807070      10.91603       9.626900      32.91061       9.626403  216.6160 82.52711 375.3852 68.55903 -158.7692      107.2896 
1 1 1 -6  15 27 o 120.5964 55.89427 -3.058025      6.230594      13.05265       9.305295      -16.15086      8.388613  223.5163 81.93648 106.5783 52.90444 116.9380       97.53188 
1 1 1 -6  15 28 o 396.0400 41.90359 33.88798       6.347042      37.04850       9.691388      31.51427       8.398869  386.4923 66.99586 361.5484 62.05194 24.94394       91.31751 
1 1 1 -6  15 29 o 379.0613 44.94556 32.19793       6.487549      25.02061       9.342645      38.88163       9.015650  290.8433 80.14597 397.2482 60.33720 -106.4049      100.3193 
1 1 1 -6  15 30 o 359.3609 51.73115 30.83765       7.011507      45.36271       12.73266      24.51618       8.399809  372.7438 89.15830 290.2859 74.22130 82.45789       116.0086 
1 1 1 -6  16 1  o 176.2232 46.35139 6.375001       3.214636      8.087542       4.388669      4.392462       4.721971  198.2259 55.04866 161.2409 58.47989 36.98495       80.31346 
1 1 1 -6  16 2  o 595.4755 20.26807 69.12630       4.687099      66.53666       5.940803      73.39606       7.628306  583.4400 26.21929 610.9169 32.26719 -27.47693      41.57671 
1 1 1 -6  16 3  o 243.4668 35.99331 11.89554       3.300627      16.06323       3.973568      2.620258       5.927838  283.4545 36.97772 157.8356 63.36515 125.6189       73.36549 
1 1 1 -6  16 4  o 608.0679 23.00441 72.16413       5.432394      67.56563       6.693244      81.04041       9.299167  587.4379 29.33909 640.6184 37.54197 -53.18048      47.64642 
1 1 1 -6  16 5  o 549.3020 23.11567 58.88778       4.931120      58.88778       4.931120      0.000000       0.000000  549.3020 23.11567 ?        ?        0.000000       23.11567 
1 1 1 -6  16 6  o 708.0506 19.17589 97.68313       5.272879      107.0483       6.569178      80.72111       8.840823  740.6836 22.83759 639.9815 35.71352 100.7021       42.39117 
1 1 1 -6  16 7  o 364.9106 25.90986 26.14427       3.647936      23.85915       5.121022      28.49838       5.197756  346.0851 38.76781 379.2677 35.70967 -33.18259      52.70791 
1 1 1 -6  16 8  o 853.9265 18.85328 142.0396       6.252235      154.3592       10.94240      136.0681       7.618287  887.6262 31.74349 835.0569 23.49164 52.56927       39.49058 
1 1 1 -6  16 9  o 905.8801 19.00995 159.8451       6.687746      156.0323       11.54337      161.7715       8.205088  892.1264 33.31795 910.6257 23.20146 -18.49933      40.60041 
1 1 1 -6  16 10 o 618.7090 19.23875 74.56067       4.622654      77.96292       6.608613      71.30117       6.468480  631.7346 26.93690 604.0549 27.57388 27.67963       38.54757 
1 1 1 -6  16 11 o 641.7694 19.79449 80.22875       4.933457      78.24613       7.057305      82.12359       6.899302  632.6863 28.72252 648.3663 27.40039 -15.67999      39.69590 
1 1 1 -6  16 12 o 1194.022 16.57652 277.4400       7.686585      279.2468       10.92699      275.6701       10.81482  1196.585 23.51413 1188.918 23.42284 7.667603       33.18951 
1 1 1 -6  16 13 o 720.4933 27.13308 101.3959       7.592014      0.000000       0.000000      101.3959       7.592014  ?        ?        720.4933 27.13308 0.000000       27.13308 
1 1 1 -6  16 14 o 155.6345 56.79462 3.989996       4.463608      -8.852372      6.579811      14.93853       6.075317  111.5641 53.40337 268.3514 59.82235 -156.7873      80.19124 
1 1 1 -6  16 15 o 382.8606 34.83180 29.00787       5.122339      29.72594       7.616897      28.41499       6.921144  383.1559 52.57483 375.5874 48.58937 7.568512       71.58938 
1 1 1 -6  16 16 o 571.4951 27.19413 63.90450       6.035534      75.52745       10.24728      57.73064       7.468416  616.3622 43.08087 540.5569 35.77848 75.80536       56.00054 
1 1 1 -6  16 17 o 687.3217 23.43580 92.31430       6.255584      102.4371       9.061800      83.09851       8.646283  721.9734 32.31955 648.8677 34.43520 73.10565       47.22644 
1 1 1 -6  16 18 o 309.5025 49.32431 19.60292       5.729617      15.68581       8.124601      23.47846       8.081376  270.2779 74.84364 334.0243 64.63541 -63.74640      98.89037 
1 1 1 -6  16 19 f 471.2791 34.62286 44.06015       6.292427      31.37800       8.934267      56.54310       8.863821  388.1120 61.31156 531.1897 43.34569 -143.0777      75.08633 
1 1 1 -6  16 20 o 212.7796 66.32662 9.419895       6.072642      11.57976       8.488189      7.155359       8.691442  236.3008 78.85564 206.2825 78.45681 30.01831       111.2371 
1 1 1 -6  16 21 o 263.6449 78.92776 15.28332       8.712906      15.28332       8.712906      0.000000       0.000000  263.6449 78.92776 ?        ?        0.000000       78.92776 
1 1 1 -6  16 22 o 264.9960 64.04811 15.30026       6.518228      27.12888       8.915482      1.716844       9.553931  353.2335 67.45135 179.2263 76.80920 174.0072       102.2220 
1 1 1 -6  16 23 o 204.3401 68.90499 8.871966       6.481757      10.67232       8.611599      6.519038       9.844869  223.2227 79.21083 202.2822 81.50051 20.94048       113.6516 
1 1 1 -6  16 24 o 233.5907 70.65121 12.52778       6.955136      15.35270       9.924499      9.801365       9.749920  252.8312 85.26257 216.7650 82.94094 36.06627       118.9492 
1 1 1 -6  16 25 o 230.9604 76.93686 12.82153       8.081433      24.37782       15.07987      8.165330       9.572028  290.8869 104.6485 202.3794 80.77447 88.50752       132.1961 
1 1 1 -6  16 26 o 218.9687 68.47349 11.59241       6.466333      10.00917       9.114354      13.19696       9.175505  206.8858 79.92606 227.3487 81.64677 -20.46295      114.2557 
1 1 1 -6  16 27 o 301.7646 56.76853 21.14289       6.408619      20.88059       9.483062      21.36337       8.694507  273.2312 82.46548 283.1148 77.02804 -9.883636      112.8445 
1 1 1 -6  16 28 o 127.0314 56.84554 0.1976452      5.763611      7.159600       9.149488      -4.382523      7.421163  178.4899 75.79358 122.8088 58.19594 55.68109       95.55853 
1 1 1 -6  16 29 o 123.1348 59.77198 -7.510414      8.963450      -7.510414      8.963450      0.000000       0.000000  123.1348 59.77198 ?        ?        0.000000       59.77198 
1 1 1 -6  17 1  o 501.0596 20.74817 48.91988       4.037356      46.33787       5.548269      51.82584       5.886058  485.9155 29.54164 513.9683 29.61437 -28.05280      41.82965 
1 1 1 -6  17 2  f 488.8296 21.83079 46.58060       4.144336      51.50125       5.831924      41.56065       5.890468  512.3597 29.43313 459.3966 33.24128 52.96313       44.39923 
1 1 1 -6  17 3  f 766.1814 16.76338 114.2532       4.987938      116.7657       5.920622      108.1092       9.258433  774.2196 19.69133 743.0076 32.08605 31.21198       37.64656 
1 1 1 -6  17 4  o 518.8547 24.34380 52.53047       4.905262      52.53047       4.905262      0.000000       0.000000  518.8547 24.34380 ?        ?        0.000000       24.34380 
1 1 1 -6  17 5  o 1007.522 19.21375 197.7065       7.517867      202.7952       9.697619      190.0423       11.90136  1019.443 24.49482 985.3915 31.09996 34.05139       39.58792 
1 1 1 -6  17 6  o 614.7123 19.96700 73.61303       4.766644      80.57363       5.695913      57.34657       8.707360  642.7992 22.81708 538.0121 42.00717 104.7870       47.80399 
1 1 1 -6  17 7  o 718.1949 18.63536 100.4362       5.197664      95.97176       6.012897      113.6333       10.33802  701.6596 22.06629 761.2632 34.96830 -59.60358      41.34856 
1 1 1 -6  17 8  o 986.8766 18.63801 189.6302       7.143160      207.1731       12.67441      181.4642       8.647315  1028.863 31.72067 964.6936 23.08149 64.16943       39.22953 
1 1 1 -6  17 9  o 648.7700 18.77851 81.95148       4.731294      82.43233       6.670857      81.46477       6.711449  649.8077 26.43436 645.9408 26.75442 3.866943       37.61083 
1 1 1 -6  17 10 o 1149.981 16.25253 257.3069       7.258377      246.5102       9.967489      269.4957       10.59062  1124.499 22.82437 1175.681 23.19551 -51.18164      32.54202 
1 1 1 -6  17 11 o 918.5502 17.20957 164.2067       6.139045      167.9917       8.900031      160.7713       8.479099  927.9611 24.69641 907.9094 24.04801 20.05164       34.47056 
1 1 1 -6  17 12 o 712.7216 19.42218 98.93153       5.375835      101.3995       7.744477      96.63645       7.468204  720.4501 27.67962 703.3774 27.34008 17.07269       38.90554 
1 1 1 -6  17 13 o 356.6071 33.78375 25.14700       4.622908      22.55035       6.693616      27.51517       6.392342  332.8911 53.59551 370.6188 45.35914 -37.72778      70.21346 
1 1 1 -6  17 14 o 530.6005 27.72192 55.20532       5.692575      56.62978       9.547448      54.41959       7.090848  532.7733 46.61325 525.2958 34.95855 7.477478       58.26574 
1 1 1 -6  17 15 o 1161.687 17.93562 262.9200       8.091580      266.9922       11.69683      259.1827       11.20543  1168.579 25.77401 1151.579 25.05571 17.00061       35.94563 
1 1 1 -6  17 16 o 104.8519 49.12175 -4.827402      5.023128      -5.381627      7.228412      -4.309820      6.985371  130.5912 60.41265 131.9816 60.44643 -1.390335      85.46027 
1 1 1 -6  17 17 o 226.0815 61.20185 10.74084       5.505090      15.52733       8.049903      6.535598       7.545318  269.1373 74.48841 196.8798 73.48494 72.25749       104.6354 
1 1 1 -6  17 18 o 207.2437 64.15372 8.850985       5.692429      18.83602       8.322050      0.7139074E-01  7.803562  295.5578 72.94682 159.8267 68.96742 135.7311       100.3880 
1 1 1 -6  17 19 o 581.2449 33.54765 66.89380       7.540486      75.33456       9.477955      52.33836       12.44620  614.5256 39.93084 500.1749 65.66116 114.3507       76.84959 
1 1 1 -6  17 20 o 578.5217 37.10430 66.72251       8.292316      65.42931       9.673413      70.30636       16.10353  569.8558 44.05274 572.8023 74.13068 -2.946533      86.23226 
1 1 1 -6  17 21 o 414.4087 48.92002 35.31452       7.721258      35.85896       8.939765      33.71570       15.31967  413.5690 57.19144 372.7369 102.5949 40.83212       117.4589 
1 1 1 -6  17 22 o 208.5758 69.30943 9.287177       6.559966      13.62373       9.025936      4.431742       9.550673  245.8701 81.28020 190.4221 78.90253 55.44803       113.2788 
1 1 1 -6  17 23 o 463.4864 38.55142 43.74463       6.876176      45.54066       9.311802      41.59083       10.19716  464.0040 52.60501 436.6307 61.86721 27.37323       81.20861 
1 1 1 -6  17 24 o 146.2218 65.95126 -1.516346      7.930080      -7.597308      14.14025      1.273726       9.578082  171.5574 81.00604 170.2129 74.87237 1.344513       110.3080 
1 1 1 -6  17 25 o 169.5239 74.37799 2.198744       9.398753      0.000000       0.000000      2.198744       9.398753  ?        ?        169.5239 74.37799 0.000000       74.37799 
1 1 1 -6  17 26 o 521.0779 34.00256 56.00147       6.843136      71.32786       9.992330      42.46436       9.390954  576.0036 45.02790 431.0138 57.54045 144.9898       73.06447 
1 1 1 -6  17 27 o 265.5378 60.42886 17.19118       6.091449      17.03569       9.292672      17.30834       8.066162  240.2695 82.49033 249.8357 76.20185 -9.566193      112.3004 
1 1 1 -6  17 28 o 279.4875 56.34660 18.99084       5.904691      33.20831       9.470119      9.948194       7.552521  350.8686 71.91566 189.8439 72.91348 161.0247       102.4121 
1 1 1 -6  18 1  o 1102.899 18.84575 236.7834       8.071925      234.8304       9.326798      242.6114       16.11206  1097.867 21.87534 1112.362 37.29727 -14.49438      43.23906 
1 1 1 -6  18 2  o 697.9597 18.30791 94.81886       4.962460      99.45678       6.808537      89.56289       7.248019  714.1470 24.54925 677.3192 27.55485 36.82788       36.90441 
1 1 1 -6  18 3  o 886.1871 19.18940 152.8963       6.604116      152.8963       6.604116      0.000000       0.000000  886.1871 19.18940 ?        ?        0.000000       19.18940 
1 1 1 -6  18 4  o 690.1219 21.09492 92.77795       5.653686      92.77795       5.653686      0.000000       0.000000  690.1219 21.09492 ?        ?        0.000000       21.09492 
1 1 1 -6  18 5  o 997.2390 16.39954 193.4817       6.351244      193.1016       7.385708      194.5605       12.44366  995.9153 19.09597 997.2733 32.12965 -1.357971      37.37606 
1 1 1 -6  18 6  o 567.8131 21.34952 62.81029       4.707839      60.42915       5.497851      69.35592       9.115412  556.5648 25.43603 592.9810 39.81385 -36.41620      47.24546 
1 1 1 -6  18 7  o 1004.692 32.86868 197.5238       12.82458      0.000000       0.000000      197.5238       12.82458  ?        ?        1004.692 32.86868 0.000000       32.86868 
1 1 1 -6  18 8  o 278.4788 53.32081 15.85377       5.556548      20.42438       7.795388      11.13297       7.922441  313.9032 66.03821 236.5101 76.01603 77.39310       100.6950 
1 1 1 -6  18 9  o 536.0989 21.64706 55.99916       4.506836      56.95510       6.257794      54.96900       6.496143  538.9827 30.01545 529.1703 31.75745 9.812317       43.69740 
1 1 1 -6  18 10 o 773.0327 18.43861 116.3356       5.535463      115.6339       7.740258      117.0701       7.919473  769.7361 25.89319 774.4344 26.33199 -4.698303      36.93008 
1 1 1 -6  18 11 o 510.1026 24.27585 50.76374       4.809056      63.86286       6.939939      38.66329       6.670146  570.3909 31.45116 441.8253 39.28358 128.5656       50.32271 
1 1 1 -6  18 12 o 1104.056 19.74374 237.4872       8.465421      251.1415       14.95631      231.0508       10.26861  1131.615 34.03281 1088.052 24.30153 43.56201       41.81861 
1 1 1 -6  18 13 o 309.4770 45.78942 19.35231       5.337151      14.50149       9.073376      21.91869       6.599666  263.7284 80.88862 327.5615 53.74464 -63.83310      97.11568 
1 1 1 -6  18 14 f 178.2233 59.66403 6.094943       4.859429      12.05923       6.957356      0.4137497      6.790233  240.2703 70.17428 152.5831 65.05512 87.68723       95.69011 
1 1 1 -6  18 15 f 788.9454 21.03607 121.4776       6.445246      120.0732       9.219795      122.8199       9.013611  782.2328 30.34990 791.4038 29.32734 -9.170959      42.20438 
1 1 1 -6  18 16 o 377.5359 54.13165 29.19210       7.709542      0.000000       0.000000      29.19210       7.709542  ?        ?        377.5359 54.13165 0.000000       54.13165 
1 1 1 -6  18 17 o 645.6014 25.86052 81.64970       6.483803      96.62530       9.318235      67.59363       9.027632  699.9955 34.27760 582.5245 40.15057 117.4709       52.79225 
1 1 1 -6  18 18 o 316.8373 56.60542 20.92318       6.709431      25.29202       8.350262      12.96418       11.27057  345.9340 64.52908 253.7607 90.55717 92.17328       111.1962 
1 1 1 -6  18 19 o 153.8086 63.11109 2.183325       6.031622      8.264618       8.576179      -3.768738      8.484565  212.1202 78.50746 148.5789 67.49620 63.54135       103.5334 
1 1 1 -6  18 20 o 190.8147 72.86102 6.176457       7.514401      0.9126104      8.992847      18.35547       13.67891  171.7745 74.07999 284.3907 99.94256 -112.6162      124.4040 
1 1 1 -6  18 21 o 220.9432 67.72332 10.67249       6.361339      8.890193       9.009607      12.44430       8.983034  213.6509 80.19019 237.7696 81.11314 -24.11867      114.0605 
1 1 1 -6  18 22 o 285.4189 59.68499 17.87143       6.402907      18.75649       9.071094      16.99259       9.039148  281.8933 79.44836 268.2523 80.41104 13.64108       113.0397 
1 1 1 -6  18 23 o 163.3156 69.16838 2.588300       7.588046      0.2968130      14.10162      3.522210       9.002493  193.4578 87.53762 177.4438 75.25632 16.01398       115.4398 
1 1 1 -6  18 24 o 386.4027 54.91052 32.83073       8.008121      13.02436       14.23969      41.99255       9.684761  233.6750 96.54484 433.8833 59.00678 -200.2083      113.1490 
1 1 1 -6  18 25 o 235.4299 66.48636 13.51436       6.346042      5.306096       9.014766      21.57815       8.935082  178.7055 75.52229 288.2832 77.94163 -109.5777      108.5289 
1 1 1 -6  18 26 o 136.7763 59.66611 1.368389       5.971681      -4.165194      8.680256      6.340762       8.228319  135.3230 63.76566 176.0354 73.11331 -40.71239      97.01348 
1 1 1 -6  18 27 o 113.4081 53.17904 -3.108031      5.910311      0.5539454      8.967750      -5.920141      7.858539  149.1317 68.36993 121.1919 58.10432 27.93980       89.72491 
1 1 1 -6  18 28 o 269.1369 60.05675 18.39215       6.117855      25.42861       9.542281      13.48116       7.971861  286.1175 81.78273 210.4252 76.03557 75.69228       111.6684 
1 1 1 -6  19 1  o 848.8611 17.02613 140.1744       5.612814      137.9740       7.709479      142.6561       8.187507  841.4626 23.59186 855.4836 24.64404 -14.02100      34.11605 
1 1 1 -6  19 2  o 1017.900 16.54554 201.5460       6.540549      198.1967       8.908977      205.4617       9.632840  1008.617 22.74435 1026.718 24.15880 -18.10040      33.18061 
1 1 1 -6  19 3  o 713.8222 20.80263 99.22177       5.766819      99.22177       5.766819      0.000000       0.000000  713.8222 20.80263 ?        ?        0.000000       20.80263 
1 1 1 -6  19 4  o 596.7476 20.17309 69.33533       4.675102      71.42104       5.542120      64.18925       8.705358  605.3576 23.57414 570.6692 39.52361 34.68842       46.02016 
1 1 1 -6  19 5  o 856.7274 17.55988 142.8202       5.842413      141.9759       6.860033      145.0498       11.14761  853.8459 20.68801 861.0543 33.33676 -7.208374      39.23434 
1 1 1 -6  19 6  o 372.7251 36.09407 27.46607       5.159144      35.47703       6.693045      15.73752       8.098479  423.0184 41.26700 274.8121 74.16267 148.2063       84.87088 
1 1 1 -6  19 7  o 750.9073 37.37997 110.5761       10.90067      0.000000       0.000000      110.5761       10.90067  ?        ?        750.9073 37.37997 0.000000       37.37997 
1 1 1 -6  19 8  o 351.2020 34.47804 24.38611       4.641857      20.35405       5.346792      36.72439       9.353132  318.5178 44.43477 426.0079 58.04528 -107.4901      73.10064 
1 1 1 -6  19 9  o 793.9705 20.68769 122.8143       6.378878      127.5961       10.78100      120.2385       7.912528  806.9216 34.40326 784.8532 25.95965 22.06836       43.09858 
1 1 1 -6  19 10 o 190.1827 54.88680 7.364419       4.278989      3.772143       5.992333      11.10192       6.112257  167.1849 64.74590 231.6987 65.18633 -64.51376      91.87649 
1 1 1 -6  19 11 o 658.0060 24.22466 84.52210       6.190353      96.84500       10.61645      78.17410       7.619768  700.2917 39.19398 631.7350 31.05838 68.55670       50.00791 
1 1 1 -6  19 12 o 370.1252 34.13363 27.12774       4.851075      16.88657       6.993001      36.62765       6.735173  283.7454 64.87363 428.9169 40.93085 -145.1715      76.70673 
1 1 1 -6  19 13 o 980.0583 18.54197 187.1991       7.057255      201.2781       10.31212      174.7961       9.678878  1014.392 26.17666 945.2581 26.36614 69.13403       37.15362 
1 1 1 -6  19 14 o 227.5318 58.11937 10.83432       5.154088      8.477353       7.435709      13.01402       7.150609  211.1614 73.71534 248.2609 70.73822 -37.09952      102.1658 
1 1 1 -6  19 15 o 295.9864 48.77687 17.92667       5.411439      13.41403       7.701560      22.32710       7.605211  251.5398 73.93699 326.6227 62.22882 -75.08286      96.63905 
1 1 1 -6  19 16 o 855.3622 24.84165 143.2231       8.251987      159.1429       10.36712      115.6960       13.63229  900.1069 29.65759 759.8955 46.41673 140.2114       55.08253 
1 1 1 -6  19 17 o 294.4769 72.07703 18.75733       8.176073      0.000000       0.000000      18.75733       8.176073  ?        ?        294.4769 72.07703 0.000000       72.07703 
1 1 1 -6  19 18 o 1048.863 20.51360 215.0845       8.355811      215.2119       11.72535      214.9530       11.91063  1045.679 28.87350 1044.814 29.35402 0.8646240      41.17448 
1 1 1 -6  19 19 o 638.1376 59.53145 85.01741       14.58295      0.000000       0.000000      85.01741       14.58295  ?        ?        638.1376 59.53145 0.000000       59.53145 
1 1 1 -6  19 20 o 144.6284 61.77578 0.8294128      6.143085      10.72722       8.829541      -8.456707      8.552356  225.5494 80.18867 131.4639 62.34851 94.08545       101.5754 
1 1 1 -6  19 21 o 157.8233 64.40231 3.039351       6.237744      -3.980260      8.919171      9.759690       8.726973  147.9810 67.96833 215.7793 79.31171 -67.79822      104.4511 
1 1 1 -6  19 22 o 133.5286 59.24183 -0.7326611     6.121926      -0.6457921     8.772436      -0.8151298     8.547372  157.5352 70.33932 155.0613 69.31868 2.473923       98.75576 
1 1 1 -6  19 23 f 422.8276 49.23585 38.27301       7.933471      29.16622       13.98822      42.59141       9.632537  319.9726 100.8158 438.8136 57.94099 -118.8410      116.2798 
1 1 1 -6  19 24 o 414.9053 40.77686 36.22744       6.485505      42.90435       9.036093      29.13351       9.313996  439.6165 54.06674 345.3296 71.79207 94.28687       89.87388 
1 1 1 -6  19 25 o 173.2066 64.94249 6.759632       5.906103      6.059077       8.404268      7.443184       8.301657  176.3837 73.62695 183.7191 74.55251 -7.335449      104.7808 
1 1 1 -6  19 26 o 205.6740 66.25151 11.02020       6.015307      7.722609       8.714336      14.02151       8.313659  180.9067 75.19778 220.5770 77.87595 -39.67032      108.2560 
1 1 1 -6  19 27 o 266.7283 59.31675 17.81154       5.985435      2.785774       8.982859      29.80951       8.026941  155.1889 70.07599 343.3300 62.50470 -188.1410      93.90144 
1 1 1 -6  20 1  o 1322.610 16.48835 340.2655       8.469090      338.5048       11.74442      342.1730       12.22419  1318.110 22.94309 1325.072 23.75486 -6.961914      33.02543 
1 1 1 -6  20 2  o 382.8413 35.90593 28.94532       5.276055      28.16638       5.839748      32.40581       12.30869  376.7346 40.55338 392.9642 83.24403 -16.22952      92.59668 
1 1 1 -6  20 3  o 1056.826 31.39545 218.3029       12.88540      0.000000       0.000000      218.3029       12.88540  ?        ?        1056.826 31.39545 0.000000       31.39545 
1 1 1 -6  20 4  o 815.6302 18.15740 129.4698       5.751418      132.5471       6.728289      121.1199       11.08303  824.9513 21.00141 786.2299 36.29787 38.72144       41.93560 
1 1 1 -6  20 5  o 263.3073 49.21533 14.11710       4.847548      14.11710       4.847548      0.000000       0.000000  263.3073 49.21533 ?        ?        0.000000       49.21533 
1 1 1 -6  20 6  o 920.7563 21.22569 165.1728       7.589873      157.6195       9.506808      178.4493       12.60404  898.4872 27.24550 954.5567 34.00008 -56.06952      43.56975 
1 1 1 -6  20 7  o 518.1208 24.66922 52.37542       4.963802      55.75096       5.848760      43.68339       9.385401  533.4144 28.33555 466.4762 52.73383 66.93820       59.86452 
1 1 1 -6  20 8  o 177.2595 57.80421 6.083969       4.570767      12.01118       5.352264      -9.884248      8.784978  240.6832 57.95493 133.7453 63.36095 106.9379       85.86840 
1 1 1 -6  20 9  o 1037.624 24.28329 210.1688       9.785328      196.7825       12.99205      227.7175       14.87546  1001.689 33.39772 1076.835 35.57077 -75.14606      48.79229 
1 1 1 -6  20 10 f 378.9811 37.74726 28.53856       5.481678      8.695725       9.652251      37.98534       6.659911  224.9006 83.27736 437.2841 39.64832 -212.3835      92.23398 
1 1 1 -6  20 11 o 1179.677 17.69462 271.0955       8.106482      276.4171       11.54126      265.9135       11.38885  1189.301 24.98811 1166.440 25.14140 22.86084       35.44708 
1 1 1 -6  20 12 o 560.8775 25.18054 61.51061       5.484804      68.36741       7.740708      54.59692       7.772760  588.6957 34.00280 524.6809 38.41328 64.01483       51.30079 
1 1 1 -6  20 13 o 815.8680 20.62271 129.8925       6.534217      136.1637       9.467591      124.1883       9.029523  833.2532 29.25732 795.7791 29.21758 37.47418       41.34801 
1 1 1 -6  20 14 o 155.8599 59.89007 3.499166       5.097009      5.620774       7.220432      1.391805       7.196147  188.4495 71.54918 161.4551 67.81260 26.99443       98.57907 
1 1 1 -6  20 15 o 220.1277 66.68455 10.10382       6.192494      4.409064       7.738506      20.24320       10.32583  183.6567 72.83932 303.6787 84.47646 -120.0220      111.5430 
1 1 1 -6  20 16 o 661.7085 25.90595 85.85785       6.657240      85.24251       9.351917      86.49001       9.478887  655.0824 36.91050 659.7785 37.14511 -4.696106      52.36549 
1 1 1 -6  20 17 o 830.8431 22.92953 135.2131       7.398473      136.8492       10.53318      133.6198       10.39424  832.1808 32.59222 822.3225 32.54788 9.858337       46.06101 
1 1 1 -6  20 18 o 272.1880 65.64046 16.14346       6.857989      21.95344       8.452160      4.947682       11.73295  316.0291 70.64259 208.7175 87.04803 107.3116       112.1059 
1 1 1 -6  20 19 o 357.6020 54.90610 27.01840       7.381438      28.57109       8.945669      23.70590       13.06618  361.7270 66.11654 311.6760 97.31362 50.05106       117.6492 
1 1 1 -6  20 20 o 182.0707 66.38425 6.466993       6.096306      11.51555       8.777540      1.762175       8.473456  228.0510 80.06387 168.1611 72.20864 59.88995       107.8161 
1 1 1 -6  20 21 o 124.3537 56.93344 -2.872915      6.189726      -7.711448      9.037636      1.401786       8.494755  135.6306 64.25742 164.5652 71.48248 -28.93463      96.11848 
1 1 1 -6  20 22 o 266.4366 71.95820 17.03202       7.620688      10.90923       14.67315      19.29359       8.917738  228.2313 96.39652 278.7772 78.84542 -50.54587      124.5347 
1 1 1 -6  20 23 o 332.3381 49.96330 24.16399       6.248966      20.13596       8.613667      28.63946       9.079465  281.5336 76.69880 344.6898 70.21167 -63.15628      103.9826 
1 1 1 -6  20 24 o 128.8193 57.70937 -0.3546073     5.957624      2.948318       8.552520      -3.468139      8.303696  162.6426 71.16473 136.0546 63.55138 26.58803       95.41068 
1 1 1 -6  20 25 o 149.5206 62.00174 3.814284       5.903809      17.42380       8.665228      -7.976538      8.065490  245.7321 79.55428 118.6318 57.37403 127.1004       98.08498 
1 1 1 -6  20 26 o 284.9218 56.57665 19.70076       6.039458      31.59489       8.720279      8.736430       8.372499  349.7653 66.63171 182.7478 74.59769 167.0174       100.0230 
1 1 1 -6  21 1  o 325.9394 41.95114 21.22323       5.186911      22.24623       5.719508      16.48505       12.30912  333.0565 45.40240 286.3795 94.93064 46.67703       105.2293 
1 1 1 -6  21 2  o 968.9200 20.92352 182.8887       7.873188      185.9993       9.108498      173.6974       15.65738  976.6215 24.01555 939.3773 42.91915 37.24426       49.18129 
1 1 1 -6  21 3  o 269.3146 47.54292 14.72971       4.790689      18.89614       6.138824      8.239994       7.661541  304.3456 53.91195 212.6299 74.79267 91.71577       92.19785 
1 1 1 -6  21 4  o 597.4357 21.49036 69.56117       4.986122      73.68520       5.940637      59.73072       9.171886  614.5079 24.89302 548.9124 43.37915 65.59558       50.01413 
1 1 1 -6  21 5  o 478.8101 30.95659 45.05140       5.725499      45.16089       7.414655      44.88968       9.010922  477.4248 40.36894 473.5589 49.73986 3.865906       64.06017 
1 1 1 -6  21 6  o 130.3716 59.56909 -4.146760      6.730973      -4.146760      6.730973      0.000000       0.000000  130.3716 59.56909 ?        ?        0.000000       59.56909 
1 1 1 -6  21 7  o 144.9570 58.37163 2.065788       5.046992      -0.9730659E-02 5.943544      7.431133       9.556108  141.3551 60.58073 216.9071 82.32205 -75.55205      102.2103 
1 1 1 -6  21 8  o 730.6409 25.38241 104.2984       7.202194      96.34159       9.042012      118.1085       11.91223  700.6862 33.22871 773.0790 39.81241 -72.39282      51.85726 
1 1 1 -6  21 9  o 471.7870 28.59514 43.73338       5.214480      40.71065       6.107486      51.86254       10.01579  453.8013 34.92345 507.6471 51.51741 -53.84576      62.23898 
1 1 1 -6  21 10 o 538.5516 27.21889 56.90437       5.674336      56.00133       6.642283      59.34330       10.91594  533.1480 32.23206 542.6297 52.45424 -9.481689      61.56584 
1 1 1 -6  21 11 f 1134.060 26.04099 251.6227       11.46890      0.000000       0.000000      251.6227       11.46890  ?        ?        1134.060 26.04099 0.000000       26.04099 
1 1 1 -6  21 12 o 584.3937 29.92344 67.18198       6.768399      75.44917       12.44549      63.70992       8.065428  611.2929 52.94745 567.1644 36.81679 44.12854       64.48960 
1 1 1 -6  21 13 o 598.5809 29.66525 70.34084       6.896025      65.15374       8.370657      81.29791       12.16590  572.9571 37.83213 635.5377 49.68714 -62.58057      62.45063 
1 1 1 -6  21 14 f 763.8041 22.52446 114.0658       6.681352      117.4596       9.342521      110.5129       9.558913  772.6707 31.13448 748.9160 32.86604 23.75470       45.27177 
1 1 1 -6  21 15 o 448.1599 34.23269 39.90946       5.912953      43.88655       8.563947      36.28628       8.174031  465.1150 48.10696 421.3838 50.98677 43.73123       70.09943 
1 1 1 -6  21 16 o 152.8835 67.35496 -1.024240      7.779033      0.000000       0.000000      -1.024240      7.779033  ?        ?        152.8835 67.35496 0.000000       67.35496 
1 1 1 -6  21 17 f 233.3718 63.36648 11.81835       5.890895      12.24368       8.372792      11.40142       8.289796  237.5844 78.27180 231.0508 77.92484 6.533539       110.4480 
1 1 1 -6  21 18 o 182.9413 70.91461 5.588750       7.193828      5.265839       8.865267      6.211325       12.30966  190.9497 77.19707 214.1040 89.21687 -23.15430      117.9790 
1 1 1 -6  21 19 o 202.3979 76.60727 8.007225       8.261249      0.000000       0.000000      8.007225       8.261249  ?        ?        202.3979 76.60727 0.000000       76.60727 
1 1 1 -6  21 20 o 517.3589 32.58828 53.91354       6.514127      60.98392       9.271199      47.01981       9.154640  542.2216 44.41798 471.0877 50.84550 71.13394       67.51460 
1 1 1 -6  21 21 o 206.6764 72.68279 9.743905       7.235189      13.41141       13.87273      8.373599       8.479798  237.3989 96.36071 199.7800 77.11806 37.61885       123.4203 
1 1 1 -6  21 22 o 168.2471 68.91132 4.682248       7.175098      13.76483       12.64173      0.3659568      8.714798  230.8152 92.58040 156.4635 69.96639 74.35172       116.0449 
1 1 1 -6  21 23 o 100.5581 48.42037 -6.520547      5.593803      -13.89928      7.507681      2.687370       8.386786  102.1221 50.57974 161.0152 70.46175 -58.89313      86.73620 
1 1 1 -6  21 24 o 399.3740 39.23250 34.12033       6.006361      24.28839       8.050191      46.46669       9.021024  308.1132 68.99379 451.0337 52.48268 -142.9206      86.68665 
1 1 1 -6  21 25 o 118.4728 54.15994 -1.096804      5.572987      -12.15111      7.877822      9.977566       7.884969  106.3108 52.49931 191.4061 74.22986 -85.09530      90.91891 
1 1 1 -6  22 1  o 1063.741 20.72933 220.5124       8.563459      215.0741       9.772943      238.4949       17.77124  1049.906 23.96882 1100.300 41.58899 -50.39392      48.00155 
1 1 1 -6  22 2  o 161.8858 56.32714 4.730308       4.339808      9.061697       5.997795      -0.2925753E-01 6.287264  212.0729 65.88553 145.2859 62.28775 66.78702       90.66789 
1 1 1 -6  22 3  o 322.0510 41.03942 20.75072       5.016145      22.10885       6.380591      18.55315       8.116385  329.9717 51.47137 296.9088 71.28997 33.06296       87.92931 
1 1 1 -6  22 4  o 574.4608 28.17994 64.53954       6.286782      70.29960       8.189449      56.27411       9.810111  597.2924 35.46430 530.7729 48.11533 66.51947       59.77291 
1 1 1 -6  22 5  o 288.6595 51.60950 17.04567       5.573177      16.16421       7.352543      18.23605       8.544377  277.1973 68.65742 293.3823 74.77303 -16.18500      101.5128 
1 1 1 -6  22 6  o 350.7569 45.57178 24.75092       6.061032      31.77249       8.538509      17.61946       8.605066  394.5460 57.40946 288.0754 75.86664 106.4706       95.13986 
1 1 1 -6  22 7  o 697.8511 21.74459 95.01375       5.893076      101.0922       6.945191      79.38566       11.13632  719.3037 24.86245 631.2345 45.73810 88.06921       52.05877 
1 1 1 -6  22 8  o 860.0253 23.25184 144.4342       7.765986      144.4342       7.765986      0.000000       0.000000  860.0253 23.25184 ?        ?        0.000000       23.25184 
1 1 1 -6  22 9  o 441.2138 32.59211 38.43816       5.545039      39.48141       6.554933      35.81310       10.39783  445.8253 38.22935 415.0489 66.77261 30.77643       76.94196 
1 1 1 -6  22 10 o 299.1257 57.67092 18.58015       6.456581      14.65652       8.285461      24.64682       10.30262  262.7513 76.53388 338.0261 79.76781 -75.27478      110.5456 
1 1 1 -6  22 11 o 958.4448 21.96535 179.4183       8.175858      186.4327       10.08925      166.0020       13.95336  975.6686 26.62739 916.1006 39.22001 59.56805       47.40492 
1 1 1 -6  22 12 o 241.9444 62.07536 12.37840       5.861351      12.45079       7.128907      12.22737       10.29741  242.4354 71.09932 247.4547 86.72780 -5.019318      112.1464 
1 1 1 -6  22 13 o 159.9516 61.89980 3.666622       5.474010      4.276041       7.770875      3.066357       7.712296  182.5505 72.80463 174.8288 71.50701 7.721634       102.0479 
1 1 1 -6  22 14 o 678.1182 29.35134 90.52821       7.729675      87.76256       13.71280      91.81621       9.358061  654.9485 54.40517 679.8850 35.56594 -24.93646      64.99891 
1 1 1 -6  22 15 o 282.2516 53.69522 16.74751       5.670662      19.16780       7.962409      14.25650       8.077892  295.7271 70.35318 254.5838 75.94781 41.14333       103.5260 
1 1 1 -6  22 16 o 415.6616 38.42271 34.85819       6.132163      39.30757       9.036101      31.05976       8.348974  433.5780 54.89396 383.2503 57.89985 50.32767       79.78559 
1 1 1 -6  22 17 o 608.2363 32.86201 73.91183       7.733569      84.08408       9.689304      56.05736       12.83683  645.3170 38.84364 507.7081 66.72090 137.6089       77.20432 
1 1 1 -6  22 18 o 180.8291 66.44662 6.346866       6.124784      5.303912       8.595111      7.422803       8.729970  187.0582 75.87576 200.2247 77.97869 -13.16652      108.8017 
1 1 1 -6  22 19 o 587.2388 42.25461 71.11512       9.572032      0.000000       0.000000      71.11512       9.572032  ?        ?        587.2388 42.25461 0.000000       42.25461 
1 1 1 -6  22 20 o 403.4397 39.86654 33.74987       6.164476      28.85054       8.565861      39.01312       8.878303  355.5157 64.41354 422.1663 55.49734 -66.65063      85.02387 
1 1 1 -6  22 21 o 121.7061 57.10407 -4.584288      6.832253      -1.680620      12.07558      -5.951470      8.286052  169.7107 78.35976 130.6603 61.79160 39.05045       99.79205 
1 1 1 -6  22 22 o 180.6575 65.72498 7.516109       5.971117      4.950204       8.142309      10.50164       8.782899  171.0321 71.99949 204.6952 78.62599 -33.66310      106.6113 
1 1 1 -6  22 23 o 180.1761 64.77456 7.853138       5.776566      11.03493       7.951147      4.296516       8.406450  203.4684 75.53550 165.2078 71.43507 38.26059       103.9643 
1 1 1 -6  22 24 o 176.3265 63.34896 7.715982       5.524240      7.695583       7.641092      7.738320       7.995888  177.7800 71.74059 178.5617 72.89609 -0.7816772     102.2768 
1 1 1 -6  23 1  o 647.6334 21.45286 81.78752       5.395634      79.09538       7.451388      84.75516       7.823353  635.5765 30.18849 657.8444 30.62258 -22.26782      43.00101 
1 1 1 -6  23 2  o 140.0241 55.72250 2.151802       4.542988      7.495645       6.210678      -3.998052      6.662614  198.4469 67.44613 130.0116 59.35062 68.43533       89.84139 
1 1 1 -6  23 3  o 1198.127 18.03775 279.6099       8.392925      279.3622       11.76401      279.8667       11.97765  1195.795 25.33207 1196.747 25.77161 -0.9516602     36.13709 
1 1 1 -6  23 4  o 461.2308 39.50130 42.23161       7.007242      57.45895       11.49796      33.23439       8.838185  533.0366 56.40055 403.3826 58.09346 129.6540       80.96833 
1 1 1 -6  23 5  o 983.9803 21.42104 188.8764       8.185685      187.0577       10.20248      192.1622       13.71390  977.9417 26.86363 988.4521 35.72541 -10.51044      44.69854 
1 1 1 -6  23 6  o 381.0540 42.21644 29.04905       6.142374      29.31361       7.979575      28.66433       9.622555  378.7455 55.93364 369.7324 69.56859 9.013031       89.26567 
1 1 1 -6  23 7  o 657.7465 22.61157 84.47357       5.775869      85.73842       6.833750      81.31032       10.80705  661.9543 26.58294 639.0670 43.80887 22.88733       51.24324 
1 1 1 -6  23 8  o 509.8550 27.95569 51.07522       5.514236      53.52542       6.597377      45.39603       10.04415  520.8509 32.78322 472.2658 55.84558 48.58505       64.75700 
1 1 1 -6  23 9  o 254.6707 55.24587 13.52350       5.306795      13.51264       6.370917      13.54809       9.590905  252.7608 64.64568 255.5049 83.75274 -2.744034      105.7997 
1 1 1 -6  23 10 o 393.2582 43.75029 31.12080       6.568435      31.12080       6.568435      0.000000       0.000000  393.2582 43.75029 ?        ?        0.000000       43.75029 
1 1 1 -6  23 11 o 338.0289 43.38008 23.11525       5.563315      27.75328       6.496232      10.35593       10.77478  369.9194 46.22887 236.6043 87.91209 133.3151       99.32594 
1 1 1 -6  23 12 o 445.0181 37.77520 39.57194       6.466809      35.35497       7.870427      48.33522       11.34570  416.1742 49.67802 481.4091 62.13637 -65.23489      79.55397 
1 1 1 -6  23 13 o 255.1873 56.61131 13.81947       5.463573      24.04300       7.671351      3.295703       7.783179  336.8437 60.88379 175.2855 71.78053 161.5582       94.12376 
1 1 1 -6  23 14 o 149.8548 60.25410 2.663367       5.369071      0.3845979      7.601313      4.932209       7.584739  157.0755 67.92339 182.7493 72.22820 -25.67383      99.14888 
1 1 1 -6  23 15 o 250.4932 68.78075 13.93334       6.895180      13.93867       12.62997      13.93108       8.229851  254.3390 95.04575 249.1026 77.14252 5.236374       122.4119 
1 1 1 -6  23 16 o 177.8635 74.31280 3.412024       8.572708      7.320610       13.40467      0.7070886      11.15128  221.7950 92.81837 183.1167 80.66065 38.67836       122.9691 
1 1 1 -6  23 17 f 135.1760 60.94886 -1.930602      6.766130      3.093523       8.499490      -10.62297      11.17974  174.0212 73.42590 146.7242 70.06320 27.29701       101.4900 
1 1 1 -6  23 18 o 396.3788 40.82829 32.47696       6.194986      37.71064       8.945528      27.65382       8.587502  416.3275 56.81075 349.4615 65.68757 66.86606       86.84652 
1 1 1 -6  23 19 o 138.3892 59.62881 1.018172       5.815970      8.508005       7.966629      -7.528834      8.510313  198.4198 75.19830 129.4825 61.63551 68.93726       97.23024 
1 1 1 -6  23 20 o 275.5846 62.13840 17.77235       6.491570      21.13151       9.954756      15.28701       8.562647  280.6860 84.44127 243.1812 79.10786 37.50473       115.7082 
1 1 1 -6  23 21 o 208.5518 68.86016 10.85114       6.478985      10.09883       10.07945      11.38085       8.457747  203.3239 82.27390 210.1588 77.92737 -6.834946      113.3211 
1 1 1 -6  23 22 o 328.2289 47.95951 24.08271       5.932954      20.75504       8.263789      27.62253       8.523148  277.7235 74.90208 330.5395 68.64176 -52.81595      101.5973 
1 1 1 -6  23 23 o 148.9059 60.94201 4.115777       5.606055      13.43137       7.911434      -5.279017      7.944992  217.0524 76.02195 124.1474 59.22174 92.90504       96.36676 
1 1 1 -6  24 1  o 754.3156 20.46256 110.9526       5.994334      103.2201       8.125914      120.1838       8.878532  726.0535 28.81878 783.3633 29.18435 -57.30981      41.01522 
1 1 1 -6  24 2  f 776.0210 22.83209 117.5636       6.880929      107.4438       10.57039      125.0053       9.064473  738.7091 36.84593 798.8448 29.21811 -60.13574      47.02468 
1 1 1 -6  24 3  o 106.4422 51.74357 -11.38611      6.782079      0.000000       0.000000      -11.38611      6.782079  ?        ?        106.4422 51.74357 0.000000       51.74357 
1 1 1 -6  24 4  o 129.3614 54.31541 0.6758689      4.614213      1.360812       5.538963      -0.8773193     8.340904  144.8664 60.06223 161.4394 70.46783 -16.57300      92.59150 
1 1 1 -6  24 5  o 583.3948 24.64800 66.54324       5.584344      67.47905       6.653517      64.31288       10.27180  586.6730 29.20298 566.6163 47.10691 20.05670       55.42450 
1 1 1 -6  24 6  o 618.6778 23.83758 74.82436       5.727362      75.57793       6.752021      72.89119       10.81440  620.9974 27.99729 603.3434 46.51289 17.65405       54.28901 
1 1 1 -6  24 7  o 424.1976 37.41548 35.81267       6.100642      33.83829       7.842666      38.83792       9.707990  408.1768 50.55690 434.4080 59.07681 -26.23111      77.75647 
1 1 1 -6  24 8  o 555.9631 26.49191 60.58302       5.719883      67.32322       6.843698      44.96454       10.41775  584.4965 30.25317 467.4239 58.68338 117.0726       66.02267 
1 1 1 -6  24 9  o 212.7517 60.62109 9.511395       5.251456      10.20783       6.261130      7.859109       9.643959  220.6467 67.10035 216.1264 82.53831 4.520218       106.3721 
1 1 1 -6  24 10 o 496.6686 30.71002 48.79221       5.894391      53.87405       6.939546      35.62912       11.16862  520.7624 34.50893 406.5205 73.44701 114.2419       81.15004 
1 1 1 -6  24 11 o 212.5224 63.11462 9.577441       5.587971      10.26443       6.479632      7.583845       11.03809  220.0455 68.50036 219.3998 87.00003 0.6457214      110.7308 
1 1 1 -6  24 12 f 446.8058 41.42963 40.35995       7.107048      40.35995       7.107048      0.000000       0.000000  446.8058 41.42963 ?        ?        0.000000       41.42963 
1 1 1 -6  24 13 o 204.5131 67.32914 8.798631       6.195752      9.178098       7.434950      7.936242       11.20838  211.0661 73.70992 218.6376 87.35841 -7.571472      114.3007 
1 1 1 -6  24 14 o 306.6985 49.17271 19.72367       5.658958      20.48951       8.047404      18.97451       7.959273  302.3804 69.92384 290.1337 71.17658 12.24670       99.77700 
1 1 1 -6  24 15 o 471.6784 32.72374 44.64643       5.957203      48.60523       8.346625      40.53585       8.505126  485.5851 44.76464 439.5255 50.76102 46.05963       67.67979 
1 1 1 -6  24 16 o 128.0404 58.50911 -2.830219      6.495367      -3.855955      8.062934      -0.9339216     10.96298  139.5118 64.27969 172.8575 77.79341 -33.34569      100.9143 
1 1 1 -6  24 17 o 288.5370 61.32147 18.77898       6.659554      23.18670       12.04715      16.83938       7.991593  295.6810 93.60249 264.7495 74.55544 30.93152       119.6659 
1 1 1 -6  24 18 o 192.5536 63.82165 8.408669       5.563583      11.18783       7.813591      5.550582       7.923757  216.4038 75.56412 178.8490 72.73895 37.55489       104.8851 
1 1 1 -6  24 19 o 111.3021 52.83361 -5.469014      6.168037      -7.121023      9.778144      -4.377248      7.949047  138.6139 66.00559 132.1271 61.86598 6.486832       90.46622 
1 1 1 -6  24 20 o 158.8724 64.28364 4.579523       6.153047      -7.834207      8.564418      17.82251       8.845851  125.3153 60.23339 255.0256 80.14248 -129.7103      100.2541 
1 1 1 -6  24 21 o 123.9023 54.90610 0.2344028      5.243558      -0.6521345     6.715136      1.619507       8.393584  132.3433 60.09235 153.3618 68.61599 -21.01843      91.20989 
1 1 1 -6  25 1  o 383.1661 37.98574 29.27205       5.577953      19.15662       8.253958      37.77490       7.567502  299.3201 71.90569 433.4447 45.64230 -134.1246      85.16835 
1 1 1 -6  25 2  o 835.0223 24.99944 136.4344       8.106927      112.4519       14.74933      146.8163       9.704280  747.4891 51.11555 865.1040 28.88464 -117.6149      58.71220 
1 1 1 -6  25 3  o 146.4158 58.50927 2.403634       5.028576      1.133384       6.955183      3.794846       7.278811  157.5481 66.44535 176.4592 70.43467 -18.91106      96.82989 
1 1 1 -6  25 4  o 228.9569 55.40796 10.99177       4.873494      10.72829       5.819829      11.61018       8.916038  225.7522 63.64109 238.9989 80.81358 -13.24669      102.8641 
1 1 1 -6  25 5  o 370.3806 35.96032 27.35467       5.107299      25.69167       6.091435      31.29063       9.371278  356.1929 45.04261 385.9949 64.81293 -29.80203      78.92751 
1 1 1 -6  25 6  o 572.7966 25.46397 64.31299       5.664407      66.74211       6.809262      58.85523       10.20662  581.6386 30.24963 539.0380 49.30278 42.60065       57.84293 
1 1 1 -6  25 7  o 284.7845 47.03697 16.67337       5.020534      20.38054       5.953772      7.549639       9.340227  314.3173 50.48369 211.8523 81.15154 102.4650       95.57288 
1 1 1 -6  25 8  o 634.7784 24.45692 79.02715       6.029092      88.38052       7.174781      56.55192       11.12184  670.3964 27.55809 523.8297 55.51734 146.5667       61.98083 
1 1 1 -6  25 9  o 231.5570 83.90406 10.72305       9.716933      0.000000       0.000000      10.72305       9.716933  ?        ?        231.5570 83.90406 0.000000       83.90406 
1 1 1 -6  25 10 o 462.1470 32.14964 42.50889       5.734187      42.94364       6.786731      41.42418       10.71999  462.2451 38.14675 440.6322 64.56055 21.61288       74.98827 
1 1 1 -6  25 11 o 644.6882 25.31246 81.82240       6.337412      93.04523       7.684197      57.95361       11.20630  686.0850 28.83982 526.6429 55.63427 159.4421       62.66504 
1 1 1 -6  25 12 o 258.4003 57.87591 14.46554       5.663597      10.83114       6.614666      24.44873       10.96291  222.1169 69.22115 321.5295 86.08447 -99.41258      110.4631 
1 1 1 -6  25 13 o 179.6155 69.05422 5.644514       6.778386      5.644514       6.778386      0.000000       0.000000  179.6155 69.05422 ?        ?        0.000000       69.05422 
1 1 1 -6  25 14 o 528.1663 35.12003 56.34179       7.162604      64.92140       8.494188      35.22935       13.32469  564.6310 38.97594 375.8799 92.02136 188.7511       99.93525 
1 1 1 -6  25 15 o 266.8555 63.49058 16.16641       6.484302      12.07908       7.910397      24.53815       11.32103  227.6291 76.12395 310.3959 89.18931 -82.76683      117.2586 
1 1 1 -6  25 16 o 269.2664 74.78806 17.63269       8.099730      0.000000       0.000000      17.63269       8.099730  ?        ?        269.2664 74.78806 0.000000       74.78806 
1 1 1 -6  25 17 o 196.0265 63.63077 8.874207       5.541030      16.40805       7.498777      -0.1866591     8.223697  258.3781 72.03007 151.2384 67.77402 107.1396       98.90221 
1 1 1 -6  25 18 f 186.4168 74.80621 7.318191       8.257722      0.000000       0.000000      7.318191       8.257722  ?        ?        186.4168 74.80621 0.000000       74.80621 
1 1 1 -6  25 19 o 143.1406 61.21898 2.238297       6.046867      3.548264       9.531534      1.355954       7.822601  169.4951 74.62034 150.7741 66.92642 18.72101       100.2364 
1 1 1 -6  25 20 o 138.6577 58.03829 2.685275       5.242547      -9.049841      6.878360      18.95211       8.098281  105.7747 51.57274 263.9399 75.30565 -158.1652      91.27261 
1 1 1 -6  26 1  o 751.4655 26.80563 110.8538       7.822816      107.2317       14.08794      112.4686       9.406263  727.7645 50.15194 755.1534 32.07406 -27.38898      59.53119 
1 1 1 -6  26 2  o 429.6315 41.36112 37.10670       6.815796      29.37429       12.45512      40.41206       8.143289  360.6523 89.37919 446.0764 47.74857 -85.42419      101.3339 
1 1 1 -6  26 3  o 172.9559 61.16768 5.560284       5.131075      16.52652       7.158805      -6.025263      7.358175  276.7147 67.27033 128.5545 59.97272 148.1602       90.12228 
1 1 1 -6  26 4  o 205.6839 57.66531 8.932139       4.791909      9.467030       5.640057      7.543965       9.086011  211.8111 63.52324 209.7533 80.11258 2.057785       102.2410 
1 1 1 -6  26 5  o 134.8763 55.72421 1.414628       4.743710      5.262324       5.605883      -8.288667      8.902321  172.8671 63.56224 136.9748 64.55379 35.89226       90.59442 
1 1 1 -6  26 6  o 187.4021 60.06430 7.215665       4.948942      4.633031       5.867202      13.58434       9.213493  169.2847 64.44325 249.9758 82.09550 -80.69112      104.3676 
1 1 1 -6  26 7  o 156.7439 59.41461 3.963014       4.973879      7.113226       5.899981      -3.776029      9.247500  189.5456 65.69171 154.5081 70.29601 35.03755       96.21294 
1 1 1 -6  26 8  o 348.9087 40.02217 24.71264       5.324909      27.76105       6.236285      16.50917       10.23029  368.2326 44.51247 269.2540 86.36462 98.97864       97.16073 
1 1 1 -6  26 9  o 776.0323 23.80263 118.4270       7.173527      121.2398       8.677271      112.3544       12.74980  783.0461 28.53434 743.2550 44.37354 39.79108       52.75623 
1 1 1 -6  26 10 o 316.5826 45.81224 20.80005       5.468687      20.95769       6.441649      20.39323       10.34832  313.6395 54.88497 293.6965 85.52797 19.94296       101.6238 
1 1 1 -6  26 11 o 252.7344 67.55387 14.38747       6.757777      9.162277       8.690341      22.38029       10.74821  212.0779 78.92171 304.5708 86.70661 -92.49294      117.2462 
1 1 1 -6  26 12 f 826.2569 23.02358 134.6034       7.387815      132.6869       8.533992      140.3354       14.75863  818.1199 26.86008 823.8130 46.31860 -5.693176      53.54322 
1 1 1 -6  26 13 o 260.1049 60.01685 15.12611       5.939176      13.74664       6.944995      18.88093       11.45803  243.3356 69.83775 272.6019 91.61498 -29.26633      115.1982 
1 1 1 -6  26 14 o 365.1071 51.67523 28.74236       7.122443      28.74236       7.122443      0.000000       0.000000  365.1071 51.67523 ?        ?        0.000000       51.67523 
1 1 1 -6  26 15 o 133.6360 58.69812 0.1561809      5.868172      0.4673105      7.339363      -0.3952053     9.770476  148.0757 65.32062 162.0986 73.15016 -14.02293      98.07002 
1 1 1 -6  26 16 o 290.8697 51.38193 18.74731       5.591872      17.04651       7.590840      20.76547       8.268784  261.5290 72.31399 288.3637 73.59163 -26.83472      103.1748 
1 1 1 -6  26 17 o 307.7811 47.09901 20.76270       5.450575      24.35810       7.490798      16.71718       7.945871  320.9299 62.34896 253.1808 75.27815 67.74916       97.74555 
1 1 1 -6  26 18 o 307.9397 54.31717 21.79023       6.258353      22.00703       9.467345      21.62196       8.340631  280.4151 81.84837 287.0279 74.26028 -6.612854      110.5158 
1 1 1 -6  27 1  o 301.4731 57.11363 19.25434       6.441986      8.185465       11.82558      23.92512       7.681847  224.8855 89.77335 334.9715 61.31075 -110.0860      108.7118 
1 1 1 -6  27 2  o 369.9372 52.18618 28.43329       7.289150      28.43329       7.289150      0.000000       0.000000  369.9372 52.18618 ?        ?        0.000000       52.18618 
1 1 1 -6  27 3  o 265.4616 55.63742 14.99656       5.552375      7.441268       6.972133      28.09542       9.180300  196.7239 71.10461 359.4069 68.26852 -162.6829      98.57208 
1 1 1 -6  27 4  o 131.6116 55.08584 1.088020       4.722346      -1.890193      5.530602      9.102475       9.072594  123.5552 55.45916 216.8574 80.65092 -93.30218      97.87896 
1 1 1 -6  27 5  o 155.5833 58.49404 4.053560       4.797809      1.420822       5.740068      10.15693       8.739735  144.5022 60.62178 222.1515 79.69451 -77.64934      100.1310 
1 1 1 -6  27 6  o 169.3209 60.17950 5.483573       4.972529      4.870760       5.867755      7.044956       9.366182  169.6179 64.47584 204.1992 80.40382 -34.58133      103.0626 
1 1 1 -6  27 7  o 401.6990 33.96324 32.41229       5.248667      34.93532       6.231287      26.25067       9.737870  414.9386 39.13139 339.7703 75.73307 75.16833       85.24532 
1 1 1 -6  27 8  o 218.7068 57.75169 10.43987       4.977732      7.044870       5.812153      19.78319       9.642009  186.2113 65.16320 289.7135 82.00088 -103.5022      104.7396 
1 1 1 -6  27 9  o 187.8183 61.36792 7.507743       5.150788      4.903981       5.918216      15.63984       10.45903  168.5373 64.58820 256.9647 87.52431 -88.42737      108.7756 
1 1 1 -6  27 10 o 592.9191 27.10395 69.76135       6.241026      71.28651       7.224384      65.27498       12.39056  596.4937 31.29577 549.8003 58.95033 46.69342       66.74253 
1 1 1 -6  27 11 o 477.3571 33.29818 46.04356       6.134273      47.94814       7.104604      40.46460       12.15954  484.3104 38.08070 413.1386 78.65990 71.17175       87.39291 
1 1 1 -6  27 12 o 147.5481 60.71115 2.668676       5.600979      6.665818       6.494377      -8.935476      11.06546  181.7681 68.11032 147.3316 70.17316 34.43657       97.79206 
1 1 1 -6  27 13 o 246.4670 62.69553 14.10229       6.015205      15.01915       6.779103      10.70796       13.04358  251.2758 67.87078 221.5060 92.03054 29.76985       114.3506 
1 1 1 -6  27 14 o 277.3481 63.84309 18.10704       6.734045      18.10704       6.734045      0.000000       0.000000  277.3481 63.84309 ?        ?        0.000000       63.84309 
1 1 1 -6  27 15 o 200.1066 66.01445 9.604070       5.955025      7.878928       6.961241      14.31128       11.49889  186.6688 70.40155 229.1865 89.42892 -42.51767      113.8152 
1 1 1 -6  27 16 o 134.7584 57.58981 1.687669       5.343775      -4.464140      7.550464      7.861606       7.564032  126.7256 59.64039 185.7061 72.51244 -58.98055      93.88839 
1 1 1 -6  27 17 o 175.7311 70.03751 6.764266       7.186928      7.250452       10.62561      6.354279       9.757490  187.5677 80.70882 181.2142 77.64112 6.353500       111.9913 
1 1 1 -6  28 1  o 543.1434 28.77318 58.55510       6.047546      57.69780       7.491393      60.15904       10.24681  535.7661 36.21742 539.3844 49.46846 -3.618347      61.30930 
1 1 1 -6  28 2  o 119.4484 53.21351 -1.284418      4.990437      4.498914       6.829418      -7.910637      7.310171  172.9578 68.48064 119.9573 57.10770 53.00053       89.16776 
1 1 1 -6  28 3  o 440.7654 32.35570 38.89270       5.499722      35.38831       7.649220      42.64299       7.913050  412.6221 48.67168 455.2494 45.36161 -42.62735      66.53276 
1 1 1 -6  28 4  o 364.9321 41.42358 27.29448       5.766660      25.76712       7.289576      29.84893       9.427135  347.2357 55.95855 366.2732 68.80083 -19.03748      88.68435 
1 1 1 -6  28 5  o 286.3004 45.54925 17.14009       4.894779      16.60196       5.818009      18.44368       9.055264  276.9283 56.02188 280.1190 79.53011 -3.190643      97.28047 
1 1 1 -6  28 6  o 181.8273 59.49286 6.998456       4.840217      5.603573       5.733436      10.45852       9.030009  172.7513 64.14017 220.4105 80.72788 -47.65924      103.1065 
1 1 1 -6  28 7  o 204.7180 59.63740 9.259421       5.030634      6.540477       5.892837      16.56536       9.659671  180.6331 65.35734 261.9237 83.91178 -81.29059      106.3615 
1 1 1 -6  28 8  o 415.1183 33.78437 34.88244       5.399227      34.16488       6.295112      36.87906       10.50077  407.3371 40.32404 402.3535 69.72908 4.983673       80.54919 
1 1 1 -6  28 9  o 123.3039 54.65426 -0.6943956     5.198651      2.220948       6.073195      -8.687123      10.05587  148.9863 62.42196 140.7084 66.98463 8.277847       91.56114 
1 1 1 -6  28 10 o 152.3614 60.89072 3.576009       5.446800      3.525532       6.303456      3.724781       10.82164  158.1187 64.65657 185.9940 80.73563 -27.87534      103.4346 
1 1 1 -6  28 11 o 148.7331 60.92157 3.017710       5.608082      14.49775       6.594151      -26.98947      10.66105  247.0213 67.02953 110.2008 55.42399 136.8205       86.97572 
1 1 1 -6  28 12 o 319.3334 47.90748 22.11641       5.757927      30.74239       6.749864      -0.9338797     11.03390  377.9527 47.00154 166.2953 76.09120 211.6574       89.43722 
1 1 1 -6  28 13 o 362.6305 51.19740 29.05236       7.009527      29.05236       7.009527      0.000000       0.000000  362.6305 51.19740 ?        ?        0.000000       51.19740 
1 1 1 -6  28 14 o 163.6545 63.59568 5.392187       5.796642      0.8649981      6.746940      18.15364       11.32772  141.9730 62.62867 248.5248 90.50927 -106.5518      110.0649 
1 1 1 -6  28 15 o 111.9624 52.41320 -3.538512      5.700325      -11.18278      6.633054      18.05371       11.14793  98.97340 48.74128 245.0651 89.70600 -146.0917      102.0925 
1 1 1 -6  29 1  o 182.6188 60.38591 7.086973       4.981770      4.533448       6.285174      11.40238       8.170684  167.4393 65.88548 224.6365 77.33727 -57.19725      101.5970 
1 1 1 -6  29 2  o 143.9989 58.33709 2.601493       5.074036      -6.564855      6.428489      17.74917       8.263877  113.2839 53.82176 274.4926 75.26871 -161.2087      92.53194 
1 1 1 -6  29 3  o 159.7112 59.49620 4.702670       4.941343      12.32994       6.740576      -4.157805      7.265092  231.6447 69.43873 130.5827 60.46399 101.0619       92.07405 
1 1 1 -6  29 4  o 196.7302 63.02962 8.551456       5.450056      7.393609       7.077324      10.23853       8.542997  190.9761 71.19157 215.1680 78.56428 -24.19194      106.0216 
1 1 1 -6  29 5  o 154.5579 58.25201 4.321378       4.763887      0.7505208      5.689958      12.69234       8.711849  136.8194 58.96577 231.6296 79.85091 -94.81026      99.26294 
1 1 1 -6  29 6  o 212.0782 57.98231 10.10788       4.912445      7.748805       5.777115      16.26712       9.334767  188.6164 65.02486 255.7652 82.54642 -67.14874      105.0816 
1 1 1 -6  29 7  o 104.4498 48.97296 -4.044126      5.010013      -5.765517      5.920242      0.2987387      9.403463  108.9924 51.74426 163.6678 72.96967 -54.67535      89.45412 
1 1 1 -6  29 8  o 174.5217 61.75689 6.494947       5.231125      4.705131       6.048337      11.80839       10.42124  163.7573 64.56990 222.6566 85.61741 -58.89931      107.2363 
1 1 1 -6  29 9  o 184.3602 62.13685 7.636186       5.270935      10.59234       6.211476      0.3131199E-01  9.962699  211.5034 67.23869 164.0885 73.97395 47.41487       99.96593 
1 1 1 -6  29 10 f 317.0877 46.48437 21.71965       5.554227      17.28284       6.501161      33.70959       10.68721  271.0706 62.96083 366.8012 77.45480 -95.73065      99.81639 
1 1 1 -6  29 11 o 253.4420 58.03350 14.89060       5.588927      22.67841       6.625033      -4.332000      10.40845  316.1195 56.01513 150.3542 70.52531 165.7653       90.06394 
1 1 1 -6  29 12 f 257.9200 65.93236 16.26850       6.629366      16.26850       6.629366      0.000000       0.000000  257.9200 65.93236 ?        ?        0.000000       65.93236 
1 1 1 -6  30 1  o 96.64809 45.61199 -4.224009      4.472723      1.417179       6.228133      -10.23183      6.427341  144.9273 62.06027 101.5343 49.58173 43.39300       79.43440 
1 1 1 -6  30 2  o 301.1409 73.34022 21.77625       8.497358      0.000000       0.000000      21.77625       8.497358  ?        ?        301.1409 73.34022 0.000000       73.34022 
1 1 1 -6  30 3  o 275.0995 52.15734 16.60090       5.368363      14.78768       6.936286      19.30947       8.477579  249.3385 69.19285 280.4818 75.95669 -31.14331      102.7476 
1 1 1 -6  30 4  o 240.6638 59.59970 13.24831       5.541146      10.81357       7.158058      16.88905       8.753131  213.9831 72.40932 259.0130 79.44930 -45.02986      107.4956 
1 1 1 -6  30 5  o 206.8458 64.22229 9.949514       5.699781      5.141879       7.390137      17.00834       8.954742  173.4830 70.36092 258.1062 80.55684 -84.62318      106.9582 
1 1 1 -6  30 6  o 436.6224 37.31570 39.42842       6.266633      42.06769       8.172473      35.66203       9.762798  442.2287 48.37484 390.6509 66.74868 51.57773       82.43489 
1 1 1 -6  30 7  o 210.8864 59.84632 10.34171       5.128806      11.57476       6.105253      7.384853       9.454249  219.9206 66.12174 193.0252 79.08618 26.89537       103.0859 
1 1 1 -6  30 8  o 114.5787 51.96601 -1.533478      5.003226      -6.861318      5.881259      12.42161       9.518336  103.6187 49.83224 220.9335 82.52111 -117.3148      96.40014 
1 1 1 -5  0  1  o 161.2956 34.53222 5.705632       1.899679      5.705632       1.899679      5.705632       1.899679  161.2956 34.53222 161.2956 34.53222 0.000000       0.000000 
1 1 1 -5  0  2  o 336.5399 19.69505 22.24005       2.553900      22.24005       2.553900      22.24005       2.553900  336.5399 19.69505 336.5399 19.69505 0.000000       0.000000 
1 1 1 -5  0  3  o 1104.354 17.60524 237.1873       7.546218      237.1873       7.546218      237.1873       7.546218  1104.354 17.60524 1104.354 17.60524 0.000000       0.000000 
1 1 1 -5  0  4  o 494.9417 18.56543 47.80774       3.557116      47.80774       3.557116      47.80774       3.557116  494.9417 18.56543 494.9417 18.56543 0.000000       0.000000 
1 1 1 -5  0  5  o 461.7034 19.92283 41.66201       3.557120      41.66201       3.557120      41.66201       3.557120  461.7034 19.92283 461.7034 19.92283 0.000000       0.000000 
1 1 1 -5  0  6  o 142.0241 55.20479 5.382535       2.900775      5.382535       2.900775      5.382535       2.900775  142.0241 55.20479 142.0241 55.20479 0.000000       0.000000 
1 1 1 -5  0  7  o 425.7401 22.55806 35.53170       3.705788      35.53170       3.705788      35.53170       3.705788  425.7401 22.55806 425.7401 22.55806 0.000000       0.000000 
1 1 1 -5  0  8  o 419.6658 23.71973 34.57021       3.837573      34.57021       3.837573      34.57021       3.837573  419.6658 23.71973 419.6658 23.71973 0.000000       0.000000 
1 1 1 -5  0  9  o 790.9305 19.27717 121.8046       5.913252      121.8046       5.913252      121.8046       5.913252  790.9305 19.27717 790.9305 19.27717 0.000000       0.000000 
1 1 1 -5  0  10 o 64.74454 43.94278 -1.770239      3.321716      -1.770239      3.321716      -1.770239      3.321716  64.74454 43.94278 64.74454 43.94278 -0.000000      0.000000 
1 1 1 -5  0  11 o 294.5713 57.78002 18.81605       5.883756      18.81605       5.883756      18.81605       5.883756  294.5713 57.78002 294.5713 57.78002 -0.000000      0.000000 
1 1 1 -5  0  12 o 651.1277 32.14094 83.25262       8.082255      83.25262       8.082255      83.25262       8.082255  651.1277 32.14094 651.1277 32.14094 0.000000       0.000000 
1 1 1 -5  0  13 o 305.5968 40.34650 19.18781       4.556038      19.18781       4.556038      19.18781       4.556038  305.5968 40.34650 305.5968 40.34650 0.000000       0.000000 
1 1 1 -5  0  14 o 588.1879 24.53068 67.75694       5.581267      67.75694       5.581267      67.75694       5.581267  588.1879 24.53068 588.1879 24.53068 0.000000       0.000000 
1 1 1 -5  0  15 o 276.7027 50.99986 16.49900       4.931842      16.49900       4.931842      16.49900       4.931842  276.7027 50.99986 276.7027 50.99986 0.000000       0.000000 
1 1 1 -5  0  16 o 1328.308 31.59599 345.4933       16.27810      345.4933       16.27810      345.4933       16.27810  1328.308 31.59599 1328.308 31.59599 0.000000       0.000000 
1 1 1 -5  0  17 o 155.7648 74.35925 7.135993       5.155489      7.135993       5.155489      7.135993       5.155489  155.7648 74.35925 155.7648 74.35925 0.000000       0.000000 
1 1 1 -5  0  18 o 326.5761 46.88260 22.18723       5.590395      22.18723       5.590395      22.18723       5.590395  326.5761 46.88260 326.5761 46.88260 0.000000       0.000000 
1 1 1 -5  0  19 o 662.5953 27.35968 86.00644       7.012954      86.00644       7.012954      86.00644       7.012954  662.5953 27.35968 662.5953 27.35968 -0.000000      0.000000 
1 1 1 -5  0  20 o 128.5560 73.85146 4.218166       5.882010      4.218166       5.882010      4.218166       5.882010  128.5560 73.85146 128.5560 73.85146 0.000000       0.000000 
1 1 1 -5  0  21 o 811.3804 26.92311 128.6229       8.462385      128.6229       8.462385      128.6229       8.462385  811.3804 26.92311 811.3804 26.92311 0.000000       0.000000 
1 1 1 -5  0  22 f 191.9852 84.61348 10.49901       6.619178      10.49901       6.619178      10.49901       6.619178  191.9852 84.61348 191.9852 84.61348 0.000000       0.000000 
1 1 1 -5  0  23 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -5  0  24 o 437.6960 48.66014 38.93357       8.009820      38.93357       8.009820      38.93357       8.009820  437.6960 48.66014 437.6960 48.66014 0.000000       0.000000 
1 1 1 -5  0  25 o 208.4657 92.48983 12.58643       7.906997      12.58643       7.906997      12.58643       7.906997  208.4657 92.48983 208.4657 92.48983 0.000000       0.000000 
1 1 1 -5  0  26 o 145.2923 86.75168 4.838210       8.659372      4.838210       8.659372      4.838210       8.659372  145.2923 86.75168 145.2923 86.75168 -0.000000      0.000000 
1 1 1 -5  0  27 f 347.9540 78.94311 27.57600       9.300767      27.57600       9.300767      27.57600       9.300767  347.9540 78.94311 347.9540 78.94311 0.000000       0.000000 
1 1 1 -5  0  28 o 189.9934 98.86633 11.11737       9.494251      11.11737       9.494251      11.11737       9.494251  189.9934 98.86633 189.9934 98.86633 -0.000000      0.000000 
1 1 1 -5  0  29 o 1190.153 43.94952 281.6044       20.25066      281.6044       20.25066      281.6044       20.25066  1190.153 43.94952 1190.153 43.94952 0.000000       0.000000 
1 1 1 -5  0  30 o 454.9478 61.18224 44.10280       10.26022      44.10280       10.26022      44.10280       10.26022  454.9478 61.18224 454.9478 61.18224 -0.000000      0.000000 
1 1 1 -5  0  31 o 97.75847 68.39925 -7.949874      9.666689      -7.949874      9.666689      -7.949874      9.666689  97.75847 68.39925 97.75847 68.39925 0.000000       0.000000 
1 1 1 -5  0  32 o 147.2818 96.61965 2.903537       13.84498      2.903537       13.84498      2.903537       13.84498  147.2818 96.61965 147.2818 96.61965 0.000000       0.000000 
1 1 1 -5  0  33 o 113.7655 80.46720 -10.97845      14.55088      -10.97845      14.55088      -10.97845      14.55088  113.7655 80.46720 113.7655 80.46720 0.000000       0.000000 
1 1 1 -5  0  34 o 161.4100 96.60086 10.13872       10.78839      10.13872       10.78839      10.13872       10.78839  161.4100 96.60086 161.4100 96.60086 -0.000000      0.000000 
1 1 1 -5  1  1  o 619.8295 11.25076 74.65411       2.708210      75.85069       3.838308      73.46786       3.821720  624.5585 15.82482 614.6597 16.01018 9.898804       22.51113 
1 1 1 -5  1  2  f 480.5708 12.14660 44.88229       2.266940      48.06204       3.246515      41.85670       3.166845  497.1129 16.81645 463.8785 17.57902 33.23444       24.32724 
1 1 1 -5  1  3  o 308.5682 15.37847 18.51254       1.842860      17.58510       2.606655      19.43934       2.605740  299.6727 22.56353 315.2835 21.40834 -15.61078      31.10353 
1 1 1 -5  1  4  o 401.5826 14.00647 31.34758       2.184397      34.19916       3.144539      28.68825       3.036690  419.2519 19.31319 383.3997 20.46888 35.85220       28.14204 
1 1 1 -5  1  5  o 376.5588 15.51355 27.56824       2.268674      28.50133       3.244558      26.67564       3.173404  382.0103 21.96262 369.5064 22.21767 12.50391       31.24071 
1 1 1 -5  1  6  f 92.43003 36.38155 0.9438054      1.917023      1.636191       2.712849      0.2532237      2.709313  113.0882 43.62878 98.97526 41.59189 14.11298       60.27732 
1 1 1 -5  1  7  o 537.2122 14.36496 56.09933       2.996942      53.29140       4.238445      58.90691       4.238185  523.2831 20.85652 550.2225 19.83415 -26.93939      28.78173 
1 1 1 -5  1  8  o 635.3118 20.21718 78.54991       4.988104      78.54991       4.988104      0.000000       0.000000  635.3118 20.21718 ?        ?        0.000000       20.21718 
1 1 1 -5  1  9  o 383.1960 18.70720 28.57321       2.783925      26.34315       3.947127      30.78067       3.927080  366.4107 27.94945 396.5375 25.63826 -30.12677      37.92746 
1 1 1 -5  1  10 o 591.2037 15.30819 67.97715       3.514707      66.71398       4.994529      69.21634       4.946905  585.1919 21.97699 596.1190 21.36843 -10.92712      30.65286 
1 1 1 -5  1  11 o 446.3698 26.55152 39.03844       4.581927      35.15914       6.337913      43.28575       6.631714  421.2344 39.19275 468.2679 36.76277 -47.03342      53.73614 
1 1 1 -5  1  12 o 460.5764 26.85466 41.60693       4.782572      37.27355       6.573029      46.48193       6.971721  433.2605 39.49914 484.7350 37.32159 -51.47449      54.34228 
1 1 1 -5  1  13 o 353.0187 23.57102 24.46006       3.212922      25.57635       4.501684      23.30104       4.587034  359.3095 32.61642 342.2938 34.99910 17.01569       47.84106 
1 1 1 -5  1  14 o 228.7624 36.72514 10.59537       3.152306      6.354042       4.501031      14.67842       4.416245  178.2650 57.29712 268.1738 43.92540 -89.90878      72.19696 
1 1 1 -5  1  15 o 513.2421 22.58435 51.56064       4.501505      56.41643       7.611728      48.94894       5.582327  532.0828 37.06785 497.9816 28.99059 34.10120       47.05826 
1 1 1 -5  1  16 o 833.8807 22.47534 136.1453       7.278437      149.3931       10.92863      125.5852       9.757219  869.6711 32.35806 797.7242 31.49527 71.94690       45.15524 
1 1 1 -5  1  17 o 119.7773 53.75938 -1.988621      5.195759      -1.988621      5.195759      0.000000       0.000000  119.7773 53.75938 ?        ?        0.000000       53.75938 
1 1 1 -5  1  18 o 173.0578 52.53691 6.105146       3.840672      -1.013483      5.451857      13.11860       5.411431  128.5708 56.52298 249.5766 57.07268 -121.0058      80.32520 
1 1 1 -5  1  19 o 925.6429 16.98496 166.9720       6.105710      157.5512       8.471712      177.1548       8.807636  897.4676 24.30661 951.8011 23.82787 -54.33350      34.03790 
1 1 1 -5  1  20 o 175.3245 54.99870 6.135744       4.168062      6.325208       5.874699      5.943700       5.914563  185.8877 65.48137 182.8923 65.56559 2.995377       92.66422 
1 1 1 -5  1  21 o 741.9263 19.62440 107.2904       5.654381      103.8522       7.894171      110.9129       8.102920  728.5393 27.90137 752.9366 27.71119 -24.39728      39.32425 
1 1 1 -5  1  22 o 897.0712 18.97727 156.7813       6.611326      156.3607       9.243375      157.2218       9.460042  894.4355 26.61053 896.7727 27.16331 -2.337219      38.02586 
1 1 1 -5  1  23 o 180.8476 60.38474 6.272433       4.977408      5.094203       7.063743      7.434375       7.014749  184.8538 70.62871 201.9445 71.50871 -17.09071      100.5083 
1 1 1 -5  1  24 o 119.8272 53.62667 -1.974269      5.130630      -3.168025      7.274658      -0.7928065     7.237102  140.0784 63.17495 150.6534 65.70301 -10.57501      91.14801 
1 1 1 -5  1  25 o 452.9604 33.90232 40.66065       5.920475      47.76167       8.487391      33.93053       8.262761  487.4326 45.35699 407.2890 53.53600 80.14359       70.16666 
1 1 1 -5  1  26 o 650.4211 38.73574 84.24902       9.740087      84.24902       9.740087      0.000000       0.000000  650.4211 38.73574 ?        ?        0.000000       38.73574 
1 1 1 -5  1  27 o 334.3499 51.21695 23.09460       6.438466      32.72174       8.974531      12.88488       9.242093  395.0450 60.41774 246.3652 82.28300 148.6799       102.0823 
1 1 1 -5  1  28 o 799.2043 28.96951 126.0949       8.991394      121.2585       10.67904      137.8732       16.66526  780.6702 35.22382 818.9383 52.67973 -38.26807      63.37090 
1 1 1 -5  1  29 o 292.8251 82.85864 20.24568       9.846196      6.217061       13.39885      36.71471       14.51758  217.3569 91.97661 384.4258 97.18820 -167.0689      133.8105 
1 1 1 -5  1  30 o 265.1652 83.43768 17.28401       9.584738      17.28401       9.584738      0.000000       0.000000  265.1652 83.43768 ?        ?        0.000000       83.43768 
1 1 1 -5  1  31 o 133.8616 60.92956 -1.951170      6.957129      -13.79219      9.656232      10.83004       10.03227  123.6177 60.45197 215.6113 83.69804 -91.99358      103.2463 
1 1 1 -5  1  32 o 174.5711 73.67371 5.267290       8.559918      -5.426491      13.89790      11.80350       10.86542  165.1483 78.65476 213.3288 85.73692 -48.18045      116.3503 
1 1 1 -5  1  33 o 90.35411 45.76891 -23.33487      8.063966      -28.29832      9.909352      -13.60370      13.87510  98.82605 50.13308 143.0634 70.46214 -44.23740      86.47681 
1 1 1 -5  1  34 o 108.3517 52.65284 -7.307144      7.005721      -15.51772      9.993785      0.6261442      9.823578  114.1443 56.83883 149.3457 69.54582 -35.20142      89.81800 
1 1 1 -5  2  1  o 392.9197 18.09689 30.03131       2.761440      30.03131       2.761440      0.000000       0.000000  392.9197 18.09689 ?        ?        0.000000       18.09689 
1 1 1 -5  2  2  o 373.1957 13.39460 27.07030       1.941307      29.76928       2.788088      24.53043       2.704659  391.1915 18.35224 354.5098 19.72323 36.68173       26.94087 
1 1 1 -5  2  3  o 456.7516 12.92226 40.54589       2.292169      36.34216       3.138381      45.35213       3.355759  432.2149 18.69726 482.8668 17.89515 -50.65189      25.88096 
1 1 1 -5  2  4  o 388.5104 14.57965 29.34162       2.199772      29.76652       3.138293      28.93121       3.084306  390.5421 20.76640 385.0137 20.70386 5.528381       29.32393 
1 1 1 -5  2  5  o 255.0470 19.79515 12.73241       1.945321      11.91379       2.791516      13.50528       2.712388  245.3411 29.91790 261.8501 27.06341 -16.50899      40.34240 
1 1 1 -5  2  6  o 420.4470 15.34471 34.36722       2.505520      34.10128       3.676106      34.59793       3.423994  417.9015 22.73648 421.6381 20.91054 -3.736572      30.89009 
1 1 1 -5  2  7  o 476.6504 15.04678 44.16861       2.785296      43.42176       3.971849      44.89125       3.906959  472.3032 21.65429 480.2664 20.94733 -7.963287      30.12804 
1 1 1 -5  2  8  o 1222.966 13.78619 290.7281       6.547666      288.9700       9.245889      292.4967       9.273770  1218.612 19.53687 1226.034 19.47717 -7.421509      27.58713 
1 1 1 -5  2  9  o 774.6342 13.83676 116.6553       4.162548      116.7932       5.870180      116.5158       5.903423  774.6400 19.51298 773.7071 19.64714 0.9328613      27.69055 
1 1 1 -5  2  10 f 757.7560 14.41835 111.6561       4.242998      109.6769       5.985692      113.6550       6.015430  750.4542 20.53819 763.9712 20.27504 -13.51703      28.85991 
1 1 1 -5  2  11 o 208.3106 48.46972 8.919988       3.847391      8.859622       5.196371      8.993232       5.723863  208.2998 60.59203 210.8610 64.16407 -2.561188      88.25204 
1 1 1 -5  2  12 o 989.7457 17.01494 190.7433       6.540065      172.4162       10.50528      202.3413       8.357056  938.5711 28.82124 1018.629 21.12562 -80.05756      35.73452 
1 1 1 -5  2  13 o 239.6652 33.92627 11.51992       3.069477      15.76289       4.286082      7.052741       4.397868  279.4388 40.68996 186.0231 56.16215 93.41570       69.35315 
1 1 1 -5  2  14 o 879.9720 15.27427 150.8567       5.219842      154.8893       7.473340      147.0154       7.293876  890.1909 21.61740 867.2588 21.65617 22.93213       30.59905 
1 1 1 -5  2  15 o 479.4120 23.96668 45.03599       4.462156      47.56940       7.807784      43.80721       5.437666  486.6367 41.71708 470.7390 29.89944 15.89777       51.32535 
1 1 1 -5  2  16 o 189.8565 59.87287 7.401102       4.932758      2.470475       6.936226      12.44639       7.016412  163.8427 67.50564 240.4636 70.54040 -76.62086      97.63687 
1 1 1 -5  2  17 o 580.2448 22.49287 65.89490       5.068555      66.71774       6.265693      64.33695       8.621538  582.6757 27.68944 567.4979 39.36276 15.17786       48.12621 
1 1 1 -5  2  18 o 219.2027 47.79376 9.978319       3.953889      5.703552       5.407011      14.89126       5.796581  176.5671 62.75372 266.0777 57.75389 -89.51053      85.28506 
1 1 1 -5  2  19 o 370.7672 30.15103 27.16267       4.303811      20.98749       5.913046      34.11964       6.276190  320.7220 49.03131 413.4502 39.57148 -92.72821      63.00771 
1 1 1 -5  2  20 o 690.9966 20.00220 93.11517       5.367619      89.14478       7.438396      97.42886       7.753311  674.6346 28.39113 705.3029 28.30633 -30.66821      40.09120 
1 1 1 -5  2  21 o 892.5579 18.57693 155.2118       6.439295      149.4772       8.918182      161.4578       9.307356  874.4564 26.26093 908.7994 26.37122 -34.34296      37.21664 
1 1 1 -5  2  22 o 141.8196 55.86912 2.391750       4.524304      -1.964311      6.267553      7.131353       6.537655  134.6151 59.82258 197.1239 69.10341 -62.50888      91.40034 
1 1 1 -5  2  23 o 98.98412 46.76778 -5.266387      4.726653      -2.284168      6.644728      -8.321084      6.724988  137.3690 61.28492 114.7863 54.68130 22.58273       82.13335 
1 1 1 -5  2  24 o 135.2926 57.50546 0.3712112      5.275980      5.162245       7.457817      -4.428945      7.464914  187.3858 72.32514 136.9403 62.63272 50.44548       95.67541 
1 1 1 -5  2  25 o 678.6393 36.24187 91.23862       9.517078      0.000000       0.000000      91.23862       9.517078  ?        ?        678.6393 36.24187 0.000000       36.24187 
1 1 1 -5  2  26 o 125.2208 56.63317 -2.705680      5.893905      -1.083901      8.340137      -4.323655      8.330351  158.8717 69.87548 145.4279 66.37892 13.44385       96.37813 
1 1 1 -5  2  27 o 134.5802 59.63039 -1.403040      6.182821      -11.42622      8.543980      9.616040       8.958394  124.7590 60.01503 222.5995 80.57727 -97.84057      100.4714 
1 1 1 -5  2  28 o 240.4142 74.14069 12.67925       7.610857      15.55002       9.064880      5.821087       14.01094  263.1903 80.87191 223.7905 94.34084 39.39980       124.2596 
1 1 1 -5  2  29 f 292.4996 70.97742 19.39565       7.980680      28.98539       13.23137      13.91178       10.00565  340.9721 95.90145 246.8906 85.54866 94.08156       128.5133 
1 1 1 -5  2  30 o 288.0959 71.44203 19.43201       7.953909      23.58022       13.67297      17.31021       9.778769  295.5913 100.0754 264.5288 84.39391 31.06244       130.9099 
1 1 1 -5  2  31 o 227.4022 76.49724 12.73575       7.988635      0.4794362      13.35773      19.56040       9.967649  184.3792 84.11800 272.5674 84.97787 -88.18820      119.5704 
1 1 1 -5  2  32 o 245.4530 77.20488 16.07290       8.207153      47.27934       14.69425      1.924180       9.894271  402.3916 95.46948 165.8847 74.33845 236.5069       120.9985 
1 1 1 -5  2  33 o 167.2329 71.53009 5.383627       8.256857      11.69366       10.22362      -6.452117      14.00189  201.8961 82.42556 155.8294 75.41979 46.06673       111.7234 
1 1 1 -5  2  34 o 238.2740 73.83778 16.82213       7.538424      12.04903       10.90984      21.18321       10.42833  193.8285 82.54630 245.0259 87.14319 -51.19736      120.0326 
1 1 1 -5  3  1  o 690.2977 11.50574 92.59050       3.084458      94.57708       4.371649      90.62121       4.352578  697.4343 16.14039 682.6769 16.41736 14.75732       23.02264 
1 1 1 -5  3  2  o 371.1654 13.87478 26.77712       1.999962      25.51473       2.785435      28.12047       2.873360  361.5747 19.91336 379.6750 19.55363 -18.10034      27.90853 
1 1 1 -5  3  3  o 530.2617 12.47445 54.64173       2.568854      55.97254       3.681068      53.37836       3.586592  536.4653 17.66868 523.8878 17.62851 12.57751       24.95890 
1 1 1 -5  3  4  o 603.0956 12.45729 70.68291       2.917681      71.22293       4.152522      70.15636       4.100420  605.1525 17.66929 600.6091 17.57958 4.543335       24.92480 
1 1 1 -5  3  5  o 165.4475 29.72917 5.500363       1.839951      7.106455       2.666838      4.041317       2.541828  187.2995 37.96325 142.7892 42.60424 44.51028       57.06425 
1 1 1 -5  3  6  o 896.8964 12.77195 156.3312       4.448641      158.1911       6.342826      154.5305       6.241065  901.8353 18.11038 891.3464 18.02952 10.48889       25.55483 
1 1 1 -5  3  7  o 293.0391 20.79369 16.79630       2.351019      16.81686       3.270626      16.77431       3.381848  292.1882 29.21464 291.6556 30.29992 0.5325928      42.09015 
1 1 1 -5  3  8  o 130.3137 40.50483 3.308956       2.266551      1.489668       3.178344      5.191507       3.233132  117.9399 46.71075 161.3929 48.02588 -43.45303      66.99537 
1 1 1 -5  3  9  o 448.5743 17.10505 39.14492       2.979797      39.47920       4.272055      38.82819       4.158383  449.3780 24.57229 445.7021 24.11406 3.675842       34.42797 
1 1 1 -5  3  10 o 957.2864 14.01955 178.1951       5.211995      185.5170       7.478106      171.2786       7.268127  976.0801 19.72778 937.8450 19.95554 38.23511       28.06080 
1 1 1 -5  3  11 o 93.80146 43.82382 -3.753346      3.951782      -12.21974      5.571234      4.819829       5.606257  89.35033 44.12857 172.2354 63.52853 -82.88509      77.35118 
1 1 1 -5  3  12 o 511.6577 21.36914 51.06755       4.246143      58.82042       7.535158      47.46017       5.139932  545.7655 35.74906 491.8593 27.01189 53.90625       44.80667 
1 1 1 -5  3  13 o 495.6015 18.88456 47.90320       3.634691      42.62967       5.036069      53.63675       5.251132  465.4966 27.98789 523.4277 25.83261 -57.93115      38.08734 
1 1 1 -5  3  14 o 208.7876 41.29292 8.958523       3.229564      13.47926       4.552489      4.378507       4.582242  255.5366 47.62635 158.7299 57.60218 96.80675       74.74142 
1 1 1 -5  3  15 o 92.30520 42.89175 -3.098192      3.704689      0.3938956      6.160428      -5.076547      4.636822  144.1947 61.73365 97.71227 46.21417 46.48246       77.11546 
1 1 1 -5  3  16 o 314.0702 37.10137 19.83468       4.437873      22.20442       5.352005      14.61957       7.939596  330.8088 42.65276 259.0322 74.76698 71.77661       86.07764 
1 1 1 -5  3  17 o 493.9310 25.36488 47.96481       4.849082      48.54998       5.942289      46.79849       8.389264  495.4323 31.04129 481.4019 45.40979 14.03030       55.00555 
1 1 1 -5  3  18 f 301.5322 34.35635 18.16072       3.951342      21.06880       5.673052      15.42066       5.506742  321.5504 46.80295 272.0809 54.02113 49.46948       71.47586 
1 1 1 -5  3  19 o 296.2047 37.65067 17.58695       4.233180      11.62872       5.824513      24.25796       6.163064  235.1064 62.65724 345.9862 47.09142 -110.8799      78.38069 
1 1 1 -5  3  20 o 440.4674 28.17263 38.13951       4.793895      36.89820       6.678941      39.45855       6.884932  430.4166 40.43064 445.2672 40.25055 -14.85062      57.05036 
1 1 1 -5  3  21 o 848.1055 18.96878 140.1494       6.247660      145.2590       8.875707      135.1314       8.795883  862.0172 26.51301 831.2682 27.24647 30.74890       38.01723 
1 1 1 -5  3  22 o 267.7965 48.22327 14.63100       4.830767      21.39327       6.598091      6.818214       7.092100  323.4735 54.45782 197.8718 71.68391 125.6017       90.02354 
1 1 1 -5  3  23 o 254.6904 53.65428 13.40956       5.139418      9.195663       6.833117      18.89851       7.798689  215.4178 70.69729 299.5666 68.52207 -84.14879      98.45497 
1 1 1 -5  3  24 o 142.4032 58.44785 1.609138       5.175040      11.02212       7.240490      -8.221347      7.399318  231.1116 72.48684 122.6994 58.13427 108.4122       92.91897 
1 1 1 -5  3  25 o 484.8763 31.73186 46.46175       5.942270      51.04822       8.306128      41.65340       8.504668  504.8633 42.76588 453.4545 49.07734 51.40884       65.09612 
1 1 1 -5  3  26 o 546.5256 30.71819 58.99617       6.493358      59.93600       9.131822      58.03497       9.235039  546.3460 43.39637 537.0312 44.68608 9.314819       62.29037 
1 1 1 -5  3  27 o 150.3385 65.31763 -0.1957783     7.095919      -0.9988841     8.510461      1.635997       12.85295  159.9863 70.46903 203.7795 88.22124 -43.79323      112.9109 
1 1 1 -5  3  28 o 152.7121 66.89959 -0.4102967     7.578137      2.458949       9.049130      -7.147212      13.86607  178.9397 75.64614 179.7024 83.32221 -0.7626801     112.5386 
1 1 1 -5  3  29 o 366.4168 57.33844 28.81346       7.891715      55.52617       13.71612      15.59448       9.648753  497.7509 73.13730 258.0177 83.97723 239.7332       111.3609 
1 1 1 -5  3  30 o 132.5045 61.71260 -4.742957      7.739860      -30.83027      13.23532      8.814720       9.541410  125.7506 63.03751 207.9984 81.37871 -82.24777      102.9380 
1 1 1 -5  3  31 o 145.3223 65.23478 -0.5799069     7.653781      -31.19166      13.06975      15.39729       9.442205  121.8920 61.31246 243.8380 83.16048 -121.9460      103.3193 
1 1 1 -5  3  32 o 223.0364 73.35733 12.92591       7.355515      25.91694       10.56526      0.7067322      10.24659  302.7503 85.88815 162.8024 74.04120 139.9479       113.3970 
1 1 1 -5  3  33 o 147.6582 66.95633 1.020053       8.301066      5.815965       10.42996      -7.267468      13.71068  175.1397 77.53276 152.5298 74.01418 22.60991       107.1888 
1 1 1 -5  3  34 o 192.7129 80.44465 11.72760       10.03302      17.56603       16.37505      8.218500       12.69499  205.8114 93.60074 179.5857 81.95964 26.22571       124.4125 
1 1 1 -5  4  1  o 981.6601 12.03502 187.2528       4.588131      189.2178       6.526657      185.3330       6.451195  986.4462 17.03685 976.2691 17.01542 10.17712       24.07860 
1 1 1 -5  4  2  f 210.6274 20.91414 8.717764       1.688116      7.851320       2.367045      9.614598       2.408200  198.1329 31.84094 220.2082 28.85418 -22.07535      42.96986 
1 1 1 -5  4  3  o 346.9111 15.01097 23.39484       2.022344      19.70210       2.866964      27.05205       2.853138  317.2431 23.43622 372.3644 19.80114 -55.12134      30.68129 
1 1 1 -5  4  4  o 994.9891 12.40243 192.3831       4.792401      196.0987       6.873806      188.8686       6.685090  1004.160 17.62650 985.4887 17.46737 18.67157       24.81537 
1 1 1 -5  4  5  o 764.2968 12.60177 113.5192       3.740430      119.7420       5.455220      107.9981       5.138509  784.6460 17.90237 745.1853 17.75599 39.46069       25.21448 
1 1 1 -5  4  6  o 175.8496 31.35208 6.214653       2.062581      6.932940       2.954068      5.531384       2.881160  184.4846 42.15368 165.0969 44.10086 19.38768       61.00671 
1 1 1 -5  4  7  o 1062.564 13.25553 219.4458       5.469910      218.4234       7.695031      220.4901       7.776860  1059.580 18.70029 1064.569 18.81059 -4.988892      26.52431 
1 1 1 -5  4  8  o 1546.344 15.01900 464.9425       9.019346      467.2739       12.80245      462.6452       12.70863  1549.159 21.27989 1541.477 21.22920 7.681885       30.05848 
1 1 1 -5  4  9  o 468.9878 16.85014 42.79003       3.068973      39.98085       4.294242      45.72271       4.387630  452.1941 24.54503 484.3737 23.32499 -32.17953      33.86021 
1 1 1 -5  4  10 o 554.5223 18.71618 59.86788       4.030550      60.12811       4.913034      59.33225       7.048634  555.3705 22.77923 549.4935 33.18616 5.877075       40.25188 
1 1 1 -5  4  11 o 373.2100 30.44053 27.44486       4.373549      19.90930       5.874827      36.81330       6.550448  313.1246 49.99294 430.6856 39.60743 -117.5610      63.78121 
1 1 1 -5  4  12 o 548.5515 19.44573 58.66706       4.142568      57.71687       7.121593      59.15300       5.092842  540.7974 34.08334 550.2598 23.83222 -9.462341      41.58904 
1 1 1 -5  4  13 o 384.8752 23.19787 29.06643       3.451133      28.43122       4.836840      29.72518       4.925649  378.5589 33.23677 387.1740 33.07630 -8.615143      46.89056 
1 1 1 -5  4  14 o 212.1666 47.42942 9.368998       3.809810      1.032897       6.499197      13.73315       4.702491  151.6921 64.11668 257.5213 48.80684 -105.8292      80.57950 
1 1 1 -5  4  15 o 336.4764 32.84409 22.56744       4.237079      26.30527       7.665081      20.92274       5.084519  354.8633 57.59407 321.3119 41.73232 33.55136       71.12428 
1 1 1 -5  4  16 o 449.2506 25.18869 39.70958       4.376908      36.16906       5.310311      47.21081       7.729532  426.8777 32.27068 484.8175 41.45168 -57.93979      52.53226 
1 1 1 -5  4  17 o 247.6127 48.21478 12.70254       4.469644      10.21333       5.305861      18.78598       8.294681  219.7896 60.32931 294.0810 72.97453 -74.29144      94.68320 
1 1 1 -5  4  18 o 327.6823 33.68483 21.37446       4.225595      31.81353       6.001017      11.10839       5.951083  398.9247 39.24306 229.4666 64.23778 169.4581       75.27623 
1 1 1 -5  4  19 f 507.5816 24.20063 50.36540       4.770463      55.53161       6.664031      44.93546       6.832015  530.5946 32.49705 475.8737 37.26600 54.72095       49.44505 
1 1 1 -5  4  20 o 363.3469 32.68581 26.12049       4.562846      20.68280       6.232865      32.39983       6.697876  318.0923 52.27146 402.3427 43.56162 -84.25043      68.04352 
1 1 1 -5  4  21 o 811.7928 19.33383 128.4121       6.095244      133.9969       8.640340      122.8796       8.599757  827.9135 26.87311 792.6100 27.93822 35.30353       38.76477 
1 1 1 -5  4  22 o 631.3797 23.52390 77.80124       5.768035      73.25768       7.945231      82.86430       8.387166  610.1497 33.66088 649.1032 33.38462 -38.95355      47.40873 
1 1 1 -5  4  23 o 349.9220 38.60113 24.41044       5.158345      27.94760       7.037618      20.30396       7.582860  371.6557 50.03025 311.5999 64.77571 60.05582       81.84692 
1 1 1 -5  4  24 o 794.4036 21.75004 123.2311       6.710105      126.1672       9.331375      120.0873       9.655993  801.7960 29.96773 781.7155 31.80682 20.08044       43.70055 
1 1 1 -5  4  25 o 506.8237 31.43736 50.74092       6.157196      48.78613       8.401320      53.00923       9.050000  492.7923 44.37504 513.2540 45.88734 -20.46170      63.83411 
1 1 1 -5  4  26 o 333.8846 48.84788 22.84340       6.146533      21.58269       8.437695      24.26881       8.971903  316.2640 70.49805 335.5524 71.06077 -19.28845      100.0980 
1 1 1 -5  4  27 o 362.4737 53.43678 27.24815       7.296548      29.25639       8.805560      22.84792       13.03427  371.3477 63.33059 314.1226 97.05031 57.22519       115.8858 
1 1 1 -5  4  28 o 673.6604 28.55470 89.64454       7.470446      103.0390       10.55105      76.17999       10.57862  716.6196 38.04853 612.0282 44.81882 104.5914       58.79130 
1 1 1 -5  4  29 f 428.6663 42.20225 37.71180       6.934493      37.33473       9.955811      38.06712       9.664390  412.7075 64.20341 418.8944 61.21428 -6.186920      88.70889 
1 1 1 -5  4  30 o 182.1805 73.28175 5.631474       7.945317      -4.017149      13.74444      10.47399       9.737104  178.1991 82.74155 217.6794 82.98243 -39.48024      117.1847 
1 1 1 -5  4  31 o 235.5300 75.94202 13.91147       7.902255      34.45519       13.82013      3.931973       9.632225  346.0964 98.24715 177.4923 76.60677 168.6040       124.5837 
1 1 1 -5  4  32 o 410.2511 54.80611 38.39162       8.513546      53.20385       15.01040      31.36690       10.33704  429.8014 92.65644 343.2925 79.15491 86.50882       121.8635 
1 1 1 -5  4  33 o 250.3632 78.29667 18.40873       8.454555      12.88442       10.71509      27.52118       13.76176  205.6159 84.21399 267.9060 99.39059 -62.29010      130.2708 
1 1 1 -5  4  34 o 175.3601 72.00306 8.340908       7.857639      6.156748       10.48848      11.13494       11.86275  168.9322 76.05301 188.3562 83.06957 -19.42401      112.6260 
1 1 1 -5  5  1  o 1168.746 12.72326 265.4435       5.774929      269.0787       8.252737      261.9555       8.083845  1176.263 18.06614 1160.603 17.93521 15.66064       25.45697 
1 1 1 -5  5  2  o 716.6281 11.99268 99.78976       3.337630      95.77826       4.690040      103.9059       4.750789  701.8196 17.20771 731.0193 16.73435 -29.19965      24.00300 
1 1 1 -5  5  3  o 906.2043 12.19507 159.5752       4.291791      158.4396       6.025198      160.7448       6.114812  902.6514 17.18792 909.1840 17.31822 -6.532593      24.39970 
1 1 1 -5  5  4  o 888.1048 12.32454 153.2688       4.250726      154.8718       6.056032      151.7122       5.967808  892.3972 17.47439 883.2531 17.39809 9.144104       24.65862 
1 1 1 -5  5  5  f 1034.925 12.72251 208.1492       5.113397      210.0669       7.255404      206.2566       7.207702  1039.253 17.97680 1029.780 18.02288 9.472900       25.45564 
1 1 1 -5  5  6  o 1191.237 13.37961 275.8115       6.189702      280.7229       8.882380      271.1751       8.630187  1201.204 19.04077 1180.626 18.82261 20.57800       26.77390 
1 1 1 -5  5  7  o 620.7695 13.97312 74.91199       3.368617      81.12003       4.919721      69.43239       4.622085  645.6240 19.62153 597.2849 19.92638 48.33911       27.96542 
1 1 1 -5  5  8  o 696.7617 13.84575 94.38362       3.746525      93.29816       5.309830      95.45976       5.287018  692.3068 19.74940 700.3077 19.43989 -8.000977      27.71188 
1 1 1 -5  5  9  o 494.3802 23.78077 47.65007       4.565780      47.65007       4.565780      0.000000       0.000000  494.3802 23.78077 ?        ?        0.000000       23.78077 
1 1 1 -5  5  10 o 702.3352 17.14686 96.01221       4.676888      93.61297       5.688681      101.0160       8.215351  693.0743 21.13507 718.7341 29.43269 -25.65979      36.23499 
1 1 1 -5  5  11 o 723.4777 21.22223 102.0781       5.962716      112.6230       8.558499      92.13181       8.312010  758.4939 29.05478 685.6024 31.21805 72.89148       42.64677 
1 1 1 -5  5  12 o 403.0482 24.62139 31.88348       3.835391      29.37405       6.514707      33.21463       4.744826  382.0673 44.75423 410.3709 29.98001 -28.30365      53.86781 
1 1 1 -5  5  13 o 299.7629 28.95110 17.80743       3.328376      18.76041       4.688475      16.83921       4.725817  304.8973 40.60547 287.7450 43.66130 17.15228       59.62477 
1 1 1 -5  5  14 o 93.50301 43.48303 -3.241646      3.819733      -7.359246      6.792662      -1.337448      4.619277  117.6362 55.72518 115.7423 51.40019 1.893898       75.81078 
1 1 1 -5  5  15 o 461.1872 26.17409 41.88611       4.668567      37.59361       8.024563      44.08239       5.739974  429.3181 49.00805 471.7017 31.51529 -42.38364      58.26665 
1 1 1 -5  5  16 o 512.8427 24.99625 51.56973       4.978369      53.93580       6.044466      46.57960       8.778090  522.5684 29.90846 479.1570 47.81148 43.41135       56.39551 
1 1 1 -5  5  17 f 820.4423 19.40894 131.4087       6.184119      127.6974       7.511332      139.2170       10.89523  807.6459 23.94793 840.0713 33.39582 -32.42542      41.09482 
1 1 1 -5  5  18 o 522.7324 22.20751 53.38781       4.508242      49.67118       6.213900      57.51819       6.550656  501.5530 32.06996 540.0469 31.36899 -38.49390      44.86086 
1 1 1 -5  5  19 o 141.4222 54.21164 2.821704       4.170063      1.137279       5.680674      4.790114       6.140897  144.9052 60.51350 175.1261 66.10526 -30.22090      89.62025 
1 1 1 -5  5  20 o 153.3993 56.19143 3.873063       4.375233      6.577194       5.904051      0.5791547      6.516163  188.6252 65.69498 150.8187 63.99870 37.80647       91.71513 
1 1 1 -5  5  21 o 620.1827 22.57892 75.03437       5.438146      70.43699       7.341004      80.62556       8.095658  598.7224 31.68476 640.4428 32.65794 -41.72040      45.50237 
1 1 1 -5  5  22 o 453.3357 29.84332 40.40476       5.224682      44.88141       7.101593      35.12278       7.713968  475.9556 38.75694 418.1858 48.39264 57.76974       61.99958 
1 1 1 -5  5  23 o 471.6562 30.50358 43.78883       5.557407      43.14259       7.598280      44.53220       8.149346  465.1964 42.52871 471.9632 45.00714 -6.766785      61.92200 
1 1 1 -5  5  24 o 884.5131 20.95892 152.7363       7.199480      154.6989       9.984553      150.6107       10.39080  888.0178 28.95203 875.6983 30.55388 12.31946       42.09227 
1 1 1 -5  5  25 o 240.5229 75.46816 12.19556       7.847468      12.19556       7.847468      0.000000       0.000000  240.5229 75.46816 ?        ?        0.000000       75.46816 
1 1 1 -5  5  26 o 128.7834 57.31791 -1.662506      5.775200      -5.132564      8.096702      1.931392       8.239915  139.8602 64.43055 172.4145 72.49757 -32.55432      96.99068 
1 1 1 -5  5  27 o 382.4795 50.67807 30.14008       7.342227      27.54601       8.545988      37.45183       14.34770  359.7007 63.49928 402.5379 93.55843 -42.83722      113.0723 
1 1 1 -5  5  28 o 622.2905 42.43000 78.51089       10.19285      78.51089       10.19285      0.000000       0.000000  622.2905 42.43000 ?        ?        0.000000       42.43000 
1 1 1 -5  5  29 o 315.7108 76.22462 23.24455       9.239736      23.24455       9.239736      0.000000       0.000000  315.7108 76.22462 ?        ?        0.000000       76.22462 
1 1 1 -5  5  30 o 247.2613 85.00254 15.21949       9.868877      0.000000       0.000000      15.21949       9.868877  ?        ?        247.2613 85.00254 0.000000       85.00254 
1 1 1 -5  5  31 o 226.9854 83.78931 13.25079       9.756271      0.000000       0.000000      13.25079       9.756271  ?        ?        226.9854 83.78931 0.000000       83.78931 
1 1 1 -5  5  32 o 369.0110 51.88009 30.79837       7.229433      22.43694       10.47616      38.40047       9.989146  274.9707 87.31189 394.4914 67.63665 -119.5207      110.4449 
1 1 1 -5  5  33 o 116.2993 55.18359 -4.250823      6.715783      -1.290108      9.869098      -6.804172      9.165036  146.9593 68.85006 127.8088 61.65212 19.15044       92.41924 
1 1 1 -5  5  34 o 139.8215 63.40237 1.473352       7.443087      11.96317       9.701180      -13.53779      11.60506  192.9155 79.69479 125.9661 62.47691 66.94934       101.2651 
1 1 1 -5  6  1  o 740.2913 11.96164 106.4875       3.438913      111.5662       4.979926      101.8580       4.754610  757.4804 16.92869 723.7744 16.91545 33.70599       23.93143 
1 1 1 -5  6  2  o 285.4955 17.65888 15.91129       1.948288      18.69420       2.824777      13.38630       2.690701  308.9572 23.72391 260.7246 26.96347 48.23260       35.91452 
1 1 1 -5  6  3  o 1477.197 14.16368 424.1369       8.125360      421.5274       11.40174      426.8297       11.58238  1471.928 19.94604 1481.128 20.13618 -9.200684      28.34273 
1 1 1 -5  6  4  o 231.8248 22.29082 10.55808       1.982105      11.98333       2.799410      9.125242       2.806844  246.0724 29.90874 213.3638 35.09473 32.70859       46.11044 
1 1 1 -5  6  5  o 677.3463 12.98357 89.16879       3.415332      97.25573       5.012785      82.16244       4.665870  707.0823 18.25497 649.8888 18.48697 57.19348       25.98099 
1 1 1 -5  6  6  o 946.4926 12.92889 174.1207       4.752328      171.1746       6.642370      177.2102       6.802090  938.0049 18.23433 954.3868 18.35228 -16.38184      25.87078 
1 1 1 -5  6  7  o 311.6732 20.89342 18.99815       2.514294      20.29128       3.564871      17.71816       3.546697  321.1486 28.89240 299.6138 30.92616 21.53479       42.32255 
1 1 1 -5  6  8  o 1143.270 13.83092 254.1363       6.140841      254.0378       8.685336      254.2347       8.683586  1142.296 19.57853 1142.740 19.56697 -0.4443359     27.68005 
1 1 1 -5  6  9  o 740.3772 14.26766 106.6082       4.102359      110.9094       5.899441      102.5810       5.708493  754.5746 20.13171 725.6764 20.25585 28.89825       28.55845 
1 1 1 -5  6  10 o 319.1362 28.31371 20.07225       3.472701      17.45065       4.187686      25.84459       6.213946  295.6905 37.29747 358.7673 45.63174 -63.07678      58.93519 
1 1 1 -5  6  11 o 111.1252 46.27304 0.6091082      3.308047      6.957539       5.695977      -2.621999      4.063598  190.6120 64.59189 101.0704 46.22097 89.54161       79.42599 
1 1 1 -5  6  12 o 270.1839 34.03926 14.59882       3.492366      13.56024       5.753342      15.20478       4.394626  253.8603 59.41010 273.6435 42.75158 -19.78322      73.19329 
1 1 1 -5  6  13 o 81.77479 38.43749 -3.208656      3.119272      -7.254831      4.397598      0.8884043      4.425164  86.27815 41.87776 127.8422 53.40042 -41.56406      67.86274 
1 1 1 -5  6  14 o 539.4512 22.44987 56.95607       4.703206      51.65987       8.188279      59.56365       5.745517  507.2188 41.94537 550.7248 26.86374 -43.50601      49.81039 
1 1 1 -5  6  15 o 369.9178 26.16808 26.98963       3.735024      27.86963       5.102005      25.97338       5.482770  373.5157 35.60357 359.1555 39.98767 14.36017       53.54090 
1 1 1 -5  6  16 f 611.7318 22.32052 73.21031       5.302654      68.96020       6.325357      83.25952       9.726372  592.5692 27.48641 646.3738 38.92871 -53.80463      47.65445 
1 1 1 -5  6  17 o 142.6221 55.72319 2.668904       4.468913      0.1769430      5.412871      8.004179       7.920188  135.2176 57.87798 208.8439 75.73888 -73.62633      95.32176 
1 1 1 -5  6  18 o 683.8581 19.61318 91.22332       5.208852      91.13634       7.086987      91.32552       7.681770  682.2015 26.74983 682.4095 28.98600 -0.2080688     39.44289 
1 1 1 -5  6  19 o 1431.622 16.92141 399.1757       9.407904      395.6708       13.07096      402.9431       13.55162  1423.283 23.64768 1436.068 24.29900 -12.78503      33.90655 
1 1 1 -5  6  20 o 433.1302 29.12289 36.88497       4.870229      45.65926       6.777768      27.51828       7.002834  480.5058 36.59635 368.9061 50.18215 111.5997       62.10910 
1 1 1 -5  6  21 o 326.4742 40.18220 21.29872       4.987071      16.81751       6.727406      26.76550       7.430454  284.1054 62.65693 362.7753 54.41985 -78.66995      82.99043 
1 1 1 -5  6  22 o 492.6159 28.53211 47.63688       5.435091      51.65353       7.342509      42.76851       8.083580  511.1363 37.24590 462.7119 45.57643 48.42444       58.85973 
1 1 1 -5  6  23 o 220.0706 59.21430 10.09447       5.171858      8.743176       6.758530      12.00389       8.033927  210.8085 70.36431 241.3986 76.44004 -30.59004      103.8952 
1 1 1 -5  6  24 o 786.1184 32.31012 121.5874       9.864033      0.000000       0.000000      121.5874       9.864033  ?        ?        786.1184 32.31012 0.000000       32.31012 
1 1 1 -5  6  25 o 707.4779 34.80953 98.87140       9.563989      98.87140       9.563989      0.000000       0.000000  707.4779 34.80953 ?        ?        0.000000       34.80953 
1 1 1 -5  6  26 o 220.5085 92.25027 4.974667       13.23506      0.000000       0.000000      4.974667       13.23506  ?        ?        220.5085 92.25027 0.000000       92.25027 
1 1 1 -5  6  27 o 602.7838 35.30799 72.40736       8.229313      67.36505       9.804069      84.43185       15.13996  577.2369 44.06747 634.7119 62.22155 -57.47498      76.24607 
1 1 1 -5  6  28 o 132.3293 59.28231 -1.768102      6.286943      -0.9422736     8.708498      -2.667010      9.085649  159.3683 70.68391 155.6830 70.37121 3.685242       99.74128 
1 1 1 -5  6  29 o 275.8594 69.81209 17.48685       7.485414      38.26543       12.87401      6.874633       9.200448  397.9771 85.82089 198.0846 79.14715 199.8925       116.7454 
1 1 1 -5  6  30 o 469.8383 58.59295 48.77077       10.45872      0.000000       0.000000      48.77077       10.45872  ?        ?        469.8383 58.59295 0.000000       58.59295 
1 1 1 -5  6  31 o 356.0878 60.97026 29.29961       8.128246      23.48986       13.18532      32.86081       10.32309  277.9640 98.08048 362.2262 75.81717 -84.26224      123.9678 
1 1 1 -5  6  32 o 153.5716 65.10345 3.559844       6.732605      4.328910       9.294744      2.710927       9.765361  169.4249 74.15895 164.8574 73.86713 4.567520       104.6704 
1 1 1 -5  6  33 o 314.3035 58.22632 24.23152       6.845436      25.02802       9.961865      23.51893       9.422457  282.4407 84.35931 277.1606 81.87056 5.280121       117.5554 
1 1 1 -5  7  1  o 668.8812 12.81969 86.94653       3.330079      91.95386       4.055412      76.58084       5.834869  687.7588 15.18346 627.1039 23.95872 60.65485       28.36473 
1 1 1 -5  7  2  o 245.3844 20.76179 11.80112       1.959956      14.36006       2.767314      9.225537       2.776300  270.1456 26.72810 214.6769 34.46690 55.46869       43.61604 
1 1 1 -5  7  3  o 1199.408 13.22621 279.5970       6.160706      268.2155       8.364832      293.0895       9.107587  1174.243 18.34304 1227.392 19.10698 -53.14941      26.48667 
1 1 1 -5  7  4  o 1033.025 12.82477 207.4023       5.145035      205.8462       7.187685      209.0375       7.368023  1028.690 17.99188 1036.601 18.30253 -7.911011      25.66496 
1 1 1 -5  7  5  o 764.0490 12.90512 113.4651       3.829228      110.1913       5.353760      116.8939       5.479107  752.5754 18.31812 775.1356 18.20137 -22.56018      25.82331 
1 1 1 -5  7  6  o 1151.872 13.47040 257.9292       6.025774      251.0437       8.317491      265.5352       8.741797  1135.774 18.85699 1168.038 19.27151 -32.26392      26.96252 
1 1 1 -5  7  7  f 950.5275 13.38420 175.6541       4.940660      175.1742       6.978437      176.1364       6.995891  948.6471 18.94199 951.2494 18.93741 -2.602295      26.78478 
1 1 1 -5  7  8  o 524.9427 22.52092 53.71519       4.591198      53.71519       4.591198      0.000000       0.000000  524.9427 22.52092 ?        ?        0.000000       22.52092 
1 1 1 -5  7  9  o 327.3640 26.03040 21.06133       3.281999      23.84653       4.044802      15.69340       5.615292  347.7806 30.24899 276.2916 54.26939 71.48895       62.13026 
1 1 1 -5  7  10 o 227.6470 45.92110 10.62731       3.919718      12.89237       5.475370      8.246214       5.613860  248.7662 57.78077 202.5223 63.87340 46.24388       86.13030 
1 1 1 -5  7  11 o 295.4719 31.96569 17.35141       3.609521      16.28079       5.970616      17.96808       4.531335  279.5760 56.92553 298.8475 40.05106 -19.27145      69.60319 
1 1 1 -5  7  12 o 585.5136 20.00370 66.93688       4.548575      73.84592       7.755885      63.31475       5.615714  611.3242 32.78828 568.4884 25.43638 42.83575       41.49796 
1 1 1 -5  7  13 o 816.6488 18.40852 130.1674       5.838242      137.5940       10.45781      126.8049       7.036895  835.2044 32.24184 805.0101 22.50877 30.19434       39.32150 
1 1 1 -5  7  14 o 766.2217 19.45751 114.6818       5.789882      102.0778       9.815660      121.4072       7.170094  718.0605 35.19902 787.3114 23.45040 -69.25092      42.29530 
1 1 1 -5  7  15 o 324.2914 31.38534 20.91369       3.903222      19.22498       5.419133      22.73424       5.626696  306.3080 47.06133 334.4861 44.41412 -28.17813      64.70999 
1 1 1 -5  7  16 o 596.5707 22.43669 69.60093       5.198149      77.41660       6.562398      56.43830       8.516296  628.2008 26.89900 531.1213 41.62159 97.07947       49.55717 
1 1 1 -5  7  17 o 400.1551 31.11840 31.65402       4.797827      27.82248       5.941907      38.83216       8.132899  372.2694 41.82368 438.2830 48.60007 -66.01355      64.11854 
1 1 1 -5  7  18 o 247.6288 45.87225 12.54864       4.248970      13.38182       6.045010      11.73505       5.973529  252.3382 62.10568 236.4663 63.64357 15.87198       88.92480 
1 1 1 -5  7  19 o 207.4137 55.13591 8.911379       4.517530      2.387974       6.207348      16.25727       6.587051  158.8302 64.46157 278.8090 62.39330 -119.9787      89.71186 
1 1 1 -5  7  20 o 476.3355 26.68085 44.48177       4.915753      39.13664       6.676344      50.81051       7.264713  444.1951 39.10086 507.0295 37.15282 -62.83441      53.93708 
1 1 1 -5  7  21 o 82.30129 40.56969 -9.879053      4.632154      -7.466609      6.342425      -12.63690      6.781283  112.9804 53.61428 103.4830 50.61706 9.497383       73.73315 
1 1 1 -5  7  22 o 113.1517 51.74316 -3.243758      5.091655      -2.086222      7.134161      -4.445500      7.269111  143.8410 63.87818 135.1525 61.81164 8.688553       88.88814 
1 1 1 -5  7  23 o 487.8980 29.46579 46.84357       5.556900      54.67329       7.564036      37.66299       8.190592  525.2227 37.32666 431.7733 49.75667 93.44931       62.20134 
1 1 1 -5  7  24 o 751.6906 23.32436 110.5014       6.808897      113.7492       9.576807      107.1814       9.682532  760.1422 32.44128 737.4381 33.80924 22.70404       46.85617 
1 1 1 -5  7  25 o 119.8061 55.04189 -3.808300      5.854457      7.536523       8.063800      -16.45343      8.513389  205.6905 76.12648 113.2099 55.64833 92.48060       94.29729 
1 1 1 -5  7  26 o 516.4557 39.98234 53.43108       7.956683      60.31527       9.396666      35.98987       14.95669  546.8898 44.63232 393.7708 98.15253 153.1189       107.8238 
1 1 1 -5  7  27 o 308.1429 79.83359 21.45611       9.630807      0.000000       0.000000      21.45611       9.630807  ?        ?        308.1429 79.83359 0.000000       79.83359 
1 1 1 -5  7  28 o 159.6301 67.57511 1.832417       7.236952      -1.132982      12.19765      3.443346       8.990270  183.8158 82.44488 181.2322 75.94084 2.583527       112.0900 
1 1 1 -5  7  29 o 144.0972 64.82101 -1.568781      7.601613      21.42617       12.84030      -13.97672      9.432111  286.8254 96.98090 123.6479 60.31033 163.1775       114.2043 
1 1 1 -5  7  30 o 328.8242 79.20616 26.87758       9.994465      0.000000       0.000000      26.87758       9.994465  ?        ?        328.8242 79.20616 0.000000       79.20616 
1 1 1 -5  7  31 o 327.0054 65.24584 25.56475       7.995416      22.20271       13.17517      27.52469       10.05950  267.6002 97.58764 323.2888 80.44647 -55.68857      126.4713 
1 1 1 -5  7  32 o 132.3150 60.07348 -0.5096169     6.708764      -8.559414      9.353124      8.020458       9.628101  127.2303 61.59336 185.7995 78.25894 -58.56923      99.59019 
1 1 1 -5  7  33 o 218.5633 73.85949 14.00914       7.447545      10.91004       9.448202      19.09437       12.10284  192.3120 78.95826 227.0998 90.76387 -34.78775      120.3017 
1 1 1 -5  8  1  o 1674.313 15.25587 545.0363       9.919767      547.1576       11.62088      539.3397       19.04342  1677.175 17.84155 1662.641 29.49297 14.53381       34.46964 
1 1 1 -5  8  2  o 788.4395 12.58297 120.8149       3.852828      119.1970       5.370094      122.5312       5.530906  782.8052 17.66446 793.6559 17.94469 -10.85071      25.18025 
1 1 1 -5  8  3  o 256.7739 21.61315 12.92772       2.135203      11.31545       2.958211      14.68121       3.085047  238.4626 32.81256 272.6941 29.60683 -34.23148      44.19535 
1 1 1 -5  8  4  o 420.6645 15.60909 34.41228       2.550007      31.85975       3.521500      37.22623       3.697439  403.8138 22.54529 437.2196 21.77576 -33.40582      31.34444 
1 1 1 -5  8  5  o 232.5335 25.67075 10.67100       2.279557      11.26389       3.188860      10.05140       3.259876  237.2997 35.70916 223.2629 39.01764 14.03677       52.89159 
1 1 1 -5  8  6  o 499.7347 15.29468 48.57228       2.968301      50.79323       4.237829      46.43329       4.158907  510.6342 21.37005 488.1851 21.93647 22.44916       30.62495 
1 1 1 -5  8  7  o 747.4567 13.71102 108.6418       3.980006      110.0681       5.634772      107.2217       5.622407  751.8153 19.29911 742.0072 19.51130 9.808105       27.44351 
1 1 1 -5  8  8  o 448.5848 17.41542 39.17651       3.033936      38.59726       4.292881      39.75455       4.288390  443.9470 25.00123 450.6350 24.59725 -6.688080      35.07258 
1 1 1 -5  8  9  o 903.4003 19.77368 159.0893       6.937383      170.9774       10.17676      148.7692       9.481934  934.7222 28.03490 871.9138 28.00241 62.80847       39.62437 
1 1 1 -5  8  10 o 561.4028 19.71397 61.47495       4.298102      65.72353       7.413135      59.32349       5.275285  577.1867 33.21188 550.7945 24.66200 26.39221       41.36718 
1 1 1 -5  8  11 o 735.9302 17.91504 105.6127       5.120145      110.3092       8.874630      103.2695       6.268655  749.1050 30.50560 726.8941 22.20625 22.21088       37.73207 
1 1 1 -5  8  12 o 403.9919 23.09274 32.04156       3.608028      35.21945       5.090404      28.83323       5.114727  421.7477 31.30263 380.4095 35.01432 41.33823       46.96656 
1 1 1 -5  8  13 o 899.3176 18.23018 157.8541       6.366958      168.7378       11.54264      153.0943       7.633267  924.8219 32.13801 884.5549 22.22070 40.26703       39.07187 
1 1 1 -5  8  14 o 485.2257 21.89301 46.05560       4.125506      42.16251       5.736700      50.22551       5.937158  461.2267 32.22985 504.1082 30.47001 -42.88147      44.35296 
1 1 1 -5  8  15 o 275.3929 36.18031 15.24820       3.775841      23.18864       5.212791      6.483518       5.476666  339.3598 40.34370 183.7886 63.31421 155.5711       75.07532 
1 1 1 -5  8  16 o 333.4994 35.89689 22.20277       4.575984      17.61731       5.534901      32.10611       8.134092  292.5587 50.54350 395.7485 54.36090 -103.1898      74.22771 
1 1 1 -5  8  17 o 162.3812 57.03460 4.777372       4.454510      5.519180       5.362202      3.125462       8.001858  175.4396 62.47819 178.7752 72.94643 -3.335587      96.04533 
1 1 1 -5  8  18 o 592.4564 21.68122 68.49091       4.988478      64.04400       6.821382      73.60314       7.313886  570.6593 30.89499 611.8823 30.87852 -41.22302      43.68047 
1 1 1 -5  8  19 o 406.9076 29.31973 32.57581       4.602181      32.05770       6.241127      33.19329       6.813394  401.2455 40.61134 407.5736 43.72894 -6.328125      59.67831 
1 1 1 -5  8  20 o 517.8682 25.63010 52.37971       5.154632      52.99163       7.205408      51.73828       7.377126  518.2144 36.02712 511.7064 37.38127 6.507965       51.91640 
1 1 1 -5  8  21 o 602.4683 23.94067 70.84647       5.601425      55.64358       7.405868      91.16972       8.562675  530.9935 36.12841 681.9889 32.32989 -150.9954      48.48178 
1 1 1 -5  8  22 o 416.0119 34.46157 34.23479       5.517478      26.92163       7.306355      43.93961       8.416704  363.6300 53.32256 468.3085 46.90958 -104.6785      71.01974 
1 1 1 -5  8  23 o 514.3581 43.61092 52.88889       8.629371      0.000000       0.000000      52.88889       8.629371  ?        ?        514.3581 43.61092 0.000000       43.61092 
1 1 1 -5  8  24 o 299.4164 51.51555 18.48756       5.774182      20.01386       7.957182      16.78988       8.392012  305.9931 68.64978 278.5634 75.62896 27.42969       102.1398 
1 1 1 -5  8  25 o 288.1610 62.24799 17.62778       6.762503      14.78722       7.903992      25.38706       13.06336  261.3949 74.33350 333.7981 95.77595 -72.40323      121.2374 
1 1 1 -5  8  26 o 424.4967 61.41134 37.83694       9.829767      56.85485       13.11910      13.49359       14.84270  518.5740 66.68797 264.4238 102.0403 254.1502       121.8996 
1 1 1 -5  8  27 f 173.9991 73.73737 2.123932       8.631912      0.000000       0.000000      2.123932       8.631912  ?        ?        173.9991 73.73737 0.000000       73.73737 
1 1 1 -5  8  28 o 190.2148 69.54742 7.138026       6.697819      9.910446       9.449318      4.338652       9.495141  219.2461 82.15633 188.0004 78.34941 31.24567       113.5266 
1 1 1 -5  8  29 o 197.9449 75.32584 7.982738       8.014265      24.19850       13.20358      -1.476440      10.08439  300.0942 98.26381 163.5605 74.01626 136.5337       123.0211 
1 1 1 -5  8  30 f 238.5887 70.66529 13.81975       7.011991      -3.124495      9.629627      32.94467       10.23053  151.1358 69.85053 368.7821 74.00623 -217.6464      101.7645 
1 1 1 -5  8  31 o 216.9014 82.56326 12.52808       9.630029      41.96602       14.09321      -13.25559      13.18950  376.4053 96.08372 145.4237 71.01682 230.9816       119.4800 
1 1 1 -5  8  32 o 153.4713 64.53915 4.071673       6.531270      3.530905       9.023830      4.666634       9.465189  162.0885 71.91836 168.5004 74.26290 -6.411850      103.3791 
1 1 1 -5  8  33 o 135.2114 59.98849 1.641223       6.277227      6.909786       8.853625      -3.684166      8.901245  170.7472 73.57098 132.2830 62.98691 38.46426       96.85061 
1 1 1 -5  9  1  o 835.2407 12.91267 135.6026       4.188474      131.4917       4.871374      147.2593       8.202914  822.3153 15.25405 869.2649 24.29898 -46.94958      28.69018 
1 1 1 -5  9  2  o 315.2023 19.44283 19.41112       2.368381      20.52729       2.839730      16.86072       4.292567  323.8212 22.72497 290.7626 38.99737 33.05862       45.13556 
1 1 1 -5  9  3  o 519.0884 14.33292 52.39213       2.889375      51.73382       4.041361      53.08049       4.132551  515.4754 20.18793 522.1281 20.38042 -6.652649      28.68648 
1 1 1 -5  9  4  o 394.5612 16.91630 30.28903       2.592076      24.79771       3.573758      36.38453       3.765230  355.5856 26.06085 431.5305 22.54562 -75.94492      34.45973 
1 1 1 -5  9  5  o 406.3609 16.86369 32.13161       2.661292      32.03587       3.718367      32.23215       3.810599  404.6477 23.76608 405.8224 24.29012 -1.174622      33.98289 
1 1 1 -5  9  6  o 815.2861 13.49817 129.2566       4.273789      130.4662       6.003467      128.0136       6.085468  818.5203 18.88620 810.7354 19.32800 7.784973       27.02333 
1 1 1 -5  9  7  o 995.4457 13.65612 192.7333       5.279258      193.2442       7.494546      192.2301       7.437774  995.9246 19.37720 993.3244 19.28075 2.600220       27.33538 
1 1 1 -5  9  8  o 530.0182 18.96360 54.74678       3.903368      42.03001       6.305500      62.64776       4.970177  460.9984 35.49315 566.5449 22.58965 -105.5465      42.07204 
1 1 1 -5  9  9  o 933.3087 19.73397 169.8996       7.152663      163.1843       9.933765      177.1296       10.30736  912.6075 28.02863 950.8375 27.91343 -38.23004      39.55709 
1 1 1 -5  9  10 o 173.8586 46.80877 6.242190       3.230651      14.29630       5.788341      2.598078       3.893510  260.7915 58.58282 136.0832 52.33149 124.7083       78.55273 
1 1 1 -5  9  11 o 510.7743 21.24058 50.98655       4.213309      53.60907       7.242891      49.64520       5.179927  519.4128 36.13128 502.4028 26.64395 17.01001       44.89287 
1 1 1 -5  9  12 o 116.3516 48.40464 0.7787784      3.615085      -9.787587      6.767603      4.997641       4.276315  109.9113 53.00852 162.5771 55.95056 -52.66576      77.07378 
1 1 1 -5  9  13 o 134.9969 53.27066 2.251157       4.119686      4.418381       7.641058      1.363009       4.891524  182.0441 72.32249 136.6455 56.53101 45.39854       91.79486 
1 1 1 -5  9  14 o 852.6914 16.41768 141.7399       5.436654      138.4625       7.570217      145.2307       7.812696  841.1363 23.17469 861.3965 23.35446 -20.26019      32.90133 
1 1 1 -5  9  15 o 1023.315 16.08806 204.0440       6.393537      204.1161       8.972245      203.9695       9.113052  1021.772 22.61097 1021.292 22.97662 0.4804688      32.23633 
1 1 1 -5  9  16 o 171.8076 56.39053 5.764209       4.347322      -2.070230      5.368931      20.68074       7.408287  122.3186 54.79151 313.9946 62.94474 -191.6760      83.45148 
1 1 1 -5  9  17 o 954.7633 19.47484 177.7287       7.221006      186.7279       9.050960      161.9701       11.97712  977.6475 23.83880 907.6922 33.97705 69.95526       41.50576 
1 1 1 -5  9  18 o 407.8668 29.42321 32.73984       4.629250      30.64851       6.509254      34.88007       6.584898  391.4016 43.56241 418.4949 41.04465 -27.09326      59.85271 
1 1 1 -5  9  19 o 201.2160 56.34618 8.319542       4.577998      10.95976       6.285684      5.336865       6.680910  230.2646 66.54321 184.1152 69.06354 46.14946       95.90501 
1 1 1 -5  9  20 o 913.2847 18.76426 162.4612       6.655269      155.8451       9.048389      170.2590       9.823229  893.2136 26.08483 933.3868 27.09971 -40.17322      37.61399 
1 1 1 -5  9  21 o 496.0355 28.72719 48.30359       5.510243      59.94171       7.571072      35.19574       8.034917  551.2478 35.55532 417.9669 50.52639 133.2809       61.78267 
1 1 1 -5  9  22 o 517.0771 27.68809 52.49473       5.539839      46.72012       7.382740      59.93633       8.380871  484.8858 39.55030 549.5873 39.53076 -64.70148      55.91876 
1 1 1 -5  9  23 o 474.4621 33.15128 44.52220       6.070042      43.38374       8.269403      45.85227       8.938230  464.2856 46.48750 476.5217 48.99731 -12.23611      67.54127 
1 1 1 -5  9  24 o 165.9179 64.26186 3.961250       5.903544      6.376592       8.064406      1.172276       8.665732  198.1674 75.52515 172.8049 73.58005 25.36244       105.4423 
1 1 1 -5  9  25 o 183.3123 76.48016 2.769742       9.061707      3.393156       11.59426      1.791173       14.52616  204.0740 85.91328 215.9890 93.64734 -11.91498      127.0863 
1 1 1 -5  9  26 o 190.8751 66.23844 7.149961       5.999534      9.560050       8.205499      4.381572       8.794316  218.5434 77.34516 188.5484 76.65124 29.99500       108.8930 
1 1 1 -5  9  27 o 234.3626 67.80197 12.11264       6.522521      5.907974       8.823112      19.58960       9.685569  194.8531 77.61944 290.9833 82.12498 -96.13014      113.0013 
1 1 1 -5  9  28 o 491.3194 43.96359 49.77508       8.299854      68.44951       14.72661      41.08209       10.04763  553.7616 70.04448 434.4738 61.24809 119.2878       93.04600 
1 1 1 -5  9  29 o 116.9696 56.55274 -10.00439      7.821054      11.32266       13.51461      -20.74358      9.590118  229.3491 94.33020 111.4568 55.52970 117.8923       109.4611 
1 1 1 -5  9  30 o 430.4666 49.18479 40.17506       8.074784      41.96921       9.811032      36.40802       14.21626  429.1599 60.54873 353.2233 99.42756 75.93658       116.4130 
1 1 1 -5  9  31 o 362.3752 60.18547 31.00371       8.172754      35.28616       13.92276      28.75229       10.09503  330.3914 99.96780 325.5269 80.34180 4.864563       128.2512 
1 1 1 -5  9  32 f 224.3330 70.92713 13.87928       6.918938      11.13485       9.611178      16.83146       9.968303  197.3715 80.17317 229.5318 84.70174 -32.16022      116.6281 
1 1 1 -5  9  33 o 167.5815 66.29636 7.142929       6.395722      1.207902       9.060068      13.03842       9.029842  147.4893 68.02052 201.9241 79.12141 -54.43475      104.3407 
1 1 1 -5  10 1  o 870.3709 15.08533 147.3377       5.099024      143.9095       6.405734      153.2666       8.424180  859.7540 19.18521 886.5352 24.46829 -26.78113      31.09292 
1 1 1 -5  10 2  o 758.5840 13.63112 111.8916       4.015718      121.4092       4.924867      93.00954       6.936765  789.9802 16.05278 690.3987 25.87194 99.58148       30.44748 
1 1 1 -5  10 3  o 1399.657 14.68788 381.0282       7.983782      372.8098       9.144888      407.3681       16.37153  1384.091 17.01320 1443.721 29.19968 -59.63025      33.79453 
1 1 1 -5  10 4  o 344.9695 26.83458 23.38091       3.566749      0.000000       0.000000      23.38091       3.566749  ?        ?        344.9695 26.83458 0.000000       26.83458 
1 1 1 -5  10 5  f 1139.137 13.71971 252.3845       6.069444      253.0545       8.565907      251.7091       8.601182  1139.723 19.35290 1136.664 19.48490 3.059204       27.46263 
1 1 1 -5  10 6  o 738.3145 16.40190 106.1203       4.702877      103.7282       8.044841      107.3622       5.796474  728.0682 28.45230 742.1418 20.11171 -14.07367      34.84271 
1 1 1 -5  10 7  o 633.5004 17.41202 78.18003       4.283748      71.50822       7.220547      81.80378       5.321412  603.0033 30.93762 647.5175 21.16154 -44.51416      37.48263 
1 1 1 -5  10 8  o 853.2906 19.97139 142.0472       6.618098      143.4078       9.473065      140.7501       9.249737  855.2862 28.52010 847.4403 28.10556 7.845886       40.04147 
1 1 1 -5  10 9  o 505.1814 20.78264 49.83616       4.077332      50.58139       7.018832      49.45659       5.009221  504.8864 36.03335 501.8483 25.78931 3.038086       44.31129 
1 1 1 -5  10 10 o 554.3259 19.82967 59.99881       4.268827      60.07862       7.475484      59.96018       5.200054  550.3751 35.15815 553.3981 24.19592 -3.022949      42.67948 
1 1 1 -5  10 11 o 332.7513 25.91216 21.84202       3.322105      33.36204       5.028778      12.92134       4.425217  410.2453 31.81269 250.0668 47.29964 160.1784       57.00266 
1 1 1 -5  10 12 o 1096.188 17.49514 234.3992       7.447841      247.8245       13.47961      228.4996       8.935672  1121.704 30.94361 1081.121 21.28261 40.58325       37.55605 
1 1 1 -5  10 13 o 479.8689 21.96712 45.02612       4.093772      38.63611       5.787612      51.42433       5.791327  441.1330 34.04670 510.6396 29.32660 -69.50659      44.93581 
1 1 1 -5  10 14 o 286.4159 35.48883 16.43213       3.862916      13.00325       5.462053      19.86336       5.463925  248.6122 57.68692 312.2311 46.47804 -63.61891      74.08096 
1 1 1 -5  10 15 o 458.8394 28.39167 41.43399       5.034319      45.41634       6.292728      34.35320       8.390938  479.1062 34.04200 410.2852 53.97168 68.82104       63.81066 
1 1 1 -5  10 16 f 612.2727 24.39607 73.26443       5.800864      77.45583       7.255513      65.83826       9.657627  628.5635 29.72288 574.8275 43.58620 53.73602       52.75610 
1 1 1 -5  10 17 o 296.1133 46.81049 17.78938       5.204122      15.98585       6.380057      21.37505       8.995966  276.8317 60.99068 317.3380 74.30472 -40.50635      96.13040 
1 1 1 -5  10 18 o 801.5147 19.50434 125.1752       6.071146      120.6891       8.568452      129.6980       8.603448  785.5713 28.08593 814.5435 27.19758 -28.97223      39.09639 
1 1 1 -5  10 19 o 877.3754 19.35867 149.9577       6.596125      153.5036       9.242002      146.2762       9.417122  886.3718 26.84863 865.0130 28.03287 21.35883       38.81611 
1 1 1 -5  10 20 o 995.6496 18.44956 193.0731       7.133794      193.1944       9.818590      192.9376       10.38242  994.6169 25.41940 993.6144 26.90623 1.002502       37.01474 
1 1 1 -5  10 21 f 747.4818 22.05757 109.0163       6.403039      109.0566       8.810862      108.9712       9.321203  746.0065 30.41220 745.3031 32.20409 0.7033691      44.29453 
1 1 1 -5  10 22 o 412.2856 36.07563 33.74793       5.718034      31.00146       7.529991      37.48878       8.788033  390.7830 50.81966 429.1974 53.91349 -38.41443      74.08982 
1 1 1 -5  10 23 o 170.5354 66.72414 3.981884       6.414616      6.199861       10.00344      2.432980       8.359553  209.5164 82.90406 177.1393 73.64307 32.37704       110.8891 
1 1 1 -5  10 24 o 553.1072 36.86001 60.81709       7.872241      55.67980       9.226885      74.56168       15.09225  525.8644 45.63316 598.2233 66.06480 -72.35889      80.29285 
1 1 1 -5  10 25 o 564.8605 36.57486 63.54811       7.980201      62.32320       9.074065      67.72964       16.76554  557.0435 42.26036 558.7653 79.50314 -1.721802      90.03714 
1 1 1 -5  10 26 o 304.1690 57.31126 19.62822       6.521570      13.66022       8.878260      26.62205       9.611050  249.2776 80.50793 347.1765 73.57011 -97.89896      109.0600 
1 1 1 -5  10 27 o 392.9955 46.56005 31.95266       6.967890      33.32991       9.668588      30.46440       10.05069  390.0215 66.20007 368.2205 72.86427 21.80099       98.44618 
1 1 1 -5  10 28 o 277.5345 82.15617 18.72496       9.479733      31.94541       14.16481      8.000128       12.75801  347.5149 99.73789 217.1842 90.69131 130.3307       134.8056 
1 1 1 -5  10 29 o 546.0893 34.84292 60.80624       7.350811      60.81608       9.804745      60.79361       11.10805  535.2690 47.66557 527.9424 54.98481 7.326660       72.76907 
1 1 1 -5  10 30 o 158.2362 65.68494 3.774561       6.636077      7.651777       9.416986      -0.5014477E-01 9.353000  192.0162 78.83121 157.3880 71.24700 34.62827       106.2567 
1 1 1 -5  10 31 o 148.6437 66.36077 1.337184       7.805450      4.950726       13.71794      -0.3928231     9.491750  185.6157 84.89898 151.9739 69.91813 33.64185       109.9836 
1 1 1 -5  10 32 o 102.4837 49.92801 -7.860307      6.409895      -4.015380      9.231814      -11.43930      8.906837  134.9475 64.22541 115.2605 56.70772 19.68697       85.67770 
1 1 1 -5  11 1  f 838.8071 15.51733 136.9077       5.054837      132.4677       6.328165      144.7349       8.402073  824.5593 19.76186 860.9976 25.12792 -36.43829      31.96785 
1 1 1 -5  11 2  o 716.7502 16.21386 99.98814       4.513175      99.91448       5.757731      100.1055       7.268115  715.9589 20.70787 715.8351 26.14453 0.1237183      33.35194 
1 1 1 -5  11 3  o 581.0285 18.02624 65.75120       4.067529      62.84907       5.103004      70.80762       6.735804  567.5057 23.15409 601.5451 28.83323 -34.03943      36.97927 
1 1 1 -5  11 4  o 734.2145 15.98892 104.9402       4.559005      111.5065       7.817585      101.5563       5.612133  755.1415 26.65731 721.7620 20.02193 33.37952       33.33901 
1 1 1 -5  11 5  o 122.0358 44.75733 2.392856       2.777016      8.327414       4.861909      -0.4807628     3.383197  201.2546 58.62886 103.6609 45.06955 97.59374       73.95004 
1 1 1 -5  11 6  o 649.0724 17.36280 82.08662       4.376642      83.87332       7.445110      81.14314       5.410163  654.0324 29.31189 644.7269 21.60760 9.305542       36.41532 
1 1 1 -5  11 7  o 593.2343 31.66966 69.37315       7.269833      69.37315       7.269833      0.000000       0.000000  593.2343 31.66966 ?        ?        0.000000       31.66966 
1 1 1 -5  11 8  o 614.1580 22.24703 73.72500       5.306158      76.36755       7.566576      71.16805       7.443030  622.2842 31.41145 600.4874 32.03240 21.79681       44.86373 
1 1 1 -5  11 9  o 355.0515 26.58957 24.85693       3.639699      24.78107       6.251968      24.89582       4.476500  348.8785 47.36874 353.9023 32.94933 -5.023712      57.70144 
1 1 1 -5  11 10 o 281.5257 29.72631 15.75458       3.200882      19.71919       4.698123      12.31998       4.372824  312.8106 39.55784 243.9545 47.86530 68.85617       62.09597 
1 1 1 -5  11 11 o 220.7059 45.91962 10.08585       3.807720      13.98092       6.903660      8.382877       4.564839  255.2354 68.30319 200.2286 56.33415 55.00679       88.53735 
1 1 1 -5  11 12 o 501.8210 24.26001 49.30531       4.727893      52.42619       8.654131      47.97756       5.644714  510.9122 44.04678 493.1716 29.60954 17.74063       53.07395 
1 1 1 -5  11 13 o 212.9795 45.08096 9.366549       3.612488      10.91263       5.169833      7.891348       5.049934  227.7406 58.22724 196.2361 60.37189 31.50455       83.87595 
1 1 1 -5  11 14 o 496.5829 22.18180 48.16792       4.277762      49.99727       6.153689      46.45723       5.950751  503.4325 31.63591 485.1834 31.75709 18.24908       44.82570 
1 1 1 -5  11 15 o 134.7453 54.42561 1.734367       4.402235      5.392514       5.402628      -5.493257      7.594029  174.8333 62.66520 134.4554 62.10220 40.37791       88.22478 
1 1 1 -5  11 16 o 251.3070 50.59398 12.99605       4.766915      12.48779       6.011614      13.85691       7.823780  244.2979 62.96675 256.9194 74.23778 -12.62144      97.34505 
1 1 1 -5  11 17 o 480.3632 26.69157 45.23362       4.959711      47.16532       6.872142      43.13364       7.165215  488.5809 36.48140 466.2960 39.95344 22.28494       54.10333 
1 1 1 -5  11 18 o 356.6931 35.59487 25.21202       4.864870      26.91942       6.672238      23.27411       7.108384  365.7766 48.14021 337.5280 56.20579 28.24863       74.00385 
1 1 1 -5  11 19 o 343.8699 39.83497 23.57059       5.221179      18.85203       7.335716      28.41511       7.432968  300.8688 64.70422 374.7576 52.51406 -73.88885      83.33285 
1 1 1 -5  11 20 o 1021.276 26.31196 203.8291       10.43576      203.8291       10.43576      0.000000       0.000000  1021.276 26.31196 ?        ?        0.000000       26.31196 
1 1 1 -5  11 21 o 578.0586 38.67692 66.21005       8.632541      0.000000       0.000000      66.21005       8.632541  ?        ?        578.0586 38.67692 0.000000       38.67692 
1 1 1 -5  11 22 o 778.0599 26.66357 118.5820       8.056739      119.3897       13.04875      118.0843       10.24219  773.9565 43.59092 774.3005 34.06084 -0.3439941     55.32006 
1 1 1 -5  11 23 o 556.6060 41.27356 61.87035       8.858146      61.87035       8.858146      0.000000       0.000000  556.6060 41.27356 ?        ?        0.000000       41.27356 
1 1 1 -5  11 24 o 498.5947 40.23190 49.73920       7.723825      35.66393       8.628812      106.4794       17.32480  416.2514 54.70338 717.3181 62.82436 -301.0667      83.30283 
1 1 1 -5  11 25 o 504.2038 34.40705 50.59895       6.696995      54.17068       9.393606      46.90707       9.550302  516.2790 47.37973 477.8138 52.32249 38.46524       70.58669 
1 1 1 -5  11 26 o 180.1051 68.03815 5.657190       6.508502      5.606072       8.866097      5.716929       9.584666  193.9411 77.62331 198.7354 80.29499 -4.794250      111.6811 
1 1 1 -5  11 27 o 208.1310 80.64925 8.237871       9.301755      24.12816       13.99262      -4.344355      12.45122  306.4977 101.1960 173.9059 80.03480 132.5918       129.0201 
1 1 1 -5  11 28 o 556.0439 40.85159 63.67540       8.759810      77.26394       15.43797      57.22287       10.63822  583.1358 69.54153 516.3503 53.84333 66.78552       87.94958 
1 1 1 -5  11 29 o 215.2058 68.70566 11.02073       6.480217      7.722658       9.168262      14.31327       9.160563  195.4783 78.68839 237.1661 81.87455 -41.68787      113.5575 
1 1 1 -5  11 30 o 273.4370 64.54011 18.15488       6.743348      19.75989       9.766386      16.69256       9.322184  265.1918 84.31244 245.3445 82.63530 19.84732       118.0558 
1 1 1 -5  11 31 o 236.3094 74.06090 15.47341       7.559965      0.7366002      13.18705      22.68786       9.226730  169.6052 79.50007 280.3015 80.51120 -110.6963      113.1473 
1 1 1 -5  11 32 o 225.6295 74.18002 14.99371       7.521703      17.12886       13.56032      14.04482       9.039851  213.4666 91.49606 210.8389 80.05589 2.627670       121.5750 
1 1 1 -5  12 1  o 684.7921 14.70703 91.26475       3.911215      83.76218       5.331322      100.0090       5.755598  655.2759 20.94994 716.0504 20.69755 -60.77448      29.44976 
1 1 1 -5  12 2  o 1209.714 14.11653 284.7701       6.631908      286.5582       7.803669      280.1206       12.58348  1213.016 16.56549 1196.368 27.08370 16.64819       31.74811 
1 1 1 -5  12 3  o 344.5946 25.87346 23.35753       3.437232      22.70507       4.406435      24.37153       5.493251  338.1365 34.01748 348.6630 41.37670 -10.52643      53.56510 
1 1 1 -5  12 4  o 223.1876 38.56918 10.10682       3.222101      10.31141       4.164463      9.801669       5.085902  223.1367 49.36530 216.6855 58.89563 6.451218       76.84808 
1 1 1 -5  12 5  o 1444.859 17.20439 406.8441       9.653676      397.7079       16.16883      411.9051       12.03399  1423.671 29.24428 1452.401 21.33512 -28.72986      36.19966 
1 1 1 -5  12 6  o 689.2637 17.38719 92.61156       4.654175      88.51451       7.763288      94.91029       5.815054  671.3205 29.77747 697.0507 21.48134 -25.73016      36.71711 
1 1 1 -5  12 7  o 495.8422 20.78348 48.02039       4.002118      48.76324       5.060428      46.77982       6.539514  498.1268 26.25158 485.6347 34.90717 12.49207       43.67672 
1 1 1 -5  12 8  o 530.8946 17.82659 54.97325       3.675400      56.51013       5.229274      53.47282       5.166888  537.0973 25.07035 522.3907 25.46863 14.70660       35.73757 
1 1 1 -5  12 9  o 669.9657 15.97583 87.47443       4.156656      92.93958       6.020549      82.49660       5.745865  689.3513 22.48886 649.4076 22.78296 39.94373       32.01269 
1 1 1 -5  12 10 o 791.3289 15.64085 122.0145       4.806682      125.2369       6.954433      119.0672       6.651060  800.2678 22.37682 780.4113 21.94519 19.85657       31.34188 
1 1 1 -5  12 11 o 741.0962 18.70505 107.1561       5.383460      114.0531       9.692028      104.0788       6.474019  760.8295 32.80193 729.5236 22.85108 31.30597       39.97672 
1 1 1 -5  12 12 o 98.60756 44.12048 -1.388585      3.470846      -6.211725      5.142504      2.646760       4.703814  100.9261 48.00520 145.0060 57.01689 -44.07993      74.53473 
1 1 1 -5  12 13 o 484.4889 22.11223 45.84143       4.160490      47.15594       5.883225      44.52638       5.884416  489.0581 31.13815 474.9460 32.09125 14.11215       44.71502 
1 1 1 -5  12 14 o 545.0687 21.09501 57.96452       4.465384      53.44789       6.322296      62.46037       6.307744  520.9908 31.39425 563.9233 28.89931 -42.93256      42.67047 
1 1 1 -5  12 15 o 567.1464 24.75014 62.83284       5.451310      57.81812       6.682925      72.80435       9.423748  542.0693 31.88605 606.2573 40.25453 -64.18805      51.35316 
1 1 1 -5  12 16 o 147.4958 57.92360 2.661949       4.848935      5.704036       6.009355      -3.014643      8.208917  182.2318 65.99042 151.4438 67.80035 30.78799       94.61301 
1 1 1 -5  12 17 o 240.1937 51.11313 11.86500       4.621420      15.14121       6.325469      8.113969       6.768334  269.8171 61.70730 206.7683 70.40839 63.04883       93.62229 
1 1 1 -5  12 18 o 268.5932 49.30309 14.71742       4.953251      20.43991       6.966110      8.865485       7.044457  315.1391 59.09023 214.2514 71.83570 100.8877       93.01625 
1 1 1 -5  12 19 o 379.8649 37.01305 28.61738       5.390880      35.05331       7.361566      21.17488       7.916339  418.5867 46.04657 318.7024 66.12712 99.88428       80.57967 
1 1 1 -5  12 20 o 527.0528 31.49375 54.66806       6.416748      64.15182       10.05868      48.16015       8.332432  566.9844 46.08033 491.3437 44.13839 75.64075       63.80905 
1 1 1 -5  12 21 o 691.2546 24.24960 93.41869       6.509843      91.85248       8.874625      95.24307       9.578198  683.3460 33.44116 694.3717 35.63932 -11.02570      48.87200 
1 1 1 -5  12 22 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -5  12 23 o 496.7761 39.04760 49.23473       7.472550      44.39516       8.342897      68.86697       16.80346  468.9784 46.41690 567.4915 78.33324 -98.51309      91.05287 
1 1 1 -5  12 24 o 1132.547 49.84483 258.9581       21.92321      0.000000       0.000000      258.9581       21.92321  ?        ?        1132.547 49.84483 0.000000       49.84483 
1 1 1 -5  12 25 o 386.6069 47.37057 30.65437       6.963439      30.55096       8.733452      30.83485       11.53758  379.4244 61.36461 369.4137 82.50533 10.01077       102.8239 
1 1 1 -5  12 26 o 315.3995 61.77974 21.63329       7.296485      22.30456       9.173615      20.47735       12.03813  312.3665 76.28150 291.3740 93.70898 20.99246       120.8315 
1 1 1 -5  12 27 o 372.8307 58.97068 30.26773       8.254367      35.75737       14.28343      27.51509       10.11430  372.5529 97.56615 341.7729 77.93172 30.78009       124.8700 
1 1 1 -5  12 28 o 180.6852 69.03481 6.426759       6.748450      8.625275       9.476609      4.164817       9.612337  204.5565 80.77071 181.9817 77.49128 22.57480       111.9321 
1 1 1 -5  12 29 o 383.3091 46.32061 31.62313       6.755418      35.31749       9.436679      27.73982       9.674985  388.4546 64.83892 331.8771 76.61794 56.57745       100.3713 
1 1 1 -5  12 30 o 181.9594 68.10830 7.844458       6.490562      15.75531       9.092639      -0.3743873     9.267953  235.7454 81.55982 151.9796 69.61272 83.76578       107.2284 
1 1 1 -5  12 31 o 314.6917 63.37379 24.91603       7.477151      36.50878       13.38228      19.65432       9.015720  324.2387 97.98627 255.2448 80.99232 68.99394       127.1262 
1 1 1 -5  13 1  o 652.7808 21.70991 83.21320       5.503681      0.000000       0.000000      83.21320       5.503681  ?        ?        652.7808 21.70991 0.000000       21.70991 
1 1 1 -5  13 2  o 467.4153 20.14979 42.63466       3.657643      45.51359       4.718126      38.29849       5.790375  481.5995 25.31524 439.6999 34.17815 41.89966       42.53242 
1 1 1 -5  13 3  o 413.7406 19.43855 33.39755       3.123346      35.78335       3.719279      27.68993       5.752665  427.3414 22.48987 371.7486 40.50203 55.59280       46.32719 
1 1 1 -5  13 4  o 597.0413 16.18970 69.45078       3.753801      68.84122       4.395252      71.09399       7.216387  594.0293 19.05232 600.5795 31.04621 -6.550232      36.42606 
1 1 1 -5  13 5  o 703.7643 16.95512 96.54039       4.633999      99.80279       5.651894      89.84918       8.094269  714.9562 20.35572 675.9753 30.83321 38.98090       36.94648 
1 1 1 -5  13 6  f 390.7325 23.32567 29.96854       3.523349      29.63363       4.252707      30.70160       6.291745  387.5190 28.45722 390.8540 42.11550 -3.334991      50.82843 
1 1 1 -5  13 7  o 692.1783 17.69639 93.43295       4.756973      103.1813       5.962734      76.36624       7.889583  726.7296 21.12733 621.7139 32.79249 105.0157       39.00912 
1 1 1 -5  13 8  o 404.7436 21.19462 32.09153       3.319866      29.82608       4.623748      34.50220       4.769651  388.2000 30.92633 418.0177 29.57166 -29.81769      42.78926 
1 1 1 -5  13 9  o 653.9091 16.43643 83.33102       4.174004      88.03851       5.908968      78.64272       5.896915  671.0302 22.67470 633.9609 23.95159 37.06927       32.98213 
1 1 1 -5  13 10 o 426.5525 25.43447 35.74923       4.194151      34.09508       7.374974      36.53995       5.098995  410.7318 47.08584 430.1173 30.72828 -19.38547      56.22547 
1 1 1 -5  13 11 o 202.6418 49.82285 8.528713       3.893411      3.516541       7.663835      10.27229       4.520164  178.1192 71.85786 221.9700 53.14151 -43.85081      89.37322 
1 1 1 -5  13 12 o 325.4787 29.20709 20.92927       3.652517      23.59131       5.288017      18.50051       5.051009  343.1819 40.45449 302.3672 44.33115 40.81476       60.01513 
1 1 1 -5  13 13 o 610.9982 19.82057 72.78273       4.703098      77.60600       6.880038      68.55180       6.443748  629.6343 28.13679 591.7829 28.03807 37.85138       39.72168 
1 1 1 -5  13 14 o 1125.433 18.99041 246.7899       8.300074      242.2426       10.07290      256.4076       14.64918  1114.057 23.28194 1143.208 32.99592 -29.15039      40.38291 
1 1 1 -5  13 15 o 755.9856 22.09566 111.4561       6.487069      112.1016       8.007914      110.2238       11.06411  757.3249 27.22759 747.6449 38.23389 9.679993       46.93796 
1 1 1 -5  13 16 o 699.4886 23.42859 95.44208       6.364359      100.8553       7.907149      85.48371       10.72473  718.2941 28.34586 657.3416 42.23498 60.95258       50.86532 
1 1 1 -5  13 17 o 831.5400 19.50798 134.6840       6.299752      136.0040       8.923302      133.3723       8.895155  834.3185 27.54011 826.1729 27.72392 8.145569       39.07779 
1 1 1 -5  13 18 o 409.2156 33.64075 33.04611       5.298872      28.78498       7.450596      37.40739       7.537637  377.3162 52.24825 432.8329 45.52456 -55.51666      69.29910 
1 1 1 -5  13 19 o 858.7188 36.89746 145.0541       12.30482      145.0541       12.30482      0.000000       0.000000  858.7188 36.89746 ?        ?        0.000000       36.89746 
1 1 1 -5  13 20 o 293.3380 50.97523 17.63900       5.596294      26.94294       7.599243      6.614193       8.272227  362.5663 55.75628 202.6857 76.67208 159.8806       94.80174 
1 1 1 -5  13 21 f 490.0388 32.66329 47.44762       6.180492      46.20303       8.422675      48.89959       9.097331  479.5831 45.77884 492.6360 48.16728 -13.05292      66.45140 
1 1 1 -5  13 22 o 441.8457 36.97834 38.86337       6.286870      40.70200       8.457115      36.59225       9.399286  448.0496 49.42620 420.7546 59.15648 27.29495       77.08721 
1 1 1 -5  13 23 o 585.4934 36.17829 68.11056       8.185871      75.18614       9.407042      46.04181       16.61349  613.8784 39.67091 449.2328 97.98573 164.6456       105.7118 
1 1 1 -5  13 24 o 674.6346 29.95853 89.76009       7.849049      92.01970       9.732651      85.55654       13.27465  679.3842 37.02793 646.0396 53.38817 33.34467       64.97202 
1 1 1 -5  13 25 o 116.9358 55.12140 -6.202061      6.497082      -12.11195      8.687156      1.299719       9.787462  123.3128 59.61529 178.4632 77.12330 -55.15032      97.47813 
1 1 1 -5  13 26 o 250.0830 76.95122 14.42530       8.204002      16.65071       14.20713      13.31198       10.04873  265.7066 100.4875 242.1362 85.60360 23.57037       132.0065 
1 1 1 -5  13 27 o 314.3952 67.67494 22.65872       8.018259      -8.587638      13.48660      39.74184       9.972095  166.0941 78.63390 423.2027 62.56070 -257.1086      100.4845 
1 1 1 -5  13 28 o 281.1332 62.44480 18.24982       6.640342      24.20656       9.238161      11.88229       9.551395  312.8409 76.64228 221.6630 82.68974 91.17795       112.7459 
1 1 1 -5  13 29 o 238.1174 68.76899 14.15471       6.715120      14.53137       9.713806      13.80995       9.293368  230.9200 83.85726 226.9229 82.08102 3.997070       117.3428 
1 1 1 -5  13 30 o 172.8947 66.97199 6.911871       6.412580      4.655303       9.625971      8.712338       8.598308  170.7611 75.08767 187.9154 76.00642 -17.15428      106.8416 
1 1 1 -5  13 31 o 168.3801 68.90386 6.669604       7.165486      11.68555       12.81764      4.389433       8.642015  196.3782 86.49114 160.9396 70.94389 35.43858       111.8649 
1 1 1 -5  14 1  o 732.6526 21.01038 104.8069       5.978057      104.8069       5.978057      0.000000       0.000000  732.6526 21.01038 ?        ?        0.000000       21.01038 
1 1 1 -5  14 2  o 392.2724 21.59056 30.14603       3.276456      34.60169       4.576728      25.46177       4.692663  419.0816 28.28641 357.9092 34.17664 61.17239       44.36399 
1 1 1 -5  14 3  o 522.1970 17.32862 53.15498       3.514199      52.48579       4.118327      54.94726       6.739825  518.5069 20.45212 527.2543 33.08314 -8.747437      38.89451 
1 1 1 -5  14 4  o 782.0953 15.43173 119.1411       4.687079      118.8614       5.484456      119.8988       9.026320  780.7256 18.08869 781.3055 29.74828 -0.5799561     34.81610 
1 1 1 -5  14 5  o 170.8644 45.00425 6.027709       3.027766      5.534506       3.564182      7.306370       5.738849  165.5600 50.68340 193.0656 64.83738 -27.50558      82.29637 
1 1 1 -5  14 6  o 498.0081 20.65955 48.42691       3.995631      49.47985       4.860120      46.23113       7.018428  502.7636 24.89174 482.0662 37.79184 20.69748       45.25286 
1 1 1 -5  14 7  o 506.8165 18.59429 50.09862       3.659809      57.96449       5.081280      41.61932       5.275696  544.3459 24.03644 459.4352 29.72769 84.91068       38.22939 
1 1 1 -5  14 8  o 383.5219 23.02453 28.85218       3.413451      25.59863       4.767883      32.27327       4.889096  358.8068 34.64760 404.0201 31.40684 -45.21323      46.76372 
1 1 1 -5  14 9  f 757.4011 15.81966 111.7241       4.653193      114.0141       6.541396      109.3783       6.620535  764.0518 22.04548 748.2100 22.78461 15.84174       31.70397 
1 1 1 -5  14 10 o 767.6013 19.23820 114.8897       5.734930      117.4872       10.16097      113.6755       6.947253  772.8644 33.85351 762.7628 23.45285 10.10156       41.18369 
1 1 1 -5  14 11 o 384.6406 25.14372 29.04022       3.735221      31.49931       5.420434      26.81658       5.154401  398.6406 35.38031 367.2953 36.62394 31.34534       50.92228 
1 1 1 -5  14 12 o 863.8536 16.50148 145.2889       5.535937      151.3467       7.948247      139.5815       7.714958  880.5298 23.24338 845.5645 23.49410 34.96527       33.04887 
1 1 1 -5  14 13 o 870.6524 19.70238 147.7148       6.661798      146.9187       8.060105      149.4311       11.83447  867.5768 23.92240 872.4003 34.93053 -4.823547      42.33702 
1 1 1 -5  14 14 o 493.6326 27.61868 47.77095       5.273382      47.37090       6.392189      48.62332       9.330573  490.3996 33.76967 492.9678 49.40216 -2.568237      59.84116 
1 1 1 -5  14 15 o 583.8282 26.10121 66.55211       5.917982      65.88250       7.314471      67.82118       10.06973  579.0887 32.65771 584.6525 44.68828 -5.563782      55.34951 
1 1 1 -5  14 16 o 890.6756 18.52950 154.4651       6.409309      155.6308       9.208505      153.3697       8.926344  892.7394 26.56051 886.3472 25.93234 6.392212       37.12071 
1 1 1 -5  14 17 o 873.6157 21.79737 148.7845       7.395244      144.3007       12.03409      151.5053       9.374147  857.3942 36.14138 880.5565 27.41237 -23.16229      45.36119 
1 1 1 -5  14 18 o 751.7177 30.92642 110.6940       9.028435      110.6940       9.028435      0.000000       0.000000  751.7177 30.92642 ?        ?        0.000000       30.92642 
1 1 1 -5  14 19 o 1174.791 18.92626 269.0085       8.634825      273.2242       11.96773      264.4308       12.47077  1181.955 26.07250 1162.269 27.62860 19.68677       37.98835 
1 1 1 -5  14 20 o 502.7154 31.08813 49.82117       6.039600      56.07076       8.241121      42.57024       8.876832  530.8160 40.27765 458.7258 50.67448 72.09027       64.73169 
1 1 1 -5  14 21 o 406.4785 39.40160 33.01851       6.141745      39.10024       8.245930      25.44082       9.204372  439.3902 49.16660 345.3663 70.99783 94.02383       86.35999 
1 1 1 -5  14 22 o 270.9091 76.13435 15.90633       8.342525      15.90633       8.342525      0.000000       0.000000  270.9091 76.13435 ?        ?        0.000000       76.13435 
1 1 1 -5  14 23 o 469.6403 41.02311 44.30259       7.406981      50.31492       8.901857      30.77260       13.35389  498.4144 46.52790 366.2339 93.55244 132.1805       104.4840 
1 1 1 -5  14 24 o 647.9161 28.73380 82.83882       7.230026      95.52499       9.849376      68.01556       10.64671  691.3271 36.81841 577.2231 47.92804 114.1040       60.43751 
1 1 1 -5  14 25 o 268.8561 63.90526 15.95895       6.574318      23.83705       8.708104      5.517047       10.02543  326.1341 70.78604 198.3320 81.37106 127.8021       107.8513 
1 1 1 -5  14 26 o 118.3322 56.86799 -9.191233      7.627128      -16.88910      13.22001      -5.350537      9.337953  148.2107 72.09290 145.9502 67.91132 2.260498       99.04208 
1 1 1 -5  14 27 o 192.4464 68.86877 8.060078       6.522789      18.03445       9.183888      -2.093214      9.265891  268.4916 81.18101 153.9469 70.16629 114.5447       107.3017 
1 1 1 -5  14 28 o 154.2288 64.37949 3.180418       6.425789      1.196557       9.125498      5.131524       9.049850  162.0348 72.08789 179.3835 75.73133 -17.34869      104.5557 
1 1 1 -5  14 29 o 127.5991 57.94186 -1.044906      6.244385      -2.716435      9.322807      0.3151432      8.409441  144.9264 67.57543 149.6829 67.67655 -4.756500      95.63762 
1 1 1 -5  14 30 o 233.2836 65.28707 14.14512       6.148034      23.54767       9.258341      6.728354       8.222759  284.2800 80.31438 173.6249 72.68143 110.6551       108.3189 
1 1 1 -5  15 1  o 287.8755 31.62246 16.47046       3.477070      17.98358       5.641471      15.54355       4.415442  296.0079 50.91072 277.0230 42.39053 18.98486       66.24847 
1 1 1 -5  15 2  o 579.0225 17.84435 65.34879       4.012584      66.55733       5.588791      64.06303       5.764593  583.3458 24.66969 572.0916 25.94628 11.25421       35.80228 
1 1 1 -5  15 3  o 414.8558 21.39838 33.69070       3.435772      34.65785       4.083750      31.34757       6.356357  420.1471 25.14371 395.5364 42.02401 24.61066       48.97166 
1 1 1 -5  15 4  o 104.5340 43.86778 0.3970803      3.007245      2.822061       3.550425      -5.759689      5.657214  134.8842 50.39567 109.7238 51.63450 25.16042       72.15154 
1 1 1 -5  15 5  o 242.9703 41.59790 12.00715       3.783967      12.00715       3.783967      0.000000       0.000000  242.9703 41.59790 ?        ?        0.000000       41.59790 
1 1 1 -5  15 6  o 124.5014 50.04872 1.540047       3.703447      1.540047       3.703447      0.000000       0.000000  124.5014 50.04872 ?        ?        0.000000       50.04872 
1 1 1 -5  15 7  o 1334.689 15.22919 346.8096       7.893780      336.0894       10.73956      359.4070       11.64195  1312.337 21.07235 1356.763 22.09499 -44.42542      30.53248 
1 1 1 -5  15 8  o 276.2020 31.16014 15.15252       3.283947      15.83256       4.554110      14.41587       4.739863  279.6351 43.33804 265.4490 47.73366 14.18613       64.47238 
1 1 1 -5  15 9  o 602.1503 20.71867 70.71553       4.845012      74.43659       8.297215      68.79027       5.968215  614.3629 34.92017 593.1649 25.90843 21.19800       43.48178 
1 1 1 -5  15 10 o 677.4570 20.63793 89.48396       5.429700      90.52964       9.509354      88.97813       6.613841  677.5789 36.26946 674.8549 25.23570 2.723938       44.18500 
1 1 1 -5  15 11 o 522.9105 24.49030 53.38608       4.973354      53.75930       6.008677      52.57420       8.862354  523.2444 29.69198 513.7850 44.86609 9.459412       53.80130 
1 1 1 -5  15 12 o 660.8121 21.92688 85.14618       5.627076      87.51600       6.943139      80.61031       9.605700  669.2711 26.71319 638.9879 38.89378 30.28326       47.18390 
1 1 1 -5  15 13 o 789.0889 21.13323 121.3495       6.476194      124.8993       7.987751      114.5396       11.06340  799.8461 25.71521 763.6853 37.30322 36.16077       45.30786 
1 1 1 -5  15 14 o 1112.666 19.62565 241.1219       8.480408      250.3103       10.58567      224.6591       14.16939  1132.810 24.06210 1070.769 34.07434 62.04150       41.71385 
1 1 1 -5  15 15 o 279.2309 43.17294 15.70430       4.530655      17.90928       6.433102      13.53432       6.381835  294.9864 58.22232 255.0456 64.41488 39.94083       86.82808 
1 1 1 -5  15 16 o 409.1583 34.98933 33.06552       5.506276      37.41541       8.583025      30.02314       7.178069  431.2119 52.32505 386.5601 48.90909 44.65179       71.62409 
1 1 1 -5  15 17 o 193.5811 58.58437 7.575831       4.781197      5.513779       6.614041      9.832790       6.919569  184.9425 68.84576 221.5654 71.02409 -36.62283      98.91492 
1 1 1 -5  15 18 o 379.0647 36.86546 28.54687       5.358356      23.27015       7.390934      34.39333       7.779725  335.8359 58.81186 412.9589 49.49600 -77.12299      76.86800 
1 1 1 -5  15 19 o 132.3102 57.04013 -0.2060760     5.327739      -0.4090593     7.187376      0.4148541E-01  7.937464  151.9855 65.88486 161.6936 69.66528 -9.708038      95.88570 
1 1 1 -5  15 20 o 256.6005 60.27357 13.87044       5.904196      16.30389       7.828660      10.66068       8.991100  275.7655 72.23756 232.8341 81.07185 42.93138       108.5860 
1 1 1 -5  15 21 o 292.9368 61.29396 18.09410       6.749046      19.27437       8.292782      15.77887       11.61464  299.0259 72.22340 272.9908 92.23654 26.03516       117.1486 
1 1 1 -5  15 22 o 338.4059 61.46474 24.13340       7.780252      22.27021       8.679369      31.75435       17.55351  320.7795 71.49751 364.3138 112.6364 -43.53433      133.4124 
1 1 1 -5  15 23 o 283.8076 60.14590 17.20919       6.423207      11.73661       8.385695      24.97820       9.991393  234.9969 78.37609 334.6685 78.27089 -99.67155      110.7662 
1 1 1 -5  15 24 o 114.1563 54.10057 -6.677479      6.416250      -8.267983      8.524229      -4.598422      9.745877  131.8211 62.43900 154.7771 71.07452 -22.95599      94.60558 
1 1 1 -5  15 25 f 289.8071 73.55302 19.37770       8.292274      9.731710       14.26547      24.30027       10.19081  232.9996 96.47859 319.7912 81.74473 -86.79160      126.4528 
1 1 1 -5  15 26 o 391.4350 54.22510 33.09909       8.021654      51.84443       14.09884      24.12637       9.754358  465.2953 80.96432 315.0146 79.67815 150.2808       113.5950 
1 1 1 -5  15 27 o 475.7424 36.66522 46.59108       6.721916      50.88978       9.613783      42.47951       9.402198  484.0376 51.95587 437.6829 56.64367 46.35474       76.86298 
1 1 1 -5  15 28 o 165.0430 65.71504 5.230069       6.321651      13.48997       9.359449      -1.699405      8.572611  224.5487 82.19581 145.0985 66.64082 79.45020       105.8166 
1 1 1 -5  15 29 o 147.9345 61.99183 3.433633       5.991444      2.862988       8.846764      3.917129       8.143251  160.1962 71.13773 161.6355 70.09868 -1.439270      99.87192 
1 1 1 -5  15 30 o 111.7960 52.90518 -3.862067      6.092210      -4.412389      9.230406      -3.437298      8.109408  134.1341 63.94341 129.5570 61.22671 4.577118       88.52949 
1 1 1 -5  16 1  o 631.8105 18.76227 77.79315       4.603629      74.95468       7.095084      79.85707       6.050096  618.5294 29.53719 639.3453 24.36681 -20.81598      38.29083 
1 1 1 -5  16 2  f 161.4289 56.99812 4.649068       4.453640      0.000000       0.000000      4.649068       4.453640  ?        ?        161.4289 56.99812 0.000000       56.99812 
1 1 1 -5  16 3  f 158.1755 48.99683 4.975797       3.319772      5.374979       4.112828      4.229445       5.623756  166.7947 54.85361 166.8786 63.19597 -0.8387756E-01 83.68183 
1 1 1 -5  16 4  o 936.2103 17.23323 170.7185       6.265678      172.2396       7.552137      167.3589       11.22329  939.7346 20.69363 923.7021 31.28674 16.03247       37.51115 
1 1 1 -5  16 5  o 97.27459 45.04610 -3.277333      4.033981      -3.277333      4.033981      0.000000       0.000000  97.27459 45.04610 ?        ?        0.000000       45.04610 
1 1 1 -5  16 6  f 632.1857 19.73766 77.90376       4.845831      88.80299       6.026262      57.96131       8.151536  674.4977 23.00592 540.9356 39.06581 133.5621       45.33663 
1 1 1 -5  16 7  o 712.3201 19.12749 98.87066       5.291285      105.9308       6.502922      85.03827       9.102255  736.7849 22.72688 656.8064 35.82011 79.97845       42.42159 
1 1 1 -5  16 8  o 546.6783 26.75422 58.41305       5.680051      55.05039       7.586240      62.70320       8.568821  527.8340 37.24753 562.9253 39.44526 -35.09131      54.25225 
1 1 1 -5  16 9  o 1075.449 22.55762 225.5920       9.421309      230.0811       13.08305      220.7567       13.57822  1083.923 31.08013 1061.177 32.94786 22.74597       45.29388 
1 1 1 -5  16 10 o 164.6023 54.73040 5.143897       4.090253      8.004195       4.941736      -1.078425      7.288700  198.7043 59.43105 150.7324 65.83162 47.97195       88.68964 
1 1 1 -5  16 11 o 191.3747 56.53138 7.419131       4.492455      0.9211636      5.388864      22.22467       8.134307  140.9756 58.91127 327.1291 66.29900 -186.1534      88.69101 
1 1 1 -5  16 12 o 1405.486 18.98453 384.6481       10.36226      374.9957       12.39000      407.1130       18.90200  1386.835 23.00481 1441.608 33.76234 -54.77332      40.85482 
1 1 1 -5  16 13 o 709.1700 22.70747 98.03687       6.253843      102.5828       7.712384      89.30869       10.68653  724.7839 27.40010 672.6898 41.10389 52.09412       49.39934 
1 1 1 -5  16 14 o 886.5409 20.12361 153.0891       6.928397      154.3769       11.73096      152.3993       8.585814  887.7065 34.02797 883.7946 25.01510 3.911987       42.23337 
1 1 1 -5  16 15 o 1355.741 17.35134 357.7759       9.135616      353.6579       13.02435      361.7641       12.81756  1346.177 24.91298 1361.700 24.23795 -15.52283      34.75824 
1 1 1 -5  16 16 o 765.6531 20.58514 114.2648       6.120881      125.3300       8.917096      104.4060       8.417001  800.4402 28.68577 730.3860 29.67406 70.05426       41.27255 
1 1 1 -5  16 17 f 558.3777 37.10405 61.64602       8.000155      61.64602       8.000155      0.000000       0.000000  558.3777 37.10405 ?        ?        0.000000       37.10405 
1 1 1 -5  16 18 o 705.1107 23.26740 97.13203       6.371375      95.73737       8.889627      98.60522       9.136409  697.9382 32.79734 708.2045 33.21917 -10.26630      46.68167 
1 1 1 -5  16 19 o 342.1861 48.09126 23.79702       6.214418      30.94486       7.764618      11.05875       10.36545  389.4391 52.69268 240.8396 86.74926 148.5995       101.4985 
1 1 1 -5  16 20 o 488.0753 36.69234 47.33345       6.903996      52.45068       8.483566      37.29824       11.88023  511.7793 43.08507 417.3486 76.10305 94.43066       87.45283 
1 1 1 -5  16 21 o 387.5219 52.65285 30.83564       7.718856      30.41580       8.770106      32.27872       16.25953  381.3080 61.30144 370.6944 106.9948 10.61359       123.3116 
1 1 1 -5  16 22 o 196.4389 67.89769 7.615901       6.300840      19.63095       8.623081      -6.147710      9.229239  298.3959 74.60946 146.9247 68.07248 151.4712       100.9972 
1 1 1 -5  16 23 o 275.0273 78.51285 17.13802       8.800241      17.13802       8.800241      0.000000       0.000000  275.0273 78.51285 ?        ?        0.000000       78.51285 
1 1 1 -5  16 24 o 661.2238 40.59792 88.78404       10.37467      88.78404       10.37467      0.000000       0.000000  661.2238 40.59792 ?        ?        0.000000       40.59792 
1 1 1 -5  16 25 o 650.5707 34.66287 85.47607       8.726060      91.77377       15.45417      82.52849       10.57273  647.5744 62.21672 632.4686 43.30540 15.10583       75.80421 
1 1 1 -5  16 26 o 185.9817 66.76255 7.451566       6.134431      11.67887       8.452929      2.747980       8.916405  221.5586 78.49295 170.8466 73.72195 50.71202       107.6850 
1 1 1 -5  16 27 o 294.2277 55.43216 19.58509       6.101576      30.56916       9.138750      10.75057       8.195904  357.0403 68.39880 209.5989 76.88773 147.4414       102.9083 
1 1 1 -5  16 28 o 140.5599 59.72990 2.341263       5.689548      2.805995       8.840023      2.012616       7.433902  162.0412 71.57411 150.5702 66.10304 11.47099       97.42928 
1 1 1 -5  16 29 o 131.6468 58.22288 0.9797325      5.867881      -6.187189      9.236721      5.829329       7.598087  130.8814 62.81435 167.0981 69.90051 -36.21666      93.97725 
1 1 1 -5  17 1  o 1219.380 15.57489 289.3258       7.375506      295.1870       10.38129      283.3521       10.48050  1230.450 21.72499 1205.379 22.38878 25.07080       31.19667 
1 1 1 -5  17 2  o 752.3328 16.73549 110.1737       4.889633      112.2341       6.828144      108.0050       7.005227  758.4865 23.18072 743.8954 24.24836 14.59106       33.54592 
1 1 1 -5  17 3  o 1220.143 20.93253 290.1890       9.918830      274.7667       13.34243      309.2417       14.82986  1185.203 28.98775 1256.908 30.38124 -71.70581      41.99178 
1 1 1 -5  17 4  o 538.6934 38.09003 57.33136       7.917208      57.33136       7.917208      0.000000       0.000000  538.6934 38.09003 ?        ?        0.000000       38.09003 
1 1 1 -5  17 5  o 165.8746 51.42904 5.454431       3.656587      5.514183       4.446512      5.329615       6.426536  170.6058 57.07307 182.3808 67.86865 -11.77496      88.67632 
1 1 1 -5  17 6  o 1136.083 17.49726 251.2664       7.719836      254.9929       9.465449      243.8634       13.34126  1143.767 21.30961 1116.226 30.77632 27.54114       37.43370 
1 1 1 -5  17 7  o 566.2697 22.37024 62.52066       4.919509      68.68315       6.032325      50.28325       8.500637  593.0724 26.19081 503.0810 43.95087 89.99149       51.16286 
1 1 1 -5  17 8  o 473.6606 31.04552 44.08481       5.679173      44.60248       7.761362      43.48820       8.332103  473.9992 42.61868 467.0083 46.56194 6.990967       63.12183 
1 1 1 -5  17 9  o 894.8499 18.76204 155.9119       6.520160      155.9394       7.849585      155.8507       11.70977  894.3813 22.59935 891.9579 33.80463 2.423401       40.66305 
1 1 1 -5  17 10 o 970.4550 18.88492 183.3617       7.117353      184.0339       8.617298      181.9190       12.62477  971.6332 22.83709 963.8192 33.72873 7.814087       40.73278 
1 1 1 -5  17 11 o 1426.872 19.11847 396.3979       10.59415      396.0999       12.93154      397.0061       18.47479  1425.396 23.36075 1424.062 33.40586 1.334351       40.76366 
1 1 1 -5  17 12 o 696.9726 22.57429 94.67973       6.110231      93.67179       10.00165      95.27992       7.717954  690.0070 37.46461 698.4093 28.45537 -8.402344      47.04577 
1 1 1 -5  17 13 o 273.9217 47.14595 15.21435       4.834416      16.67645       7.864768      14.32639       6.129084  282.2679 71.62775 262.8534 61.18732 19.41452       94.20415 
1 1 1 -5  17 14 o 421.3810 29.97964 34.90190       4.874018      34.16648       7.140549      35.54346       6.669354  413.7170 45.17699 423.0279 41.11580 -9.310913      61.08575 
1 1 1 -5  17 15 o 752.7081 20.42022 110.4308       5.969184      123.5079       8.860956      99.56573       8.076830  794.5674 28.71586 713.3269 29.15576 81.24048       40.92260 
1 1 1 -5  17 16 o 168.3423 59.85297 5.016104       4.919135      10.18283       7.223410      0.5477366      6.717520  224.8581 72.61794 152.6969 64.89500 72.16119       97.38956 
1 1 1 -5  17 17 o 414.7303 34.14058 34.05283       5.449912      34.24187       7.636533      33.85661       7.780152  411.8856 48.68242 409.1093 50.01015 2.776367       69.79250 
1 1 1 -5  17 18 o 416.3033 41.34728 34.66275       6.596310      45.70851       8.333863      16.13618       10.79309  477.2312 45.51837 275.7125 88.73704 201.5187       99.73055 
1 1 1 -5  17 19 o 180.5383 65.04532 5.821375       5.827931      9.157722       8.092976      2.227560       8.399444  218.3066 76.86109 176.4456 73.62531 41.86099       106.4346 
1 1 1 -5  17 20 o 433.6872 44.02687 37.89321       7.312393      36.73031       8.658323      40.78598       13.65588  423.1723 53.90954 430.9179 84.62124 -7.745575      100.3344 
1 1 1 -5  17 21 o 492.5790 39.83593 48.65199       7.555185      54.17277       8.843683      33.73801       14.53548  518.0125 44.38953 380.5453 97.81780 137.4672       107.4186 
1 1 1 -5  17 22 o 215.0723 67.61205 9.884129       6.295315      8.557426       8.352047      11.62943       9.579477  210.6939 77.56716 235.5290 83.54732 -24.83513      114.0036 
1 1 1 -5  17 23 o 275.4679 59.59608 16.51450       6.190265      8.054590       8.201707      27.71291       9.436255  204.1186 76.53037 351.7968 71.50565 -147.6782      104.7376 
1 1 1 -5  17 24 o 179.2661 72.88190 4.738586       7.951246      -9.622054      14.21802      11.27364       9.591283  170.2307 80.63437 225.9817 83.13368 -55.75099      115.8150 
1 1 1 -5  17 25 f 243.4942 68.08798 13.87629       6.689774      5.559181       9.529509      21.95767       9.393495  189.0634 78.61630 298.6728 79.55823 -109.6095      111.8483 
1 1 1 -5  17 26 o 332.5897 50.37256 24.17264       6.302567      8.186847       8.898558      40.26391       8.927866  196.3296 78.03151 426.0361 55.26197 -229.7065      95.61800 
1 1 1 -5  17 27 o 324.3503 47.76645 23.18597       5.836640      23.04223       8.611244      23.30812       7.938276  298.5958 74.50223 306.9417 68.34992 -8.345856      101.1054 
1 1 1 -5  17 28 o 128.3061 56.54753 0.7546849      5.487839      2.170085       8.436626      -0.2834653     7.225356  154.7384 69.04324 136.9892 62.25257 17.74919       92.96424 
1 1 1 -5  17 29 o 148.8892 60.38519 4.422649       5.443053      9.542173       8.149353      0.2993745      7.313571  187.3962 74.61335 137.5242 62.54803 49.87199       97.36225 
1 1 1 -5  18 1  o 729.5720 17.02892 103.5766       4.824845      104.9643       6.689219      102.0716       6.965910  733.7391 23.47501 723.3888 24.79580 10.35028       34.14539 
1 1 1 -5  18 2  o 688.4437 17.88002 92.25036       4.780402      91.05240       6.535657      93.62863       7.010289  683.2306 24.63168 692.6426 26.06146 -9.411987      35.85971 
1 1 1 -5  18 3  o 137.2323 56.63108 1.208593       4.891065      1.208593       4.891065      0.000000       0.000000  137.2323 56.63108 ?        ?        0.000000       56.63108 
1 1 1 -5  18 4  o 818.0048 19.48584 130.3006       6.190175      130.3006       6.190175      0.000000       0.000000  818.0048 19.48584 ?        ?        0.000000       19.48584 
1 1 1 -5  18 5  o 204.1991 55.07430 8.558250       4.467671      8.713237       5.804164      8.332911       6.998636  208.6757 64.81053 210.1801 71.59611 -1.504471      96.57333 
1 1 1 -5  18 6  o 337.1084 30.64142 22.39740       3.967689      19.87990       4.665725      28.97372       7.540956  315.9349 38.84546 379.0648 52.64674 -63.12991      65.42667 
1 1 1 -5  18 7  o 780.6130 21.43601 118.7149       6.498418      116.0517       8.291581      122.9555       10.46288  770.9567 27.69360 792.4537 33.99768 -21.49695      43.84948 
1 1 1 -5  18 8  o 125.6334 53.61973 0.1372798E-01  4.621424      -6.123360      5.892667      9.820216       7.448820  112.2681 52.78982 224.3957 73.82195 -112.1275      90.75487 
1 1 1 -5  18 9  o 476.5912 22.91345 44.26793       4.240963      47.32294       5.840289      40.86000       6.168408  491.0924 30.77819 455.4285 35.14775 35.66391       46.71896 
1 1 1 -5  18 10 o 565.7018 20.99226 62.33432       4.611846      70.53168       6.667224      54.81361       6.386123  600.9535 28.56776 528.5748 31.24908 72.37872       42.33937 
1 1 1 -5  18 11 o 444.2501 29.19076 38.72311       5.008143      39.27636       8.546140      38.43374       6.180588  442.9272 50.59082 441.3171 36.38650 1.610077       62.31700 
1 1 1 -5  18 12 o 459.1625 26.24909 41.28681       4.661250      37.49877       6.611072      45.03146       6.573099  435.1198 39.55532 477.9532 35.66949 -42.83344      53.26289 
1 1 1 -5  18 13 o 320.9240 37.28551 20.49232       4.560369      20.43950       6.445069      20.54527       6.453610  316.4081 54.41254 317.2618 54.33318 -0.8536987     76.89486 
1 1 1 -5  18 14 o 917.8277 18.85366 164.1146       6.720241      161.4050       9.523825      166.8015       9.484011  908.6572 26.98878 923.8485 26.43402 -15.19128      37.77767 
1 1 1 -5  18 15 o 554.5315 25.61261 60.11047       5.515794      61.15943       7.966899      59.14479       7.644131  556.1384 37.10035 547.1042 36.18171 9.034180       51.82231 
1 1 1 -5  18 16 o 289.9837 57.51309 17.46610       6.248181      20.17645       7.847201      12.77146       10.32769  309.2310 67.25851 252.8932 86.95501 56.33780       109.9313 
1 1 1 -5  18 17 o 751.4437 23.11192 110.3443       6.744666      113.4880       9.331687      106.9057       9.759482  759.9786 31.61774 736.9011 34.10277 23.07751       46.50462 
1 1 1 -5  18 18 o 290.5946 51.88532 17.41977       5.640620      14.97130       7.852748      20.02963       8.107428  264.3592 73.71513 306.2617 69.72837 -41.90253      101.4690 
1 1 1 -5  18 19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -5  18 20 o 660.8146 31.49997 86.17242       8.083840      80.37751       9.574499      100.5589       15.08585  634.3840 39.05272 699.9868 55.96266 -65.60278      68.24174 
1 1 1 -5  18 21 o 489.8669 33.75878 47.84815       6.383129      55.80180       8.957987      39.64420       9.097854  524.3635 44.40675 436.3198 54.90756 88.04373       70.61728 
1 1 1 -5  18 22 f 434.2949 38.08385 38.13517       6.358366      40.96263       8.769949      35.00191       9.232010  442.9572 51.96835 404.0575 60.71065 38.89969       79.91553 
1 1 1 -5  18 23 o 810.4084 29.90462 130.7558       9.411746      109.5536       16.15792      141.6436       11.57882  715.3715 58.67677 839.2242 35.52699 -123.8527      68.59396 
1 1 1 -5  18 24 o 365.6729 57.25580 29.28225       7.864115      25.04558       13.96467      31.24980       9.516583  301.9347 101.1426 369.0569 68.93371 -67.12216      122.3996 
1 1 1 -5  18 25 o 157.5355 70.42635 0.1313392      8.823266      0.000000       0.000000      0.1313392      8.823266  ?        ?        157.5355 70.42635 0.000000       70.42635 
1 1 1 -5  18 26 o 163.0999 64.78719 5.032119       6.130961      -3.207777      8.893476      12.49448       8.463475  142.5455 66.30988 219.6040 78.46248 -77.05849      102.7295 
1 1 1 -5  18 27 o 427.5784 61.72046 43.82500       9.952057      43.82500       9.952057      0.000000       0.000000  427.5784 61.72046 ?        ?        0.000000       61.72046 
1 1 1 -5  18 28 o 155.1987 62.33893 5.000912       5.740639      4.882432       8.956115      5.083534       7.479052  166.4259 72.82219 162.1943 68.68031 4.231598       100.1002 
1 1 1 -5  19 1  o 991.8662 19.17947 191.4840       7.387845      192.4504       8.560256      188.6628       14.62548  993.9702 22.17611 981.0516 38.38754 12.91864       44.33265 
1 1 1 -5  19 2  f 286.8188 44.09557 16.53683       4.754414      16.72601       5.324464      15.79254       10.56112  287.3193 49.50512 278.5845 87.57217 8.734833       100.5964 
1 1 1 -5  19 3  o 796.0455 21.34722 123.4163       6.599442      119.8219       7.511062      135.5862       13.82071  783.9752 24.67011 829.5063 43.05051 -45.53119      49.61815 
1 1 1 -5  19 4  o 882.7970 16.61685 151.6028       5.696886      148.8068       6.649154      159.3210       11.04741  874.3106 19.58270 902.8699 31.50702 -28.55927      37.09682 
1 1 1 -5  19 5  o 698.5447 18.30716 94.96116       4.966417      92.56322       5.807805      101.4856       9.579973  689.3611 21.69388 720.1586 34.25375 -30.79749      40.54558 
1 1 1 -5  19 6  o 1207.453 19.24472 283.7939       9.024222      281.0079       11.22753      288.8787       15.16790  1200.681 24.07846 1215.565 32.13063 -14.88416      40.15158 
1 1 1 -5  19 7  f 519.1375 27.98574 52.75699       5.621340      48.76480       7.234224      58.84110       8.930684  497.3736 37.73373 545.5935 42.48397 -48.21994      56.82185 
1 1 1 -5  19 8  o 1344.705 16.93240 351.8050       8.842471      344.8958       10.14855      373.5850       18.01850  1330.987 19.63371 1381.749 33.57852 -50.76221      38.89729 
1 1 1 -5  19 9  o 855.2910 24.41418 142.6424       8.109312      148.1599       11.39897      136.9885       11.53891  870.0202 33.73715 836.2136 35.53199 33.80664       48.99712 
1 1 1 -5  19 10 o 842.4472 17.90216 138.1381       5.857012      142.3513       8.351144      134.0594       8.216625  854.2100 25.17406 828.9037 25.52475 25.30627       35.85033 
1 1 1 -5  19 11 o 798.9304 18.63201 124.2837       5.780915      127.2995       8.175287      121.2677       8.175611  807.5004 26.06947 788.0315 26.71460 19.46893       37.32676 
1 1 1 -5  19 12 o 1011.300 17.71761 199.1347       6.958461      214.0246       10.13605      185.8618       9.569841  1047.028 24.92772 975.6412 25.25728 71.38635       35.48692 
1 1 1 -5  19 13 o 941.3658 18.33632 172.6266       6.703454      179.7753       9.574302      165.7524       9.388656  959.1793 25.70273 920.8857 26.25244 38.29352       36.73991 
1 1 1 -5  19 14 o 510.7534 27.37069 51.19096       5.409314      58.03990       7.683682      44.46107       7.616610  541.7465 36.73840 472.4608 41.94775 69.28574       55.76131 
1 1 1 -5  19 15 o 299.4801 55.08427 18.51616       6.170465      17.82939       7.569487      19.87646       10.65318  290.1316 68.31152 302.9769 86.34666 -12.84531      110.1009 
1 1 1 -5  19 16 o 654.3209 24.47978 83.72389       6.220514      83.54021       8.894917      83.89971       8.702508  650.2024 35.35910 651.8762 34.49847 -1.673767      49.40051 
1 1 1 -5  19 17 o 134.3275 57.91463 -0.1556427     5.493273      2.576292       7.947760      -2.654488      7.601149  174.6600 72.14211 145.3577 65.14709 29.30231       97.20405 
1 1 1 -5  19 18 o 273.9764 55.86308 15.71281       5.742305      9.914669       7.979762      21.93993       8.269688  222.7735 76.44366 320.3111 68.55033 -97.53760      102.6780 
1 1 1 -5  19 19 o 369.2771 52.23719 28.12280       7.282312      37.11755       8.894394      9.831248       12.68373  423.6881 55.38107 239.5459 93.79784 184.1422       108.9270 
1 1 1 -5  19 20 f 470.3402 36.64305 44.32092       6.640349      50.80637       9.402821      37.86833       9.378968  497.8085 49.28463 424.5879 58.42789 73.22064       76.43817 
1 1 1 -5  19 21 o 273.4789 59.53267 16.21690       6.143362      20.77173       8.452084      11.11544       8.944899  303.7558 72.63123 228.2534 80.75769 75.50241       108.6145 
1 1 1 -5  19 22 o 350.3997 49.05780 25.80334       6.492731      23.09735       8.993809      28.74844       9.382751  316.4040 74.43761 357.0652 70.16589 -40.66113      102.2947 
1 1 1 -5  19 23 o 246.2498 73.99229 14.32449       7.646921      1.150459       14.03285      19.88882       9.119965  195.9509 88.11639 286.3095 79.30042 -90.35869      118.5456 
1 1 1 -5  19 24 o 372.9108 46.15211 29.57097       6.541082      22.59457       8.935429      37.62607       9.601408  303.3668 76.00201 407.4033 62.69532 -104.0365      98.52415 
1 1 1 -5  19 25 o 446.5173 37.26212 41.47911       6.402479      36.97094       8.930891      46.24574       9.183331  402.4438 58.88495 457.1129 52.69575 -54.66913      79.02075 
1 1 1 -5  19 26 o 148.2212 62.05973 3.232073       5.996735      -5.410521      8.424879      12.10742       8.537572  130.0766 61.74612 212.3474 78.38241 -82.27083      99.78168 
1 1 1 -5  19 27 f 186.6008 65.84412 8.838928       5.942399      7.325261       8.663839      10.18360       8.165890  178.7922 74.70429 194.8623 75.54886 -16.07004      106.2467 
1 1 1 -5  20 1  o 353.5568 35.14346 24.69059       4.761439      23.25524       5.282083      30.91370       10.99841  342.0377 40.55521 386.1165 76.05308 -44.07883      86.19046 
1 1 1 -5  20 2  o 297.5522 43.12749 17.73725       4.838359      22.67929       5.434292      -1.161026      10.62677  337.3236 42.42105 183.4659 79.82207 153.8577       90.39419 
1 1 1 -5  20 3  o 565.3352 26.29671 62.32911       5.773449      64.54709       6.573441      54.84423       12.07554  574.2286 29.57724 522.1945 60.67626 52.03412       67.50127 
1 1 1 -5  20 4  o 438.4379 24.87731 37.59315       4.218390      39.64207       4.970149      32.31488       7.977261  449.7634 28.60355 401.2128 52.45355 48.55057       59.74561 
1 1 1 -5  20 5  o 575.3641 21.12502 64.46887       4.720282      68.79890       5.614289      54.02664       8.718584  594.0896 24.33407 522.5436 43.35465 71.54602       49.71693 
1 1 1 -5  20 6  o 466.7828 30.36390 42.74791       5.474339      43.91438       7.081394      41.01546       8.630061  471.5814 39.01689 453.2209 49.85586 18.36053       63.30817 
1 1 1 -5  20 7  o 321.0922 37.86960 20.49175       4.631394      18.61999       5.440386      25.41922       8.827064  303.7724 47.68671 350.9017 67.22176 -47.12930      82.41837 
1 1 1 -5  20 8  o 593.7897 29.42730 68.90141       6.785956      57.59433       9.100257      83.06365       10.18462  539.1012 43.84647 648.8817 40.62043 -109.7805      59.77067 
1 1 1 -5  20 9  o 388.8905 38.20508 29.98012       5.695521      26.71159       7.361741      34.85356       8.989216  363.1056 53.83678 414.7069 57.35007 -51.60126      78.66022 
1 1 1 -5  20 10 o 216.4074 56.09586 9.681714       4.753410      14.11468       5.815152      0.7554370      8.251804  260.8770 58.80447 169.5339 71.98436 91.34305       92.95006 
1 1 1 -5  20 11 o 170.7063 56.70959 5.569055       4.391785      3.994545       6.213542      7.140912       6.208307  170.4324 65.95067 195.4469 67.40623 -25.01453      94.30319 
1 1 1 -5  20 12 o 542.2557 24.71873 57.44066       5.205450      66.09593       7.500252      49.39701       7.230397  579.2950 33.48140 499.5548 37.54386 79.74020       50.30453 
1 1 1 -5  20 13 o 355.5400 42.57355 25.34932       5.761452      21.20940       6.989578      34.12474       10.17627  320.2925 58.34172 405.1056 67.02717 -84.81308      88.86168 
1 1 1 -5  20 14 o 447.8741 31.94654 39.58715       5.520143      46.26600       7.891292      33.18733       7.724696  481.4836 42.64370 404.9297 50.19798 76.55380       65.86594 
1 1 1 -5  20 15 o 368.0817 39.02041 27.06540       5.492756      35.05048       7.980747      19.87869       7.571278  415.8679 50.44775 306.9847 65.50343 108.8831       82.67813 
1 1 1 -5  20 16 o 446.3197 33.65690 39.45727       5.790833      47.11085       8.153464      31.66697       8.225967  484.7810 43.78046 392.7251 55.47970 92.05591       70.67338 
1 1 1 -5  20 17 o 413.5505 37.18002 34.12372       5.907443      42.82272       8.492208      25.96737       8.223063  459.7043 48.28954 351.5122 62.52880 108.1921       79.00462 
1 1 1 -5  20 18 o 903.4994 25.06445 160.1606       8.794558      171.5329       10.99483      139.9598       14.65372  932.7858 30.35140 833.7266 45.42946 99.05927       54.63555 
1 1 1 -5  20 19 o 798.1070 27.96971 125.5842       8.669161      130.3620       10.60050      115.9359       15.06389  810.3945 33.68231 751.5623 51.92971 58.83215       61.89663 
1 1 1 -5  20 20 o 512.1088 32.97273 52.40182       6.522745      64.02009       9.344124      41.35977       9.109461  560.7511 43.24207 444.2650 53.90240 116.4861       69.10387 
1 1 1 -5  20 21 o 217.2505 66.93382 10.48424       6.204811      -3.676191      8.633933      25.60894       8.923063  146.4637 67.12415 336.4645 70.54275 -190.0009      97.37521 
1 1 1 -5  20 22 o 429.8090 46.39851 38.68953       7.621907      48.68427       14.00187      34.48081       9.086043  450.0418 83.17728 395.3817 61.14727 54.66010       103.2349 
1 1 1 -5  20 23 o 406.5424 48.18679 35.27569       7.459768      18.97558       13.12668      43.05092       9.066010  263.6860 97.21796 445.0520 53.52741 -181.3660      110.9798 
1 1 1 -5  20 24 o 238.0101 64.72523 13.57523       6.140685      15.58931       8.495532      11.37171       8.886108  245.1324 78.71011 214.3611 79.79891 30.77135       112.0854 
1 1 1 -5  20 25 o 210.7821 66.58074 11.08797       6.098035      17.16984       8.529794      4.730011       8.721241  250.8929 78.67400 171.3071 73.39972 79.58574       107.5970 
1 1 1 -5  20 26 o 175.3448 63.95332 7.394164       5.658679      4.774518       8.017728      9.994106       7.987518  164.8501 70.49815 194.9990 74.96247 -30.14899      102.9046 
1 1 1 -5  21 1  o 621.5596 24.19570 75.30347       5.840485      78.80074       6.667824      63.77573       12.10576  635.5317 27.01587 564.7859 55.92767 70.74579       62.11088 
1 1 1 -5  21 2  o 453.4534 25.53104 40.22478       4.477734      42.14980       6.061042      37.91166       6.643971  462.9260 33.95059 437.8793 39.49526 25.04666       52.08184 
1 1 1 -5  21 3  o 884.9519 17.96387 152.4014       6.173727      151.0743       8.482084      153.8966       9.003131  880.2162 24.81334 888.2029 26.10077 -7.986755      36.01322 
1 1 1 -5  21 4  o 764.7666 18.52143 113.8413       5.500872      121.3606       6.499774      94.86067       10.32680  789.3251 21.20383 694.3230 38.44794 95.00208       43.90725 
1 1 1 -5  21 5  o 364.3895 49.70732 26.70436       6.850676      26.70436       6.850676      0.000000       0.000000  364.3895 49.70732 ?        ?        0.000000       49.70732 
1 1 1 -5  21 6  o 600.4537 29.18751 70.46783       6.806197      62.71826       9.317846      79.33233       9.965603  562.7797 42.95780 633.9062 40.69598 -71.12646      59.17377 
1 1 1 -5  21 7  o 150.7998 55.51741 3.646142       4.278548      4.431724       5.038503      1.615103       8.101491  164.5201 60.29505 172.8519 72.23217 -8.331894      94.09027 
1 1 1 -5  21 8  o 1014.954 21.37743 200.8119       8.426159      185.8219       10.32861      230.6406       14.56997  975.1429 27.27381 1084.302 34.60034 -109.1591      44.05728 
1 1 1 -5  21 9  o 1191.754 17.64519 276.5670       8.166595      271.3427       9.427106      292.2780       16.34810  1179.846 20.57431 1220.282 34.49683 -40.43616      40.16632 
1 1 1 -5  21 10 o 1006.264 22.05805 197.5403       8.619994      191.9319       10.83735      207.1994       14.22232  990.4162 28.17587 1026.706 35.66945 -36.28986      45.45536 
1 1 1 -5  21 11 o 101.1347 47.19789 -4.182059      4.563797      0.4254829      6.628120      -8.335806      6.293260  151.0587 64.33628 109.2936 52.29310 41.76507       82.90794 
1 1 1 -5  21 12 o 307.6836 48.21685 19.25591       5.572153      25.83461       6.814564      5.983041       9.679440  356.6464 50.62151 207.9601 81.78428 148.6863       96.18319 
1 1 1 -5  21 13 f 291.7361 46.39178 17.31240       5.080068      19.67946       7.149367      14.89850       7.219751  306.7513 62.14366 265.0463 69.34329 41.70499       93.11459 
1 1 1 -5  21 14 o 789.0170 21.35623 121.5510       6.543936      142.8913       9.542166      102.6031       8.991416  853.5708 28.78587 722.4398 32.04782 131.1310       43.07771 
1 1 1 -5  21 15 o 761.0117 22.73065 113.2248       6.717864      123.0659       9.743178      104.3065       9.275086  790.8527 31.72321 727.7498 32.81768 63.10284       45.64386 
1 1 1 -5  21 16 o 374.3038 40.61226 28.17241       5.808785      37.84926       8.191078      18.38233       8.238856  431.0582 49.84985 290.9401 73.02959 140.1181       88.42132 
1 1 1 -5  21 17 o 489.1042 33.00348 47.52504       6.232203      55.08211       8.815334      39.97370       8.811997  522.3616 43.86100 440.7120 52.52072 81.64960       68.42670 
1 1 1 -5  21 18 o 334.4935 56.30468 23.61107       7.054291      24.45492       8.537724      21.79557       12.52306  334.8687 67.97268 304.1457 95.31986 30.72308       117.0733 
1 1 1 -5  21 19 o 264.0548 60.51282 15.19558       6.072516      23.95370       8.834063      7.350129       8.361110  327.1774 71.52168 200.7876 76.81182 126.3899       104.9543 
1 1 1 -5  21 20 o 249.6147 63.52064 13.90723       6.172902      13.52835       8.657715      14.29900       8.803720  242.3959 79.57967 248.1581 80.17164 -5.762207      112.9620 
1 1 1 -5  21 21 o 474.4298 36.92709 45.84573       6.750100      57.77185       9.710851      34.69603       9.389428  524.6068 48.20375 395.0561 63.34028 129.5507       79.59644 
1 1 1 -5  21 22 o 410.7234 48.72754 36.03925       7.620743      45.58754       13.40088      31.47557       9.264637  428.3509 83.55807 369.2780 67.07263 59.07291       107.1480 
1 1 1 -5  21 23 o 100.6598 48.63897 -7.430982      5.764231      -6.893958      7.819228      -8.070210      8.530894  123.4966 58.86696 126.5146 60.62519 -3.018021      84.50285 
1 1 1 -5  21 24 o 113.7132 53.13976 -3.478721      5.816183      0.3903277      7.989843      -7.840060      8.482934  148.2293 66.58786 124.6777 59.93174 23.55164       89.58659 
1 1 1 -5  21 25 o 169.4426 64.18666 6.567129       5.802584      9.015185       8.308217      4.235845       8.107645  189.9785 75.43298 163.3079 70.38435 26.67065       103.1702 
1 1 1 -5  22 1  o 591.7375 21.34097 68.22772       4.904235      71.32705       6.787782      64.84284       7.093591  604.1539 28.93026 574.7810 31.90404 29.37286       43.06771 
1 1 1 -5  22 2  o 913.7379 17.95587 162.5276       6.371710      164.0827       8.821166      160.8310       9.213552  917.0660 24.76837 907.6893 26.13737 9.376709       36.00881 
1 1 1 -5  22 3  o 381.5957 31.06259 28.67648       4.563348      28.56951       6.165578      28.80607       6.786047  378.5477 42.68488 379.0740 47.11226 -0.5263062     63.57330 
1 1 1 -5  22 4  o 263.5985 58.18885 14.38036       5.797378      18.50305       8.571917      10.90487       7.870393  296.3934 74.54218 233.8850 75.82822 62.50841       106.3318 
1 1 1 -5  22 5  o 692.7351 30.81420 93.93379       8.289840      82.91134       13.89032      100.0317       10.33150  642.6149 56.22455 712.5566 37.46656 -69.94177      67.56436 
1 1 1 -5  22 6  o 434.2339 33.34237 37.18377       5.579815      37.18377       5.579815      0.000000       0.000000  434.2339 33.34237 ?        ?        0.000000       33.34237 
1 1 1 -5  22 7  o 850.7142 19.31189 141.0114       6.380231      132.6935       7.183985      172.0690       13.88170  824.7500 22.42927 935.0836 38.22648 -110.3336      44.32083 
1 1 1 -5  22 8  o 375.3756 34.45612 27.89705       4.966901      26.08105       5.849063      32.59245       9.405134  361.0077 42.53619 397.8859 62.96207 -36.87814      75.98388 
1 1 1 -5  22 9  o 1062.293 18.49982 219.8735       7.632027      220.3196       8.921492      218.6560       14.73763  1062.707 21.61702 1054.344 35.99294 8.363525       41.98557 
1 1 1 -5  22 10 o 242.1282 54.33242 12.17146       4.983399      14.27973       5.818445      6.366882       9.654475  261.6633 58.70261 210.2207 81.96705 51.44258       100.8196 
1 1 1 -5  22 11 o 278.5183 49.16670 15.88178       5.123624      10.57862       6.017365      29.86329       9.770481  225.4235 65.09681 377.2973 69.23267 -151.8738      95.03030 
1 1 1 -5  22 12 o 338.1009 46.02539 23.12675       5.886219      32.30043       10.50529      18.92875       7.106531  391.1192 71.80878 300.2917 62.95017 90.82745       95.49463 
1 1 1 -5  22 13 o 119.3999 53.63663 -2.142972      5.183963      -2.707607      7.485851      -1.622692      7.185811  143.9547 64.57535 145.6763 64.42889 -1.721619      91.21983 
1 1 1 -5  22 14 o 345.6577 42.27067 24.10085       5.556077      21.69709       7.754053      26.63727       7.965159  320.1188 64.59933 357.6151 59.43879 -37.49631      87.78407 
1 1 1 -5  22 15 o 466.0620 31.98122 43.04936       5.753488      44.52697       8.220510      41.63053       8.055326  469.2012 45.69386 453.2676 46.41621 15.93362       65.13366 
1 1 1 -5  22 16 o 225.1183 62.30327 10.87324       5.631740      1.382216       8.256408      19.13133       7.701484  168.4875 71.78339 296.3911 68.31034 -127.9035      99.09166 
1 1 1 -5  22 17 o 342.9229 91.92513 27.81816       12.49187      0.000000       0.000000      27.81816       12.49187  ?        ?        342.9229 91.92513 0.000000       91.92513 
1 1 1 -5  22 18 o 276.9582 58.65460 16.62625       6.112406      14.83545       8.597491      18.45655       8.691775  254.7959 78.83702 283.4246 76.97581 -28.62872      110.1842 
1 1 1 -5  22 19 o 306.4035 52.44867 20.04305       6.016622      11.91848       8.217116      29.43308       8.833899  229.7477 77.58201 364.9391 64.69984 -135.1915      101.0200 
1 1 1 -5  22 20 o 458.4014 36.45650 42.78429       6.436442      55.93763       9.128259      29.77835       9.076965  517.8026 45.86842 362.6387 66.91760 155.1639       81.12877 
1 1 1 -5  22 21 o 220.7024 72.63081 11.54527       7.210164      12.98672       12.79522      10.87459       8.727818  233.2285 93.28475 216.1132 79.33352 17.11531       122.4576 
1 1 1 -5  22 22 o 477.8372 35.67086 47.07548       6.571722      42.97041       8.940269      51.90084       9.692928  441.2573 53.24740 486.4665 52.11802 -45.20920      74.50888 
1 1 1 -5  22 23 o 284.1964 53.70927 18.40611       5.710618      16.91240       7.640876      20.29622       8.595152  255.5811 73.22418 276.8445 77.09418 -21.26344      106.3264 
1 1 1 -5  22 24 o 126.4443 56.52795 -0.5876464E-01 5.684664      1.760492       8.076571      -1.844849      8.002598  152.2247 67.76460 137.5247 63.60092 14.70007       92.93609 
1 1 1 -5  23 1  o 347.3081 33.89093 23.87072       4.512909      25.89151       6.226845      21.63486       6.549833  359.2356 45.66547 325.8367 53.62706 33.39896       70.43576 
1 1 1 -5  23 2  o 709.5062 20.43899 98.10496       5.631752      97.02991       7.814137      99.26691       8.123890  704.3894 28.56540 712.3195 29.36711 -7.930115      40.96839 
1 1 1 -5  23 3  o 354.7430 52.39343 25.52742       7.000803      0.000000       0.000000      25.52742       7.000803  ?        ?        354.7430 52.39343 0.000000       52.39343 
1 1 1 -5  23 4  o 498.8394 38.26345 49.23975       7.356144      61.27470       12.54459      42.93253       9.081413  549.9688 59.69250 462.0099 51.49030 87.95886       78.83176 
1 1 1 -5  23 5  f 509.8262 25.70123 50.90995       5.072296      49.42212       5.953612      54.84923       9.687510  501.3700 30.72515 523.7490 48.16764 -22.37894      57.13280 
1 1 1 -5  23 6  o 459.9276 27.93543 41.53254       4.966055      47.48040       5.936325      27.66595       9.064048  491.2121 31.28145 364.7651 66.43297 126.4470       73.42934 
1 1 1 -5  23 7  o 238.9425 53.29334 11.82453       4.819478      13.33508       5.669471      7.889133       9.151003  252.9187 58.83059 216.8402 80.92867 36.07846       100.0524 
1 1 1 -5  23 8  o 661.6845 29.22680 85.76723       7.510352      85.76723       7.510352      0.000000       0.000000  661.6845 29.22680 ?        ?        0.000000       29.22680 
1 1 1 -5  23 9  o 644.9271 23.59419 81.25188       5.909405      84.60021       6.992749      72.88647       11.05293  657.3961 27.39005 603.5816 47.53823 53.81451       54.86436 
1 1 1 -5  23 10 o 909.9930 20.12243 161.5451       7.111257      155.8625       8.226181      178.3502       14.14639  893.0381 23.71922 950.3774 38.32847 -57.33936      45.07408 
1 1 1 -5  23 11 f 737.0308 22.44355 106.1368       6.423995      105.8757       7.528566      106.8359       12.31952  735.2594 26.36597 732.0214 43.53154 3.237976       50.89360 
1 1 1 -5  23 12 o 189.0538 63.30138 7.017842       5.470001      13.81934       6.394598      -11.53341      10.56082  254.8979 64.53497 145.0815 68.94520 109.8163       94.43623 
1 1 1 -5  23 13 o 705.3932 23.25887 97.40771       6.371592      91.87186       8.885128      103.2682       9.141941  682.0787 33.54295 723.5042 32.53639 -41.42548      46.73057 
1 1 1 -5  23 14 o 161.6737 65.55798 2.888961       6.414251      -10.88723      12.15284      8.208471       7.551777  159.0460 75.09826 206.6243 74.08512 -47.57826      105.4910 
1 1 1 -5  23 15 o 160.3227 62.03446 3.886671       5.497237      -0.6483362     7.791954      8.380736       7.756701  153.9983 67.64049 207.4565 74.99637 -53.45816      100.9935 
1 1 1 -5  23 16 o 427.0318 76.98076 40.79459       12.29682      0.000000       0.000000      40.79459       12.29682  ?        ?        427.0318 76.98076 0.000000       76.98076 
1 1 1 -5  23 17 o 544.7122 34.90770 59.60258       7.345556      59.29832       9.106496      60.16923       12.42778  538.1333 43.95850 529.3886 61.60112 8.744690       75.67727 
1 1 1 -5  23 18 o 389.9937 40.57544 31.21401       6.055404      30.75516       8.619372      31.66118       8.508964  374.8525 61.33044 381.7778 59.31541 -6.925293      85.32140 
1 1 1 -5  23 19 o 333.2789 47.06071 23.49590       5.921608      32.02642       8.137383      13.89359       8.633454  383.6751 56.28616 240.9056 79.48637 142.7695       97.39721 
1 1 1 -5  23 20 o 240.9039 68.89260 13.80766       6.769638      13.94739       10.49139      13.70799       8.861174  236.1305 86.93507 235.3602 80.55976 0.7703094      118.5225 
1 1 1 -5  23 21 o 405.1756 41.32031 34.60868       6.410827      27.28981       8.962798      42.27559       9.173429  334.8126 71.12584 435.1243 55.55423 -100.3117      90.25053 
1 1 1 -5  23 22 f 332.2652 47.80941 24.30165       5.991516      25.22619       8.335601      23.31340       8.618020  319.0482 69.26139 301.0538 74.18994 17.99442       101.4953 
1 1 1 -5  23 23 o 154.2780 61.86723 4.538964       5.643946      7.405268       7.999897      1.698529       7.963715  180.9218 73.26616 151.5768 67.39336 29.34500       99.54796 
1 1 1 -5  24 1  o 830.9977 21.63951 134.6729       6.983533      143.9228       11.09418      128.6022       8.987596  856.5177 33.35270 810.7556 28.54470 45.76208       43.89992 
1 1 1 -5  24 2  o 312.3824 52.15403 19.91468       6.103991      11.97957       11.66363      22.90767       7.163241  254.3050 91.95927 334.0587 57.27674 -79.75375      108.3381 
1 1 1 -5  24 3  o 465.9179 35.79899 42.91409       6.427974      42.38631       12.13364      43.12000       7.578865  451.4737 71.59293 465.3963 42.39784 -13.92264      83.20531 
1 1 1 -5  24 4  o 606.6799 25.90216 71.94376       6.102723      74.56921       7.745484      67.64557       9.910334  615.6526 32.51078 583.0763 44.09164 32.57635       54.78159 
1 1 1 -5  24 5  o 744.2672 24.01499 108.1955       6.941275      106.1727       8.686190      111.7697       11.54615  735.9806 30.39030 751.6578 39.69463 -15.67719      49.99233 
1 1 1 -5  24 6  o 713.5321 21.33070 99.33936       5.910803      98.94930       6.924877      100.3864       11.34526  711.4783 25.06238 711.4810 41.23724 -0.2685547E-02 48.25591 
1 1 1 -5  24 7  o 368.8622 35.44129 27.02456       5.014434      25.07883       5.939580      31.85232       9.355910  352.9634 44.30733 391.9218 63.65337 -38.95840      77.55573 
1 1 1 -5  24 8  o 515.4322 27.61200 52.19451       5.507014      60.98082       6.501251      29.87580       10.36163  556.6303 30.18764 374.9001 73.79527 181.7302       79.73102 
1 1 1 -5  24 9  o 550.1957 27.37660 59.33623       5.849581      65.08698       6.849789      43.84445       11.24258  574.7344 30.80102 459.3884 64.81816 115.3460       71.76418 
1 1 1 -5  24 10 o 158.7365 63.96103 2.749826       6.064000      2.749826       6.064000      0.000000       0.000000  158.7365 63.96103 ?        ?        0.000000       63.96103 
1 1 1 -5  24 11 o 370.1225 38.47298 27.46674       5.449242      33.64604       6.452539      12.10042       10.17527  409.1501 41.16775 244.4492 86.17098 164.7008       95.49986 
1 1 1 -5  24 12 o 279.0964 52.66767 16.27959       5.499263      15.12933       6.481932      19.23418       10.38856  265.3249 63.71024 292.7010 85.82500 -27.37613      106.8874 
1 1 1 -5  24 13 o 385.7905 43.13266 30.23593       6.351680      30.79056       7.785959      29.13243       10.98235  384.9307 53.53280 360.3650 80.50403 24.56577       96.67812 
1 1 1 -5  24 14 o 547.5214 29.23916 59.41186       6.194696      68.38567       8.805694      50.61946       8.716237  582.9880 39.12015 498.0475 45.56912 84.94046       60.05773 
1 1 1 -5  24 15 o 138.3171 61.31623 -1.083456      6.545167      17.67872       12.19491      -8.674897      7.757098  274.0892 94.47518 122.5417 58.47281 151.5475       111.1064 
1 1 1 -5  24 16 o 248.2321 77.82656 14.20383       8.347419      0.5493950      12.13100      26.48328       11.50401  188.0252 83.40810 330.4455 88.05354 -142.4203      121.2862 
1 1 1 -5  24 17 o 228.2866 62.02114 11.68610       5.641512      12.94233       7.967174      10.42283       7.989480  236.0905 76.26698 216.7667 76.36275 19.32381       107.9255 
1 1 1 -5  24 18 o 129.3464 57.15041 -0.4571446     5.640394      5.999609       7.926192      -7.081213      8.028231  184.1658 73.50355 127.3544 60.40190 56.81145       95.13759 
1 1 1 -5  24 19 o 209.2528 68.88105 10.26330       6.484736      19.22404       10.27036      4.322500       8.362496  270.0603 86.52412 174.3301 73.15487 95.73027       113.3052 
1 1 1 -5  24 20 o 143.5930 61.37621 1.892665       6.071495      1.699715       8.736070      2.072936       8.444151  161.1999 71.17980 161.0542 70.58479 0.1457367      100.2436 
1 1 1 -5  24 21 o 171.6230 63.25203 6.560458       5.555894      4.109936       7.404685      9.717311       8.404355  162.6454 68.57505 199.0188 76.78827 -36.37337      102.9513 
1 1 1 -5  24 22 o 182.5908 63.88511 8.061131       5.586277      3.564051       7.902673      12.55256       7.897706  160.0347 69.22984 215.4265 75.91942 -55.39177      102.7450 
1 1 1 -5  25 1  o 553.9661 30.78645 60.37183       6.597121      48.81823       11.60101      65.89377       8.020160  487.7994 62.68954 577.4968 35.93882 -89.69733      72.26049 
1 1 1 -5  25 2  o 211.7659 65.94946 9.134402       6.005343      10.55273       11.48609      8.600837       7.044942  243.7876 90.73065 210.7816 71.83242 33.00597       115.7236 
1 1 1 -5  25 3  o 661.5191 22.81694 85.46752       5.861756      82.44186       7.948483      89.07505       8.679178  647.9901 31.58551 673.1655 33.19929 -25.17542      45.82398 
1 1 1 -5  25 4  o 702.4801 24.22790 96.47359       6.609639      93.99135       8.331579      100.6886       10.85683  691.8953 31.00694 712.6956 39.37847 -20.80023      50.12080 
1 1 1 -5  25 5  o 245.9899 51.62771 12.54935       4.774853      16.28572       5.684209      3.592744       8.800687  280.3430 54.17031 187.5249 76.50700 92.81819       93.74297 
1 1 1 -5  25 6  o 545.0037 31.17964 58.57268       6.571908      53.53323       8.496215      66.07910       10.36932  517.4730 42.65770 573.6077 46.96027 -56.13470      63.44246 
1 1 1 -5  25 7  o 634.5501 23.46006 78.76941       5.781267      76.50438       6.774012      84.84314       11.09269  624.3950 27.93564 651.0961 44.13021 -26.70111      52.22907 
1 1 1 -5  25 8  o 162.4974 60.13248 4.419776       5.031036      8.634060       6.010001      -5.448959      9.196942  205.5760 66.22253 150.0116 68.94441 55.56439       95.59683 
1 1 1 -5  25 9  o 513.1862 56.37488 54.23530       11.05027      0.000000       0.000000      54.23530       11.05027  ?        ?        513.1862 56.37488 0.000000       56.37488 
1 1 1 -5  25 10 o 280.3996 50.88924 16.37333       5.337461      17.36318       6.163204      13.40391       10.67474  286.6144 57.37262 252.3340 88.31007 34.28038       105.3104 
1 1 1 -5  25 11 o 189.7200 62.35078 7.348790       5.314240      12.90490       6.129120      -9.478174      10.66634  244.1115 63.90358 149.4627 70.50661 94.64883       95.15698 
1 1 1 -5  25 12 o 142.1577 61.89335 -0.1829906     6.398081      -0.1829906     6.398081      0.000000       0.000000  142.1577 61.89335 ?        ?        0.000000       61.89335 
1 1 1 -5  25 13 o 350.7260 44.23827 25.29276       5.891475      26.44540       6.963077      22.38837       11.05300  355.1269 52.03149 307.4776 88.06213 47.64932       102.2850 
1 1 1 -5  25 14 o 112.6758 53.01115 -5.395091      5.956454      -0.1229616E-01 7.414790      -15.18895      10.00166  151.3850 66.25005 127.6277 62.21914 23.75731       90.88613 
1 1 1 -5  25 15 o 207.9062 69.15195 9.479534       6.529630      9.443456       7.846896      9.560760       11.77396  210.2790 75.50580 223.0835 89.39332 -12.80452      117.0141 
1 1 1 -5  25 16 o 146.4998 60.16338 2.513064       5.487164      7.616070       7.867942      -2.319255      7.656423  195.5104 74.57879 141.1815 64.12877 54.32889       98.35901 
1 1 1 -5  25 17 o 236.5737 66.50456 13.07543       6.364619      14.98199       10.88424      12.08476       7.845840  244.0603 88.74477 225.2730 75.81033 18.78729       116.7169 
1 1 1 -5  25 18 o 329.8787 46.78270 23.39502       5.825405      17.49136       7.981633      30.12446       8.521583  265.2711 74.44107 361.9840 62.90097 -96.71292      97.45771 
1 1 1 -5  25 19 f 114.7001 53.75902 -4.041415      6.027558      -13.06757      9.187181      2.780178       7.986817  119.5372 58.56409 160.9666 69.61523 -41.42936      90.97271 
1 1 1 -5  25 20 o 79.81998 39.86663 -12.00458      5.075492      -13.49488      6.717351      -10.02180      7.748167  94.99990 47.18851 112.6969 54.90137 -17.69699      72.39417 
1 1 1 -5  26 1  o 140.0839 60.54798 -0.2140169     6.034590      -11.03534      10.98467      4.463579       7.222014  150.2910 71.09695 180.0554 70.69684 -29.76439      100.2638 
1 1 1 -5  26 2  o 333.4266 55.52637 23.01646       6.937109      23.01646       6.937109      0.000000       0.000000  333.4266 55.52637 ?        ?        0.000000       55.52637 
1 1 1 -5  26 3  o 330.7907 43.15357 22.13932       5.411614      16.82990       6.692988      32.16410       9.196737  281.6723 62.78820 392.3184 62.45634 -110.6461      88.56158 
1 1 1 -5  26 4  o 788.3524 22.61387 121.5825       6.923461      126.4478       8.778573      113.5762       11.26119  802.3304 28.17362 755.7390 38.49686 46.59143       47.70494 
1 1 1 -5  26 5  o 381.2680 33.82967 28.93274       4.957031      31.45967       5.907628      22.92066       9.112313  396.1889 38.89728 324.6422 73.93100 71.54675       83.53916 
1 1 1 -5  26 6  o 137.7686 55.86924 1.889501       4.658855      0.9965419      5.515999      4.111829       8.701868  140.9004 59.28502 187.4604 76.23243 -46.56001      96.57172 
1 1 1 -5  26 7  o 268.7652 48.96344 15.00009       4.922319      12.42778       5.719621      22.34553       9.665300  240.9134 61.05570 317.0210 78.83656 -76.10753      99.71460 
1 1 1 -5  26 8  o 300.9744 45.36369 18.60486       5.137666      24.53327       6.055949      3.381065       9.704530  346.0863 46.21220 189.4511 79.10278 156.6352       91.61231 
1 1 1 -5  26 9  o 943.6880 19.90573 174.2713       7.295154      184.1605       8.631698      149.5476       13.64816  968.8651 22.94061 863.6384 40.69249 105.2266       46.71349 
1 1 1 -5  26 10 o 316.8162 45.29600 20.69051       5.414439      18.26908       6.287945      27.63495       10.64859  292.4197 57.41922 348.4415 80.33652 -56.02179      98.74677 
1 1 1 -5  26 11 f 127.7525 56.10292 -0.6262134     5.358451      4.356031       6.244496      -14.54110      10.43578  168.2413 65.83152 133.5406 64.74754 34.70074       92.33652 
1 1 1 -5  26 12 o 449.4282 34.47012 40.61724       5.970476      41.69601       6.969337      37.64206       11.57401  452.7108 40.05421 407.3176 75.96262 45.39322       85.87584 
1 1 1 -5  26 13 o 138.7425 61.16002 -0.5083318     6.422953      -0.5083318     6.422953      0.000000       0.000000  138.7425 61.16002 ?        ?        0.000000       61.16002 
1 1 1 -5  26 14 o 212.9002 69.52276 10.19756       6.611016      10.19756       6.611016      0.000000       0.000000  212.9002 69.52276 ?        ?        0.000000       69.52276 
1 1 1 -5  26 15 o 335.6594 52.61305 24.39094       6.632960      31.66132       7.773930      4.931627       12.71820  382.2672 53.85851 201.0996 87.40891 181.1677       102.6696 
1 1 1 -5  26 16 f 478.9781 32.55045 46.60079       6.018882      44.82963       8.174464      48.69799       8.895091  459.5314 46.44277 477.1255 48.68755 -17.59412      67.28601 
1 1 1 -5  26 17 f 157.2471 61.09236 4.573813       5.348370      11.54861       7.294986      -3.532658      7.864564  216.9849 73.10020 134.8309 62.59953 82.15395       96.24105 
1 1 1 -5  26 18 o 137.1680 59.92744 0.9440667      6.044426      7.164881       9.498908      -3.288759      7.835474  188.6897 78.47787 134.0162 62.30836 54.67351       100.2053 
1 1 1 -5  26 19 o 275.1301 59.74440 17.96925       6.200674      9.785226       9.715991      23.59303       8.054112  199.8325 80.80639 307.0823 69.19451 -107.2498      106.3840 
1 1 1 -5  27 1  o 514.3823 29.16199 52.27493       5.801507      55.66698       7.167469      45.83027       9.879487  528.8585 35.09719 471.2263 55.02147 57.63220       65.26236 
1 1 1 -5  27 2  o 167.1161 60.09214 5.069371       4.971848      -2.099425      6.504975      15.14059       7.710162  134.6861 60.32240 262.9767 72.94113 -128.2906      94.65305 
1 1 1 -5  27 3  o 142.3012 57.66652 2.114087       4.959649      3.711169       6.766761      0.2602174      7.290491  169.7672 67.86111 154.3016 66.62228 15.46567       95.09815 
1 1 1 -5  27 4  o 606.6722 25.23970 72.30380       5.946567      59.76616       7.865784      89.02846       9.084741  546.6823 37.27153 668.7301 35.10384 -122.0479      51.20006 
1 1 1 -5  27 5  o 372.0807 34.15230 27.69699       4.879897      28.88186       5.780058      24.75652       9.105525  378.0133 39.97956 335.5795 72.02323 42.43381       82.37543 
1 1 1 -5  27 6  o 368.9205 35.23411 27.31364       4.986678      30.74702       5.958074      19.28316       9.112050  389.8928 39.91146 292.1491 78.59357 97.74374       88.14689 
1 1 1 -5  27 7  o 196.9335 59.29452 8.238829       4.907018      6.309920       5.782259      13.20327       9.276349  181.4099 64.84993 245.0219 82.43238 -63.61195      104.8838 
1 1 1 -5  27 8  o 215.5492 58.63648 10.05253       5.038730      9.942268       5.914863      10.34422       9.620606  214.1660 65.23831 225.3558 83.20132 -11.18976      105.7284 
1 1 1 -5  27 9  o 363.8891 38.98405 26.92490       5.423391      30.49575       6.390576      17.73292       10.25317  385.4848 43.44548 274.7045 86.27519 110.7803       96.59668 
1 1 1 -5  27 10 o 527.6920 29.15618 55.42869       5.951840      54.50512       6.849961      58.27425       12.02365  520.9597 34.04481 520.9226 60.56449 0.3704834E-01  69.47738 
1 1 1 -5  27 11 o 313.6726 46.91705 20.65483       5.539704      19.87372       6.446527      22.86017       10.83203  302.4486 56.97421 305.5209 87.06732 -3.072296      104.0518 
1 1 1 -5  27 12 o 249.4436 58.11684 13.80122       5.525452      15.04638       6.344321      9.890071       11.24409  257.8476 63.72346 220.7271 87.71899 37.12050       108.4219 
1 1 1 -5  27 13 o 198.7633 69.46551 8.711815       6.603945      8.711815       6.603945      0.000000       0.000000  198.7633 69.46551 ?        ?        0.000000       69.46551 
1 1 1 -5  27 14 o 174.5710 67.63509 5.805738       6.541224      5.805738       6.541224      0.000000       0.000000  174.5710 67.63509 ?        ?        0.000000       67.63509 
1 1 1 -5  27 15 o 193.5012 69.64754 8.502898       6.680266      8.502898       6.680266      0.000000       0.000000  193.5012 69.64754 ?        ?        0.000000       69.64754 
1 1 1 -5  27 16 o 95.61839 47.05814 -10.81623      6.149093      -12.16170      7.199997      -7.189762      11.82051  103.5636 50.95918 152.0650 72.45528 -48.50142      88.58106 
1 1 1 -5  27 17 o 164.7410 65.13425 5.325700       6.170089      8.171491       10.26544      3.716125       7.720255  194.6560 81.32323 162.7577 69.37961 31.89836       106.8971 
1 1 1 -5  28 1  o 293.6295 45.35215 17.81452       5.004984      13.92742       6.687540      22.76393       7.546234  251.5804 67.18229 325.1723 62.02037 -73.59192      91.43296 
1 1 1 -5  28 2  o 306.2607 43.86857 19.29432       5.068587      16.51108       6.722988      22.95965       7.715124  274.8613 64.15180 325.7589 63.26488 -50.89761      90.09938 
1 1 1 -5  28 3  o 295.0176 47.54105 18.11407       5.261736      16.05208       7.157639      20.53860       7.761417  269.0637 68.36173 305.4630 67.24767 -36.39929      95.89356 
1 1 1 -5  28 4  o 441.7474 31.89944 38.95557       5.435688      42.16684       7.543967      35.48825       7.838963  454.6321 43.24903 413.5280 49.81433 41.10416       65.96929 
1 1 1 -5  28 5  o 125.9410 53.42433 0.6639586      4.538352      0.3559111      5.347141      1.457520       8.582289  133.2298 57.28951 168.9768 72.61802 -35.74698      92.49575 
1 1 1 -5  28 6  o 110.0132 49.76616 -1.951288      4.554125      0.8170075      5.335194      -9.384332      8.742332  135.6928 57.75489 130.1047 62.07980 5.588089       84.79110 
1 1 1 -5  28 7  o 302.0475 43.99142 18.93902       5.008706      12.18028       5.831855      37.94048       9.778387  234.3304 62.80671 418.1740 62.09783 -183.8436      88.32227 
1 1 1 -5  28 8  o 395.3530 34.02647 31.54340       5.173422      28.55882       5.974707      40.48574       10.34190  372.3672 42.05267 429.5667 63.94229 -57.19946      76.53132 
1 1 1 -5  28 9  o 172.5881 60.72858 6.034516       5.051486      6.529193       5.857714      4.599325       9.977505  180.3194 65.17478 189.8615 79.80193 -9.542145      103.0345 
1 1 1 -5  28 10 o 223.9964 59.83837 11.26074       5.304117      13.07453       6.200811      6.314377       10.23994  239.1160 65.04774 197.9209 81.82951 41.19505       104.5336 
1 1 1 -5  28 11 o 108.0604 50.57574 -4.121820      5.302808      -5.782254      6.191359      0.4498388      10.27335  112.3356 53.21057 170.8395 76.21106 -58.50393      92.94886 
1 1 1 -5  28 12 o 190.4457 68.31476 7.961523       6.421878      7.961523       6.421878      0.000000       0.000000  190.4457 68.31476 ?        ?        0.000000       68.31476 
1 1 1 -5  28 13 o 191.2140 69.07713 8.210343       6.578953      8.210343       6.578953      0.000000       0.000000  191.2140 69.07713 ?        ?        0.000000       69.07713 
1 1 1 -5  28 14 o 93.96362 45.94683 -8.938406      5.575012      -6.348093      6.509604      -16.06676      10.79874  112.1303 53.52151 126.8258 62.40604 -14.69547      82.21354 
1 1 1 -5  28 15 o 320.1423 49.10157 22.58946       5.909907      27.68190       6.890200      8.414619       11.49550  352.5799 51.87093 200.0300 84.94923 152.5499       99.53374 
1 1 1 -5  29 1  o 318.5860 39.69072 20.79745       4.804211      18.22261       6.514999      23.86634       7.112630  288.6263 60.07734 333.0629 57.04065 -44.43658      82.84276 
1 1 1 -5  29 2  o 688.4932 22.03485 93.24487       5.891661      82.23057       7.872149      107.2705       8.883326  642.2186 31.56330 733.7445 31.17473 -91.52588      44.36334 
1 1 1 -5  29 3  o 153.2091 58.32907 3.947331       4.806974      -8.120798      6.548236      18.05075       7.078912  110.1733 52.87923 283.8109 65.54828 -173.6377      84.21870 
1 1 1 -5  29 4  o 170.6015 59.66870 5.853958       4.873014      9.170667       6.802486      2.357816       6.984067  205.7523 70.58111 159.1124 66.81607 46.63983       97.19095 
1 1 1 -5  29 5  o 554.7086 25.00170 60.86069       5.385951      58.96280       6.334068      65.81526       10.23410  542.9747 30.15702 562.1573 47.31749 -19.18262      56.11052 
1 1 1 -5  29 6  o 101.5857 47.34565 -3.531533      4.568337      -4.243464      5.336309      -1.578232      8.839076  108.6135 50.80303 154.6401 69.69947 -46.02654      86.24943 
1 1 1 -5  29 7  o 232.8092 54.32130 11.94052       4.821544      11.30385       5.622133      13.71073       9.374663  223.3569 62.40527 239.2922 82.81342 -15.93530      103.6942 
1 1 1 -5  29 8  o 155.0220 58.90088 4.316585       4.895510      7.401561       5.758402      -3.725753      9.297523  185.6004 64.86614 149.0376 68.79460 36.56279       94.55323 
1 1 1 -5  29 9  o 132.2570 56.13538 1.233073       5.015168      -2.418628      5.817842      11.79584       9.894714  121.0546 55.33892 223.6171 84.01611 -102.5626      100.6037 
1 1 1 -5  29 10 o 283.4457 51.15829 17.60162       5.424156      18.00197       6.313670      16.47349       10.59848  281.2231 59.65825 250.5783 87.97732 30.64471       106.2973 
1 1 1 -5  29 11 o 153.3177 61.21479 3.873446       5.499354      15.33650       6.388499      -28.92457      10.80619  254.6847 64.51685 108.4212 54.68936 146.2635       84.57748 
1 1 1 -5  29 12 o 146.9538 62.69525 2.117056       6.313870      2.117056       6.313870      0.000000       0.000000  146.9538 62.69525 ?        ?        0.000000       62.69525 
1 1 1 -5  29 13 o 149.5930 60.67274 3.577737       5.495220      8.199011       6.398541      -9.411100      10.72717  188.1921 68.10221 139.1610 67.01949 49.03111       95.54854 
1 1 1 -5  30 1  o 287.3169 48.33401 17.61977       5.201679      20.69110       6.512661      12.20851       8.644594  307.0190 56.71077 228.6557 79.50122 78.36336       97.65529 
1 1 1 -5  30 2  o 341.8893 37.61590 24.01630       4.911808      23.01838       6.715686      25.16414       7.202532  324.8687 55.20520 338.9773 56.71627 -14.10864      79.14764 
1 1 1 -5  30 3  o 132.3322 59.90816 -1.913619      6.613990      -1.913619      6.613990      0.000000       0.000000  132.3322 59.90816 ?        ?        0.000000       59.90816 
1 1 1 -5  30 4  o 144.8608 57.69132 3.107718       4.873114      7.213230       6.832887      -1.142059      6.951902  187.2809 69.92429 138.7499 62.23592 48.53099       93.60938 
1 1 1 -5  30 5  o 321.0515 39.16182 21.39775       4.781569      20.42868       5.690537      23.72538       8.819261  308.0826 49.21838 314.9071 73.46035 -6.824493      88.42438 
1 1 1 -5  30 6  o 116.2760 51.52482 -0.6119311     4.617227      0.6576387      5.447428      -3.851124      8.701250  132.8074 57.46476 142.6451 66.09215 -9.837692      87.58065 
1 1 1 -5  30 7  o 183.9342 59.38485 7.563864       4.830909      8.060059       5.654772      6.223389       9.294332  189.4317 64.35702 188.7076 77.98512 0.7240601      101.1114 
1 1 1 -5  30 8  o 276.7277 48.60936 16.67818       5.033350      15.39330       5.872026      20.23731       9.772996  258.8090 59.64689 277.7732 83.68976 -18.96414      102.7703 
1 1 1 -5  30 9  o 490.9352 29.64959 48.76210       5.626368      39.35993       6.446207      78.83367       11.52838  434.8597 38.57074 603.9902 49.58609 -169.1305      62.82103 
1 1 1 -5  30 10 o 150.7411 59.44770 3.960409       5.127610      9.702874       6.087227      -10.06894      9.514569  201.9359 66.74923 129.3477 62.49831 72.58817       91.44123 
1 1 1 -5  31 1  o 312.4779 43.77229 20.66192       5.166092      24.63062       6.591352      14.34123       8.318273  336.1617 52.18095 240.8923 77.94096 95.26933       93.79575 
1 1 1 -5  31 2  o 185.3945 60.74811 7.672979       5.045942      12.02191       6.653235      1.784321       7.741943  224.8191 69.31770 157.7998 68.39237 67.01929       97.37792 
1 1 1 -5  31 3  o 161.5395 59.97023 5.156475       5.011879      7.550640       6.606171      1.909687       7.693072  187.0389 68.96616 157.7637 68.27645 29.27519       97.04640 
1 1 1 -5  31 4  o 207.5751 61.28838 9.961647       5.281415      10.86902       6.812529      8.594823       8.361242  213.6587 70.61349 198.5075 76.59104 15.15118       104.1751 
1 1 1 -4  0  1  o 752.9182 15.26600 110.3134       4.459621      110.3134       4.459621      110.3134       4.459621  752.9182 15.26600 752.9182 15.26600 -0.000000      0.000000 
1 1 1 -4  0  2  o 479.8425 16.02073 44.90232       2.977902      44.90232       2.977902      44.90232       2.977902  479.8425 16.02073 479.8425 16.02073 -0.000000      0.000000 
1 1 1 -4  0  3  o 920.5966 16.31275 164.8730       5.827964      164.8730       5.827964      164.8730       5.827964  920.5966 16.31275 920.5966 16.31275 -0.000000      0.000000 
1 1 1 -4  0  4  o 645.3380 16.16498 81.08507       4.045518      81.08507       4.045518      81.08507       4.045518  645.3380 16.16498 645.3380 16.16498 -0.000000      0.000000 
1 1 1 -4  0  5  o 281.2590 24.84859 15.74286       2.665436      15.74286       2.665436      15.74286       2.665436  281.2590 24.84859 281.2590 24.84859 -0.000000      0.000000 
1 1 1 -4  0  6  o 1035.532 17.76867 208.5702       7.140987      208.5702       7.140987      208.5702       7.140987  1035.532 17.76867 1035.532 17.76867 -0.000000      0.000000 
1 1 1 -4  0  7  f 739.9864 17.80377 106.5908       5.109702      106.5908       5.109702      106.5908       5.109702  739.9864 17.80377 739.9864 17.80377 -0.000000      0.000000 
1 1 1 -4  0  8  o 536.0621 20.39186 56.09390       4.231271      56.09390       4.231271      56.09390       4.231271  536.0621 20.39186 536.0621 20.39186 -0.000000      0.000000 
1 1 1 -4  0  9  o 1550.379 21.03178 467.4835       12.65790      467.4835       12.65790      467.4835       12.65790  1550.379 21.03178 1550.379 21.03178 0.000000       0.000000 
1 1 1 -4  0  10 o 731.1338 19.60160 104.1256       5.556613      104.1256       5.556613      104.1256       5.556613  731.1338 19.60160 731.1338 19.60160 -0.000000      0.000000 
1 1 1 -4  0  11 o 981.1809 19.36863 187.3613       7.373846      187.3613       7.373846      187.3613       7.373846  981.1809 19.36863 981.1809 19.36863 -0.000000      0.000000 
1 1 1 -4  0  12 o 284.0081 54.44212 17.40994       5.366100      17.40994       5.366100      17.40994       5.366100  284.0081 54.44212 284.0081 54.44212 -0.000000      0.000000 
1 1 1 -4  0  13 o 599.2022 32.55663 70.63581       7.524907      70.63581       7.524907      70.63581       7.524907  599.2022 32.55663 599.2022 32.55663 -0.000000      0.000000 
1 1 1 -4  0  14 o 105.0756 61.34581 2.641609       4.161314      2.641609       4.161314      2.641609       4.161314  105.0756 61.34581 105.0756 61.34581 -0.000000      0.000000 
1 1 1 -4  0  15 o 916.8380 21.03150 163.9209       7.479534      163.9209       7.479534      163.9209       7.479534  916.8380 21.03150 916.8380 21.03150 -0.000000      0.000000 
1 1 1 -4  0  16 o 1421.636 31.35305 395.5907       17.29097      395.5907       17.29097      395.5907       17.29097  1421.636 31.35305 1421.636 31.35305 0.000000       0.000000 
1 1 1 -4  0  17 o 86.06165 59.56938 -5.291818      6.819984      -5.291818      6.819984      -5.291818      6.819984  86.06165 59.56938 86.06165 59.56938 -0.000000      0.000000 
1 1 1 -4  0  18 o 243.8490 65.27888 13.98574       5.341953      13.98574       5.341953      13.98574       5.341953  243.8490 65.27888 243.8490 65.27888 0.000000       0.000000 
1 1 1 -4  0  19 o 980.4523 23.42941 187.5273       8.909542      187.5273       8.909542      187.5273       8.909542  980.4523 23.42941 980.4523 23.42941 -0.000000      0.000000 
1 1 1 -4  0  20 o 338.0931 48.82062 23.75953       6.021594      23.75953       6.021594      23.75953       6.021594  338.0931 48.82062 338.0931 48.82062 -0.000000      0.000000 
1 1 1 -4  0  21 o 385.3262 46.19747 30.28705       6.650212      30.28705       6.650212      30.28705       6.650212  385.3262 46.19747 385.3262 46.19747 -0.000000      0.000000 
1 1 1 -4  0  22 o 129.7098 75.95668 3.997273       6.411536      3.997273       6.411536      3.997273       6.411536  129.7098 75.95668 129.7098 75.95668 -0.000000      0.000000 
1 1 1 -4  0  23 o 150.6500 80.95479 6.469622       6.534951      6.469622       6.534951      6.469622       6.534951  150.6500 80.95479 150.6500 80.95479 0.000000       0.000000 
1 1 1 -4  0  24 o 144.0665 82.01099 5.471774       7.161003      5.471774       7.161003      5.471774       7.161003  144.0665 82.01099 144.0665 82.01099 0.000000       0.000000 
1 1 1 -4  0  25 o 799.2444 30.82983 125.1923       9.536937      125.1923       9.536937      125.1923       9.536937  799.2444 30.82983 799.2444 30.82983 -0.000000      0.000000 
1 1 1 -4  0  26 o 362.4901 67.23122 28.54076       8.507465      28.54076       8.507465      28.54076       8.507465  362.4901 67.23122 362.4901 67.23122 -0.000000      0.000000 
1 1 1 -4  0  27 o 126.7596 80.02476 1.810191       8.388398      1.810191       8.388398      1.810191       8.388398  126.7596 80.02476 126.7596 80.02476 -0.000000      0.000000 
1 1 1 -4  0  28 o 732.6251 36.70554 106.0697       10.38358      106.0697       10.38358      106.0697       10.38358  732.6251 36.70554 732.6251 36.70554 -0.000000      0.000000 
1 1 1 -4  0  29 o 501.1588 80.12780 54.98051       14.40001      54.98051       14.40001      54.98051       14.40001  501.1588 80.12780 501.1588 80.12780 -0.000000      0.000000 
1 1 1 -4  0  30 o 180.7239 96.69929 10.44676       9.286407      10.44676       9.286407      10.44676       9.286407  180.7239 96.69929 180.7239 96.69929 -0.000000      0.000000 
1 1 1 -4  0  31 o 339.6893 86.92816 28.39158       9.913092      28.39158       9.913092      28.39158       9.913092  339.6893 86.92816 339.6893 86.92816 0.000000       0.000000 
1 1 1 -4  0  32 o 225.6283 104.4352 17.11120       10.10494      17.11120       10.10494      17.11120       10.10494  225.6283 104.4352 225.6283 104.4352 0.000000       0.000000 
1 1 1 -4  0  33 o 143.1630 94.96764 2.718637       13.97233      2.718637       13.97233      2.718637       13.97233  143.1630 94.96764 143.1630 94.96764 -0.000000      0.000000 
1 1 1 -4  0  34 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -4  1  1  o 758.9960 15.35038 112.0733       4.524667      0.000000       0.000000      112.0733       4.524667  ?        ?        758.9960 15.35038 0.000000       15.35038 
1 1 1 -4  1  2  o 455.5012 11.32671 40.32824       2.003648      39.15126       2.823207      41.52268       2.844080  448.5716 16.20626 461.9773 15.85233 -13.40573      22.67023 
1 1 1 -4  1  3  o 366.8581 12.83664 26.16432       1.828848      25.16540       2.571050      27.18742       2.601990  359.0841 18.49970 373.7514 17.92647 -14.66733      25.76038 
1 1 1 -4  1  4  o 75.80003 30.45838 0.5133438      1.370996      0.8106464      1.926798      0.2084643      1.951195  90.83837 36.24507 84.30416 35.35472 6.534210       50.63261 
1 1 1 -4  1  5  o 393.8062 13.77339 30.14715       2.106452      33.00950       3.019016      27.43177       2.940481  411.8765 18.87428 374.8652 20.27368 37.01123       27.69947 
1 1 1 -4  1  6  o 340.6294 16.28764 22.56233       2.154608      15.90471       3.036003      29.31798       3.058270  284.2549 27.86024 387.6004 20.38886 -103.3454      34.52389 
1 1 1 -4  1  7  o 610.5995 12.89080 72.45713       3.056781      74.44685       4.352255      70.52013       4.294211  618.6696 18.11455 602.1186 18.36426 16.55096       25.79502 
1 1 1 -4  1  8  o 624.9778 13.27450 75.91273       3.221892      75.79866       4.539454      76.02852       4.573623  624.2327 18.72532 625.1718 18.83792 -0.9391479     26.56134 
1 1 1 -4  1  9  o 849.4597 13.23261 140.2442       4.365321      133.1940       5.999258      148.1773       6.363856  827.4545 18.66919 872.7463 18.77605 -45.29181      26.47789 
1 1 1 -4  1  10 o 688.2508 13.88645 92.08352       3.711641      95.47842       5.260159      88.71714       5.238017  700.4520 19.33715 675.1458 19.97751 25.30621       27.80335 
1 1 1 -4  1  11 o 504.5991 16.49778 49.53094       3.232957      48.17968       4.529532      50.93422       4.615875  497.2095 23.45773 511.2418 23.24875 -14.03226      33.02680 
1 1 1 -4  1  12 o 633.6985 21.91403 78.26908       5.393033      78.47517       7.536253      78.05277       7.720898  633.4031 30.63708 631.5680 31.47891 1.835083       43.92667 
1 1 1 -4  1  13 o 507.2548 24.79941 50.25509       4.885348      54.50522       6.949135      46.10193       6.869406  525.8172 34.21677 482.7875 36.91812 43.02969       50.33622 
1 1 1 -4  1  14 o 830.2752 14.87434 134.2067       4.796096      131.2966       6.765331      137.1468       6.800210  820.1157 21.24154 838.2604 20.88889 -18.14471      29.79176 
1 1 1 -4  1  15 o 1151.239 14.91568 258.1548       6.668629      261.9661       9.585338      254.5797       9.283628  1157.833 21.31737 1141.519 20.94144 16.31372       29.88267 
1 1 1 -4  1  16 o 489.6914 23.73794 46.96602       4.514332      53.72467       7.903498      43.69330       5.499757  518.4122 39.55546 470.1277 30.28422 48.28452       49.81735 
1 1 1 -4  1  17 o 227.5455 55.25770 10.91809       4.834307      12.47685       6.877558      9.395785       6.796645  241.3457 69.56522 214.2492 70.51778 27.09650       99.05592 
1 1 1 -4  1  18 o 122.3027 49.34280 1.462729       3.613858      5.968895       5.031919      -3.337373      5.193443  176.8133 60.70168 113.3969 52.00284 63.41631       79.93115 
1 1 1 -4  1  19 f 355.2967 29.76286 24.94515       4.068875      25.42408       5.783308      24.47573       5.725641  355.5202 42.74418 348.6016 43.21970 6.918579       60.78657 
1 1 1 -4  1  20 o 1090.751 16.76841 231.7103       7.103060      236.7657       10.16852      226.8929       9.926342  1100.927 23.78326 1077.747 23.71616 23.17981       33.58719 
1 1 1 -4  1  21 o 947.6559 17.76455 174.8999       6.537821      174.7589       9.140753      175.0476       9.354710  945.9254 24.88268 946.5803 25.44748 -0.6549683     35.59104 
1 1 1 -4  1  22 o 704.2100 20.77049 96.65157       5.680374      97.69316       7.918702      95.54745       8.152944  706.7827 28.84962 698.7682 30.04369 8.014465       41.65242 
1 1 1 -4  1  23 o 449.3773 30.32343 39.70084       5.261018      29.95647       7.352212      49.92605       7.531432  385.5241 50.30549 502.3214 38.91075 -116.7973      63.59787 
1 1 1 -4  1  24 o 294.2854 47.67708 17.60025       5.262462      19.03790       7.364733      16.10045       7.522257  301.6303 64.80324 276.1526 70.03693 25.47775       95.41819 
1 1 1 -4  1  25 o 264.8548 55.29377 14.58923       5.503707      12.21116       7.788547      16.96104       7.778297  242.0530 75.05998 282.0519 71.04749 -39.99890      103.3525 
1 1 1 -4  1  26 o 629.7169 37.79308 78.71767       9.199664      78.71767       9.199664      0.000000       0.000000  629.7169 37.79308 ?        ?        0.000000       37.79308 
1 1 1 -4  1  27 o 516.6859 48.64240 54.04796       9.645553      0.000000       0.000000      54.04796       9.645553  ?        ?        516.6859 48.64240 0.000000       48.64240 
1 1 1 -4  1  28 o 650.0754 28.28944 83.18870       7.141938      94.24612       10.04508      71.88510       10.15629  687.3285 37.77731 597.0642 44.11357 90.26428       58.07867 
1 1 1 -4  1  29 o 498.0509 52.88674 51.57114       10.07284      68.02965       14.07113      34.27251       14.42579  563.2929 65.54883 375.5977 97.90037 187.6953       117.8182 
1 1 1 -4  1  30 o 181.6597 71.75146 5.455865       7.480476      12.54013       13.05847      1.995696       9.126273  241.9358 95.04162 173.5155 74.72971 68.42027       120.9026 
1 1 1 -4  1  31 o 272.4938 65.86910 17.15855       6.893441      28.50700       10.09759      7.253068       9.433816  343.8352 77.47742 197.6630 79.73116 146.1721       111.1747 
1 1 1 -4  1  32 o 271.4999 73.57475 18.41696       7.950998      5.401964       13.70196      25.02434       9.762823  198.7799 88.38924 311.4259 80.22814 -112.6460      119.3701 
1 1 1 -4  1  33 o 188.4767 79.32172 7.785688       9.878326      27.83405       14.14446      -11.30351      13.80196  283.6149 101.4227 150.3636 73.25623 133.2513       125.1121 
1 1 1 -4  1  34 o 172.2222 69.54837 7.011163       7.186894      11.35656       10.45104      3.112685       9.899022  198.2446 82.37321 162.3596 73.41548 35.88501       110.3412 
1 1 1 -4  2  1  o 700.7654 10.85274 95.43792       2.953520      96.92581       4.174538      93.94665       4.179282  705.9096 15.22760 694.9561 15.48518 10.95349       21.71798 
1 1 1 -4  2  2  o 504.7798 11.34803 49.52234       2.224592      47.52248       3.122014      51.58498       3.170648  494.2432 16.26545 514.9597 15.85429 -20.71649      22.71395 
1 1 1 -4  2  3  o 742.1420 11.32507 107.0398       3.264044      106.4675       4.601534      107.6194       4.630715  739.8375 16.01542 743.8278 16.03052 -3.990234      22.65990 
1 1 1 -4  2  4  o 491.7633 12.32199 47.00177       2.353233      49.31349       3.421377      44.92631       3.241826  503.4737 17.49831 480.5628 17.37047 22.91086       24.65612 
1 1 1 -4  2  5  o 468.9315 12.99276 42.73968       2.366130      39.90866       3.325048      45.64395       3.367789  452.8934 18.90488 484.3946 17.90266 -31.50116      26.03651 
1 1 1 -4  2  6  o 291.8826 17.59425 16.62976       1.985054      14.86662       2.777483      18.47066       2.838077  274.9543 26.33345 307.0302 23.99274 -32.07590      35.62447 
1 1 1 -4  2  7  o 458.3914 14.41899 40.84398       2.566842      40.58904       3.599877      41.10765       3.661021  456.7229 20.29583 459.6213 20.51040 -2.898407      28.85476 
1 1 1 -4  2  8  o 338.2909 17.57582 22.31641       2.301099      26.51612       3.360891      18.61046       3.157148  368.2632 23.62465 307.8881 26.66762 60.37512       35.62704 
1 1 1 -4  2  9  o 558.7744 14.38956 60.69478       3.122568      63.03498       4.431069      58.38619       4.401041  569.1489 20.04724 547.7215 20.69034 21.42737       28.80941 
1 1 1 -4  2  10 o 471.9325 16.68290 43.31907       3.057590      47.66775       4.360529      39.11280       4.288541  494.7048 22.69683 447.3082 24.78420 47.39664       33.60658 
1 1 1 -4  2  11 o 679.8681 14.75410 89.88528       3.895519      91.75513       5.456001      87.94083       5.563772  686.4354 20.46665 671.9351 21.32132 14.50031       29.55474 
1 1 1 -4  2  12 o 1025.075 16.34820 204.4728       6.508091      202.0191       7.885520      209.7149       11.52562  1018.377 19.93856 1035.849 28.65102 -17.47144      34.90598 
1 1 1 -4  2  13 o 517.7757 19.87107 52.25830       3.995681      48.24590       6.568845      54.61481       5.034091  494.4470 34.42379 528.7906 24.51373 -34.34360      42.26015 
1 1 1 -4  2  14 o 203.6785 39.27855 8.469681       2.994301      15.55800       4.248838      1.475706       4.220467  277.5618 40.61902 130.2849 53.04804 147.2768       66.81317 
1 1 1 -4  2  15 o 496.2455 19.66455 48.08094       3.789733      51.19845       5.288622      44.79055       5.433290  510.2087 26.78477 476.4578 29.50890 33.75095       39.85221 
1 1 1 -4  2  16 o 83.79292 40.06695 -4.866269      3.682089      -8.800627      6.541751      -3.041811      4.454756  110.0726 52.83680 104.2625 47.94235 5.810188       71.34561 
1 1 1 -4  2  17 o 378.7635 30.88449 28.43885       4.503386      25.88778       5.453609      33.90708       7.984471  358.8026 39.80919 406.8588 51.70030 -48.05618      65.25099 
1 1 1 -4  2  18 o 745.1439 17.71292 108.2848       5.125761      107.5385       7.131017      109.0826       7.372872  741.0342 24.77908 746.1639 25.44336 -5.129639      35.51574 
1 1 1 -4  2  19 o 486.0980 22.94204 46.17375       4.330956      48.02940       6.149522      44.34754       6.100563  493.2335 32.28222 473.5961 33.38279 19.63739       46.43869 
1 1 1 -4  2  20 f 742.0783 18.63206 107.3182       5.369560      107.7203       7.538765      106.9041       7.649862  742.1637 26.15607 739.2474 26.64623 2.916260       37.33848 
1 1 1 -4  2  21 o 989.4841 17.52451 190.6577       6.734149      204.5074       9.810643      178.3185       9.260223  1023.360 24.68546 955.5316 24.95447 67.82806       35.10125 
1 1 1 -4  2  22 o 593.3330 23.61279 68.68491       5.440937      87.32422       7.927230      52.08318       7.481403  667.9448 30.55997 513.4394 37.78578 154.5054       48.59708 
1 1 1 -4  2  23 o 555.7588 25.18017 60.30709       5.434667      51.31824       7.469723      70.41675       7.921737  509.5172 38.02397 598.1937 34.24191 -88.67648      51.16962 
1 1 1 -4  2  24 o 635.1265 24.31006 78.79035       5.996173      74.79088       8.236445      83.30025       8.746235  616.0192 34.56813 650.1680 34.76513 -34.14880      49.02622 
1 1 1 -4  2  25 o 382.7517 39.08382 29.24132       5.728037      27.88107       7.915082      30.73708       8.299953  368.0590 57.23408 386.9041 56.94178 -18.84512      80.73479 
1 1 1 -4  2  26 o 762.2633 23.91341 113.6829       7.079043      112.0354       9.750964      115.5190       10.29362  754.0551 33.29787 765.2326 34.63752 -11.17755      48.04691 
1 1 1 -4  2  27 o 321.1029 52.09924 21.28268       6.274209      30.96030       8.603447      10.28913       9.169744  385.6741 59.34363 229.3962 81.70155 156.2779       100.9793 
1 1 1 -4  2  28 o 335.2927 60.82052 23.81572       7.627929      19.14000       8.921265      36.52655       14.70920  293.6794 77.20255 395.9890 96.52530 -102.3096      123.6017 
1 1 1 -4  2  29 o 208.3557 74.02496 8.830456       7.523103      12.12215       8.981363      1.089808       13.77276  236.0990 81.09463 202.9679 89.51093 33.13116       120.7831 
1 1 1 -4  2  30 o 326.1372 63.59176 23.56722       7.764981      11.88103       13.68132      29.12048       9.431173  239.8851 96.27882 358.8756 70.18417 -118.9905      119.1446 
1 1 1 -4  2  31 o 336.4688 77.57424 27.40039       9.929097      0.000000       0.000000      27.40039       9.929097  ?        ?        336.4688 77.57424 0.000000       77.57424 
1 1 1 -4  2  32 o 123.1443 58.79361 -7.138733      7.865663      -11.34705      12.67405      -4.502486      10.03122  149.0002 72.02737 148.2583 69.44419 0.7418671      100.0522 
1 1 1 -4  2  33 o 372.3355 63.89014 33.55979       8.905724      18.39866       11.15077      60.26460       14.79905  244.5417 89.68664 469.0880 84.33711 -224.5463      123.1115 
1 1 1 -4  2  34 o 323.5866 80.86920 30.37334       10.13420      25.52911       15.32937      34.13417       13.50686  248.4414 101.1224 307.1942 99.30977 -58.75279      141.7327 
1 1 1 -4  3  1  o 532.7875 11.21041 55.16436       2.319548      52.34669       3.221975      58.19585       3.341989  518.7845 15.99216 547.0159 15.73175 -28.23138      22.43295 
1 1 1 -4  3  2  o 628.5262 11.14983 76.76966       2.721570      76.32110       3.857916      77.21405       3.839911  626.4330 15.85806 630.0975 15.69226 -3.664490      22.30975 
1 1 1 -4  3  3  o 586.0700 11.47260 66.74844       2.611194      68.85447       3.767434      64.80145       3.622406  595.0037 16.30414 577.2343 16.15910 17.76947       22.95521 
1 1 1 -4  3  4  o 223.9978 19.21624 9.834906       1.655446      8.964937       2.410472      10.61153       2.277492  212.2460 30.08614 231.9245 25.71920 -19.67850      39.58097 
1 1 1 -4  3  5  f 438.6006 18.88428 37.42515       3.216605      37.42515       3.216605      0.000000       0.000000  438.6006 18.88428 ?        ?        0.000000       18.88428 
1 1 1 -4  3  6  o 439.4918 14.12858 37.54401       2.411445      36.39825       3.390693      38.71665       3.430247  432.5051 20.18688 446.0843 19.80070 -13.57913      28.27681 
1 1 1 -4  3  7  o 717.6808 12.73269 100.0949       3.548785      99.66921       5.036507      100.5147       5.001159  715.8564 18.11655 718.8995 17.91326 -3.043030      25.47733 
1 1 1 -4  3  8  o 976.9799 12.99481 185.5000       4.930415      184.7898       6.960793      186.2150       6.984587  974.6866 18.38932 978.4389 18.38142 -3.752258      26.00084 
1 1 1 -4  3  9  o 909.9276 13.15145 160.9254       4.647382      165.7847       6.681014      156.3698       6.468900  923.1212 18.63613 896.5313 18.57963 26.58990       26.31554 
1 1 1 -4  3  10 o 512.7580 15.85683 51.13228       3.157597      52.96051       4.500274      49.35946       4.431552  521.4557 22.22253 503.3844 22.66878 18.07126       31.74452 
1 1 1 -4  3  11 o 1124.895 16.24817 246.1673       7.098134      246.9447       8.709889      244.6302       12.24809  1126.143 19.91549 1119.289 28.17723 6.854248       34.50483 
1 1 1 -4  3  12 o 727.1494 17.05170 102.9194       4.815256      99.75481       5.838519      109.6503       8.514845  715.4338 21.01383 748.7869 29.28131 -33.35309      36.04131 
1 1 1 -4  3  13 o 251.9967 59.00901 13.25391       5.673201      13.25391       5.673201      0.000000       0.000000  251.9967 59.00901 ?        ?        0.000000       59.00901 
1 1 1 -4  3  14 o 482.2269 28.86347 45.78248       5.380559      0.000000       0.000000      45.78248       5.380559  ?        ?        482.2269 28.86347 0.000000       28.86347 
1 1 1 -4  3  15 o 130.8101 50.33206 2.400779       3.603030      0.4988244      6.305273      3.322952       4.390460  146.7707 62.63571 147.3853 55.83236 -0.6146393     83.90760 
1 1 1 -4  3  16 o 470.3896 25.45592 43.51598       4.632926      41.91189       8.029992      44.31637       5.672201  455.1248 46.06589 473.2665 31.03338 -18.14172      55.54401 
1 1 1 -4  3  17 o 452.3530 26.58981 40.28685       4.650574      48.03967       5.791546      26.21311       7.803137  493.1057 30.39120 354.4051 58.75249 138.7007       66.14742 
1 1 1 -4  3  18 o 495.2966 26.15472 48.20514       5.013037      46.87629       6.128861      50.89123       8.713711  486.8085 32.60703 503.2481 45.06253 -16.43958      55.62239 
1 1 1 -4  3  19 o 520.4331 22.13425 52.89483       4.473607      49.54819       6.166246      56.61382       6.500229  501.1992 31.84507 535.9946 31.36442 -34.79538      44.69715 
1 1 1 -4  3  20 o 533.2960 22.70379 55.51622       4.702131      51.40348       6.476089      60.10191       6.838321  510.6847 32.82761 552.5602 32.00409 -41.87558      45.84663 
1 1 1 -4  3  21 o 826.3319 18.49863 133.0029       5.936385      121.4950       8.040819      146.7904       8.801253  788.5301 26.25754 866.7607 26.14673 -78.23065      37.05550 
1 1 1 -4  3  22 o 112.7244 49.99224 -1.398080      4.355364      -1.425104      5.999589      -1.367973      6.332735  134.3241 59.16642 138.5909 60.92347 -4.266891      84.92547 
1 1 1 -4  3  23 o 712.8120 21.72249 99.07129       6.013297      102.3898       8.388551      95.56342       8.624530  723.3222 29.86257 698.4304 31.79686 24.89178       43.62125 
1 1 1 -4  3  24 o 836.3809 20.46546 136.4124       6.647429      134.9185       9.202051      138.0428       9.613188  830.1245 28.54391 839.4490 29.48798 -9.324585      41.04017 
1 1 1 -4  3  25 o 387.2514 37.61552 29.87457       5.585649      34.03484       7.782646      25.45517       8.021365  409.8589 49.92668 349.8477 61.27211 60.01126       79.03762 
1 1 1 -4  3  26 o 231.8047 63.76065 11.35754       5.919347      7.926650       8.260295      14.97911       8.486739  210.0873 77.17068 263.9876 77.61979 -53.90031      109.4538 
1 1 1 -4  3  27 o 386.1939 42.35489 30.05783       6.248138      21.30586       8.455161      40.58678       9.273887  314.1837 70.97137 444.4281 54.89887 -130.2444      89.72637 
1 1 1 -4  3  28 o 152.6981 65.98919 0.1871585      7.165536      4.520861       8.498475      -10.47004      13.32702  187.4567 75.65392 168.8940 79.40733 18.56274       109.6770 
1 1 1 -4  3  29 o 456.7389 54.78617 43.74625       9.523855      43.74625       9.523855      0.000000       0.000000  456.7389 54.78617 ?        ?        0.000000       54.78617 
1 1 1 -4  3  30 o 253.5573 73.70249 14.91815       7.690892      13.26862       12.91803      15.82387       9.572236  244.2318 94.92918 257.5413 83.63488 -13.30945      126.5162 
1 1 1 -4  3  31 o 175.9146 72.43721 4.683139       7.980925      -13.92381      13.95075      13.73522       9.730477  155.8258 75.38509 236.8001 84.18127 -80.97427      113.0018 
1 1 1 -4  3  32 o 258.6177 85.19142 18.19551       9.918732      0.000000       0.000000      18.19551       9.918732  ?        ?        258.6177 85.19142 0.000000       85.19142 
1 1 1 -4  3  33 f 339.5917 56.92088 26.95798       7.241179      29.09298       10.36270      24.92073       10.12266  322.6923 82.40147 294.2704 84.27309 28.42191       117.8641 
1 1 1 -4  3  34 o 116.6819 56.75418 -8.527924      8.190683      -21.62610      10.51397      11.69287       13.06353  110.4602 55.48404 198.6881 87.41821 -88.22789      103.5395 
1 1 1 -4  4  1  o 168.5939 20.65867 5.615084       1.324307      4.382281       1.852291      6.904188       1.894115  146.8810 33.24705 186.2715 26.96845 -39.39052      42.80962 
1 1 1 -4  4  2  o 153.8259 23.30305 4.712189       1.348503      4.177608       1.859881      5.304689       1.958045  143.3640 33.93266 161.9933 32.25778 -18.62924      46.81869 
1 1 1 -4  4  3  o 822.1461 11.54468 131.3445       3.686030      129.0442       5.162420      133.7369       5.264754  814.6194 16.31814 829.2969 16.34707 -14.67749      23.09780 
1 1 1 -4  4  4  o 489.9974 14.17236 46.67058       2.696894      46.53742       3.301599      46.93757       4.675147  489.1682 17.37954 490.8817 24.52395 -1.713593      30.05782 
1 1 1 -4  4  5  o 1162.300 12.75634 262.5374       5.758008      263.4372       8.190475      261.6581       8.096444  1163.803 18.12181 1159.882 17.97432 3.920776       25.52403 
1 1 1 -4  4  6  o 257.6754 19.88653 12.99455       1.974636      17.92078       2.893289      8.699243       2.701664  302.3187 24.86368 208.3163 34.60938 94.00235       42.61469 
1 1 1 -4  4  7  o 806.4283 12.73961 126.3809       3.989789      126.6886       5.646155      126.0740       5.638680  807.0829 18.01385 805.1215 18.03383 1.961426       25.48957 
1 1 1 -4  4  8  o 567.5111 14.26288 62.60495       3.143472      62.03599       4.413116      63.19094       4.478693  564.6290 20.12585 569.8541 20.23763 -5.225098      28.54140 
1 1 1 -4  4  9  o 556.1924 14.83720 60.14481       3.204831      62.19175       4.609325      58.22919       4.459040  565.2190 20.99871 546.9164 20.99387 18.30261       29.69324 
1 1 1 -4  4  10 o 143.4421 42.37891 4.102951       2.524494      1.614471       3.600264      6.509941       3.540825  124.6372 49.60332 178.9450 49.35197 -54.30781      69.97219 
1 1 1 -4  4  11 o 1007.487 16.17323 197.4802       6.327971      198.2807       7.804121      195.9436       10.81235  1009.021 19.91572 1001.658 27.79539 7.362976       34.19385 
1 1 1 -4  4  12 o 885.3544 16.59490 152.5788       5.705843      153.6660       6.936042      150.3029       10.03548  887.9948 20.11284 876.4216 29.48471 11.57312       35.69138 
1 1 1 -4  4  13 o 199.3137 45.52703 8.192176       3.446743      13.56782       5.812409      5.276604       4.280581  254.5396 59.81250 166.5471 55.99664 87.99242       81.93387 
1 1 1 -4  4  14 o 144.5315 47.63567 4.019882       3.101042      4.407411       4.360667      3.623385       4.410834  157.7056 56.32301 150.6342 56.19262 7.071381       79.56062 
1 1 1 -4  4  15 o 779.2094 18.69208 118.5077       5.656397      110.9165       9.124083      123.2464       7.208833  750.3619 31.31053 793.4807 23.39379 -43.11877      39.08477 
1 1 1 -4  4  16 o 544.4710 23.17319 58.03690       4.899914      70.79656       8.457012      51.58907       6.011795  596.6484 36.67580 510.9618 30.43408 85.68665       47.65866 
1 1 1 -4  4  17 o 649.8599 21.05133 82.53478       5.312846      84.06152       6.454269      79.32628       9.356553  654.8901 25.37761 631.3353 38.34326 23.55475       45.98074 
1 1 1 -4  4  18 o 556.4783 23.76187 60.57302       5.135195      66.18824       6.388132      50.31713       8.633306  580.8083 28.32129 500.6704 44.87777 80.13785       53.06704 
1 1 1 -4  4  19 o 313.0135 34.93190 19.51638       4.173903      16.88367       5.744895      22.45982       6.074463  285.9748 53.70010 332.5081 48.46621 -46.53326      72.33723 
1 1 1 -4  4  20 o 450.6974 26.04169 39.83810       4.538661      47.04152       6.452926      32.78579       6.384888  488.2069 34.25177 405.5455 41.10822 82.66141       53.50765 
1 1 1 -4  4  21 o 282.7506 42.27262 16.10027       4.499367      17.15260       6.164442      14.90047       6.582217  288.3626 57.06637 267.0195 64.25341 21.34314       85.93644 
1 1 1 -4  4  22 o 182.8356 57.79160 6.607091       4.593739      8.848299       6.354266      4.153305       6.648792  211.3444 68.09406 175.5053 68.13531 35.83908       96.32871 
1 1 1 -4  4  23 o 468.7802 28.86592 43.14760       5.229569      46.71106       7.262524      39.31017       7.536540  485.7224 38.82545 443.9795 44.30157 41.74286       58.90709 
1 1 1 -4  4  24 o 715.3911 22.61269 99.90769       6.282374      101.0286       8.602645      98.62669       9.196272  717.7498 30.86249 708.5640 33.41987 9.185730       45.49045 
1 1 1 -4  4  25 o 461.1021 32.06473 41.99493       5.706142      40.52227       7.905899      43.59629       8.244131  448.9194 45.99710 465.7223 46.19089 -16.80289      65.18690 
1 1 1 -4  4  26 o 318.7619 49.40640 20.80721       5.918214      28.94940       8.207932      11.99030       8.541254  373.7405 58.46649 240.5903 79.04531 133.1502       98.31831 
1 1 1 -4  4  27 o 737.0362 34.32962 107.3687       9.826204      107.3687       9.826204      0.000000       0.000000  737.0362 34.32962 ?        ?        0.000000       34.32962 
1 1 1 -4  4  28 f 1003.782 46.41982 203.3766       18.09550      0.000000       0.000000      203.3766       18.09550  ?        ?        1003.782 46.41982 0.000000       46.41982 
1 1 1 -4  4  29 o 158.8888 64.66492 2.985894       6.267684      10.29921       8.622995      -5.205641      9.126069  221.5677 79.19481 146.8942 67.92868 74.67348       104.3366 
1 1 1 -4  4  30 o 192.5473 73.09841 7.185290       7.536072      -4.337632      12.39904      13.93573       9.490148  171.9594 79.39951 243.4565 83.36967 -71.49715      115.1294 
1 1 1 -4  4  31 o 437.3918 61.64629 42.86868       10.18098      0.000000       0.000000      42.86868       10.18098  ?        ?        437.3918 61.64629 0.000000       61.64629 
1 1 1 -4  4  32 o 196.7248 71.52104 9.138160       7.068944      6.816264       9.992250      11.46447       10.00175  189.9617 79.85334 214.3531 83.46991 -24.39146      115.5153 
1 1 1 -4  4  33 o 158.5197 66.72855 4.214523       6.993167      -16.79996      9.888905      25.23689       9.890759  115.4387 57.32619 297.5309 82.64610 -182.0922      100.5816 
1 1 1 -4  4  34 o 125.4623 59.37859 -3.788574      7.678177      1.846085       9.840418      -12.55819      12.27637  156.6472 71.74323 134.6208 66.29900 22.02641       97.68647 
1 1 1 -4  5  1  o 159.0502 23.41062 5.030628       1.402768      5.946118       1.978672      4.105559       1.988995  172.0199 30.74725 142.2096 35.98504 29.81032       47.33198 
1 1 1 -4  5  2  o 1004.758 11.95855 196.1709       4.666246      196.4460       6.607030      195.8972       6.591136  1005.097 16.92662 1003.694 16.90951 1.403503       23.92576 
1 1 1 -4  5  3  o 395.8639 13.28110 30.45581       2.041775      30.87164       2.874211      30.03220       2.900986  398.3905 18.57726 392.9209 19.01134 5.469604       26.58092 
1 1 1 -4  5  4  o 1197.885 12.81651 278.8560       5.962287      277.8356       8.421038      279.8816       8.442901  1195.205 18.14241 1199.600 18.12288 -4.394775      25.64344 
1 1 1 -4  5  5  o 1148.735 12.82609 256.4398       5.721925      262.3833       8.240039      250.9050       7.951710  1161.492 18.26774 1135.827 18.02687 25.66541       25.66473 
1 1 1 -4  5  6  o 1125.507 12.96224 246.1802       5.665737      250.1818       8.120322      242.3842       7.908980  1134.139 18.43652 1116.344 18.24292 17.79480       25.93665 
1 1 1 -4  5  7  o 466.4951 14.83463 42.30375       2.687521      43.61943       3.785090      40.96608       3.816563  473.4483 20.58617 458.7817 21.42093 14.66660       29.70937 
1 1 1 -4  5  8  o 669.5150 13.62091 87.12874       3.541558      90.69412       5.036325      83.64103       4.981170  682.7477 18.99440 655.6230 19.56362 27.12469       27.26760 
1 1 1 -4  5  9  o 120.5221 41.42663 2.597907       2.343989      5.164599       3.334206      0.8981090E-01  3.295927  161.3976 48.94010 107.1545 45.49566 54.24311       66.82056 
1 1 1 -4  5  10 o 232.9155 42.02213 10.97841       3.661206      10.97841       3.661206      0.000000       0.000000  232.9155 42.02213 ?        ?        0.000000       42.02213 
1 1 1 -4  5  11 o 505.3712 19.65712 49.74609       3.857965      52.69146       4.733563      43.91860       6.658231  519.7784 23.44995 471.6806 36.63564 48.09781       43.49793 
1 1 1 -4  5  12 o 279.8994 39.58400 15.73307       4.182769      0.000000       0.000000      15.73307       4.182769  ?        ?        279.8994 39.58400 0.000000       39.58400 
1 1 1 -4  5  13 o 169.9570 49.64569 5.888343       3.481951      5.215091       5.745092      6.279229       4.377565  175.3840 64.36791 177.5356 56.44735 -2.151642      85.61268 
1 1 1 -4  5  14 o 563.9903 18.62132 62.05953       4.078589      59.24258       5.896763      64.64320       5.647314  548.7719 27.75927 574.4553 25.31382 -25.68335      37.56816 
1 1 1 -4  5  15 o 114.6273 48.36023 0.4358119      3.686347      -11.63082      6.492677      6.176098       4.478138  101.6619 49.68438 175.9532 57.20757 -74.29125      75.77100 
1 1 1 -4  5  16 o 725.3881 17.05075 102.6216       4.803326      109.1968       6.818743      96.14507       6.767404  746.7981 23.51111 700.4009 24.87983 46.39716       34.23125 
1 1 1 -4  5  17 o 420.9144 28.16858 34.93734       4.577968      36.84795       5.551795      30.87818       8.092179  431.0002 33.43023 387.0887 55.41125 43.91150       64.71466 
1 1 1 -4  5  18 o 918.5970 19.34241 164.6162       6.900231      161.5469       8.290056      171.5383       12.44968  908.9917 23.48386 933.0475 34.35788 -24.05585      41.61677 
1 1 1 -4  5  19 o 275.6340 39.33728 15.28423       4.091349      17.83255       5.657744      12.49090       5.923482  294.9889 51.24620 243.9858 62.29799 51.00311       80.66730 
1 1 1 -4  5  20 o 343.3888 33.94963 23.36816       4.468106      25.47307       6.313470      21.25604       6.324257  355.5905 46.85968 322.8683 52.22068 32.72220       70.16287 
1 1 1 -4  5  21 o 668.6641 20.77214 87.14383       5.394079      89.40160       7.481325      84.69939       7.784461  676.1606 28.49054 657.8076 30.47205 18.35303       41.71638 
1 1 1 -4  5  22 o 389.4694 33.32620 29.94099       4.992114      29.71827       6.921052      30.18253       7.207487  384.8761 47.30002 387.4712 48.99273 -2.595123      68.09978 
1 1 1 -4  5  23 o 154.8858 58.87104 3.502437       4.891694      0.3722501      6.765584      6.931280       7.080989  152.5548 64.98740 198.6937 71.68196 -46.13887      96.75570 
1 1 1 -4  5  24 o 375.2379 37.61425 28.02203       5.407547      28.77476       7.423353      27.17102       7.893096  376.1972 52.21913 363.5664 57.84069 12.63074       77.92550 
1 1 1 -4  5  25 o 344.2606 43.32641 23.89147       5.664222      29.25797       7.889769      18.18369       8.136781  377.4743 55.47552 291.2349 72.28161 86.23935       91.11622 
1 1 1 -4  5  26 f 380.3761 41.77187 29.08378       6.068970      16.46442       8.191608      44.43893       9.036029  275.9940 74.63248 467.8450 50.53609 -191.8510      90.13270 
1 1 1 -4  5  27 o 160.1587 66.91904 1.774545       6.952199      0.2833021      8.240255      5.457785       12.95035  164.0323 70.82635 221.1586 91.77824 -57.12631      115.9294 
1 1 1 -4  5  28 o 164.7388 65.32063 3.680808       6.221988      -2.612570      8.383116      11.39974       9.284150  151.1659 68.02953 234.0613 82.33256 -82.89540      106.8020 
1 1 1 -4  5  29 o 610.8701 34.99242 74.84754       8.266832      83.23721       13.89690      70.25274       10.28440  627.7306 57.64967 585.3032 45.60490 42.42737       73.50708 
1 1 1 -4  5  30 o 124.0146 57.30966 -3.754975      6.479642      2.042245       9.195798      -9.471701      9.131733  172.7694 74.70915 131.8228 63.05126 40.94652       97.75950 
1 1 1 -4  5  31 o 147.6352 68.41307 -3.824148      9.327530      0.000000       0.000000      -3.824148      9.327530  ?        ?        147.6352 68.41307 0.000000       68.41307 
1 1 1 -4  5  32 o 314.8150 59.45783 22.98462       7.002865      7.090096       9.697695      40.30416       10.12309  189.2521 79.05202 412.2762 65.41022 -223.0241      102.6047 
1 1 1 -4  5  33 o 144.1333 62.89102 2.048069       6.638317      5.703244       9.561189      -1.353759      9.223889  175.3076 75.99241 146.6396 67.98006 28.66794       101.9614 
1 1 1 -4  5  34 o 112.0542 54.27697 -7.267433      7.288593      -4.744966      9.642741      -10.62936      11.13222  135.5513 64.82257 131.3704 64.38370 4.180893       91.36316 
1 1 1 -4  6  1  o 570.3992 12.16557 63.22063       2.694879      63.88503       3.202797      61.60987       4.986907  573.3089 14.38509 562.5916 22.82496 10.71735       26.97981 
1 1 1 -4  6  2  o 509.2751 12.22939 50.39771       2.418719      48.34113       3.365685      52.59416       3.478261  498.5957 17.38189 520.0734 17.22145 -21.47769      24.46852 
1 1 1 -4  6  3  o 656.6595 11.92144 83.78602       3.040165      84.46763       4.299555      83.10447       4.299329  659.1060 16.79733 653.7589 16.93383 5.347168       23.85172 
1 1 1 -4  6  4  o 1108.091 12.64164 238.6054       5.440096      241.9833       7.765830      235.3506       7.623071  1115.476 17.92667 1100.090 17.84324 15.38611       25.29322 
1 1 1 -4  6  5  o 531.7842 13.16724 54.95849       2.719307      56.42684       3.841624      53.48393       3.849750  538.6270 18.36534 524.3674 18.90466 14.25952       26.35662 
1 1 1 -4  6  6  o 973.5661 12.75215 184.1979       4.821439      176.6286       6.651611      192.5778       6.998713  952.9678 17.97300 995.0510 18.11110 -42.08313      25.51550 
1 1 1 -4  6  7  o 357.4546 17.97584 24.91639       2.487429      25.17135       3.546153      24.66944       3.490029  358.5010 25.63983 354.9078 25.49107 3.593201       36.15516 
1 1 1 -4  6  8  o 686.2119 13.62274 91.53550       3.630368      95.31399       5.168518      87.85597       5.100390  699.8690 19.01609 671.8895 19.54688 27.97943       27.27073 
1 1 1 -4  6  9  o 815.2634 13.71613 129.2200       4.342676      127.3304       6.057877      131.2176       6.228624  808.7935 19.28656 821.0205 19.53485 -12.22699      27.45144 
1 1 1 -4  6  10 o 556.4881 18.33828 60.28474       3.963167      62.90142       4.963130      55.68029       6.583706  568.0751 22.49686 532.5070 31.98416 35.56812       39.10365 
1 1 1 -4  6  11 o 400.3380 23.56170 31.38019       3.647055      32.78682       4.466997      28.56801       6.316078  408.5080 28.33214 377.9707 43.84332 30.53726       52.20103 
1 1 1 -4  6  12 o 658.0441 16.28180 84.32242       4.160882      88.22999       6.015165      80.73714       5.761765  672.1620 23.04335 642.9827 23.07429 29.17938       32.61010 
1 1 1 -4  6  13 o 412.2927 24.92221 33.38576       3.971679      43.92311       6.872643      28.10209       4.866599  469.8752 37.98782 376.2959 33.65719 93.57928       50.75314 
1 1 1 -4  6  14 o 706.5294 19.06940 97.43662       5.232331      113.2871       10.05823      91.55589       6.126550  757.4832 34.19168 684.0543 23.06202 73.42883       41.24231 
1 1 1 -4  6  15 o 493.2049 24.03791 47.64565       4.604178      48.66532       7.821022      47.10487       5.695724  492.7444 41.25037 488.2906 30.18405 4.453857       51.11428 
1 1 1 -4  6  16 o 547.4664 20.01552 58.54078       4.255517      59.79629       5.921705      57.19996       6.119591  551.1483 27.75523 538.5797 29.36888 12.56860       40.40896 
1 1 1 -4  6  17 o 177.1498 55.11093 6.345251       4.194884      0.5517022E-01  5.019287      20.91663       7.639488  129.7610 55.64326 314.4479 64.71638 -184.6870      85.34859 
1 1 1 -4  6  18 o 375.5178 33.72190 27.96054       4.865373      30.25874       5.968016      23.40624       8.401300  389.1677 40.06033 333.2049 67.24261 55.96280       78.27132 
1 1 1 -4  6  19 o 249.6869 46.24439 12.74204       4.319037      18.05464       6.034002      7.160446       6.184873  296.1506 54.47163 195.0296 67.27795 101.1211       86.56490 
1 1 1 -4  6  20 o 312.8693 38.25637 19.53751       4.551473      11.91332       6.153733      28.74560       6.762802  239.0741 64.70204 378.1936 47.06321 -139.1195      80.00813 
1 1 1 -4  6  21 o 185.1501 56.65477 6.870767       4.454080      4.772474       5.924783      9.597904       6.754496  174.3094 65.10607 219.3274 70.15761 -45.01793      95.71254 
1 1 1 -4  6  22 o 947.0519 18.70433 174.6758       6.879295      182.1441       9.651997      166.9650       9.807452  965.8107 25.73340 924.3638 27.32029 41.44696       37.53140 
1 1 1 -4  6  23 o 291.8989 47.56865 17.30523       5.206659      26.35972       7.338577      8.127549       7.388332  359.8148 54.19926 209.3783 73.45831 150.4364       91.28901 
1 1 1 -4  6  24 o 452.0318 32.63252 40.35052       5.690081      48.00133       7.876441      31.99922       8.229119  490.7662 41.72210 395.9115 55.00765 94.85471       69.04039 
1 1 1 -4  6  25 o 392.1141 39.09591 30.71835       5.874116      24.21709       7.976213      38.42329       8.683261  340.0788 62.70358 434.4553 52.53172 -94.37656      81.80049 
1 1 1 -4  6  26 o 419.0779 39.04214 35.10901       6.281006      39.20729       8.457966      30.07004       9.378564  439.0092 50.53141 377.4669 66.40226 61.54224       83.44270 
1 1 1 -4  6  27 o 306.2891 64.01798 20.03179       7.369628      20.41622       8.746783      19.09108       13.68259  305.3016 74.44268 292.8506 100.1059 12.45108       124.7513 
1 1 1 -4  6  28 o 208.4461 71.76773 8.906219       7.036269      9.960409       11.58114      8.289392       8.858768  232.0966 89.97473 211.1102 79.46133 20.98633       120.0398 
1 1 1 -4  6  29 o 226.7605 68.05074 11.44446       6.471129      5.123242       8.911998      18.49418       9.411539  189.1782 77.06354 280.5940 81.52260 -91.41580      112.1816 
1 1 1 -4  6  30 o 380.6272 56.12778 31.42345       8.047706      59.56398       14.23120      18.19378       9.757752  507.9775 74.33886 271.6007 83.98042 236.3768       112.1560 
1 1 1 -4  6  31 o 120.8588 59.35834 -15.06339      9.622816      0.000000       0.000000      -15.06339      9.622816  ?        ?        120.8588 59.35834 0.000000       59.35834 
1 1 1 -4  6  32 f 161.2674 67.27151 4.136059       7.009251      -13.41541      9.820201      22.36383       10.00761  123.0699 60.34696 283.3068 84.53798 -160.2369      103.8673 
1 1 1 -4  6  33 o 128.5197 60.28311 -3.266068      7.604551      3.796360       9.564054      -15.40612      12.53936  166.2416 73.88705 133.9271 66.15538 32.31456       99.17576 
1 1 1 -4  7  1  o 1695.660 15.15883 558.9009       9.982343      553.1048       11.46338      577.0851       20.30448  1686.548 17.50193 1720.281 30.39237 -33.73303      35.07155 
1 1 1 -4  7  2  o 1186.394 12.83259 273.5200       5.912500      289.6660       8.769506      260.0642       8.005676  1220.403 18.50308 1156.431 17.82586 63.97229       25.69290 
1 1 1 -4  7  3  o 301.8104 16.95362 17.76741       1.979074      18.10480       2.789582      17.42551       2.808177  304.0154 23.81787 298.1488 24.46862 5.866577       34.14681 
1 1 1 -4  7  4  o 683.1720 12.35548 90.69447       3.278065      89.05061       4.569552      92.43737       4.705190  676.7059 17.38784 689.4432 17.57319 -12.73724      24.72153 
1 1 1 -4  7  5  o 746.8198 12.50237 108.3864       3.626070      109.2222       5.151455      107.5656       5.104937  749.3950 17.70073 743.6920 17.67540 5.703064       25.01471 
1 1 1 -4  7  6  o 1118.807 13.11818 243.2835       5.699763      242.0488       8.026478      244.5395       8.095328  1115.448 18.52881 1121.165 18.59246 -5.717041      26.24874 
1 1 1 -4  7  7  o 825.9893 13.09215 132.6122       4.199654      133.7143       5.984172      131.5426       5.895241  828.9915 18.58772 822.2431 18.46177 6.748352       26.19810 
1 1 1 -4  7  8  o 192.3082 33.23752 7.435156       2.392509      11.98397       3.503101      3.458462       3.275402  244.4582 38.14493 140.1254 48.92435 104.3328       62.03731 
1 1 1 -4  7  9  o 521.9432 16.11086 52.99833       3.265652      57.00892       4.707466      49.27774       4.534071  540.8564 22.41183 502.7799 23.22108 38.07645       32.27241 
1 1 1 -4  7  10 o 775.4064 16.56776 117.0189       4.989088      117.7488       6.164974      115.6336       8.492847  777.3572 20.42126 769.0856 28.43483 8.271606       35.00811 
1 1 1 -4  7  11 o 1161.228 14.34284 262.3762       6.468161      259.0779       8.977202      265.9369       9.327579  1152.779 20.05243 1167.818 20.56676 -15.03882      28.72441 
1 1 1 -4  7  12 o 448.4280 22.16535 39.27394       3.860072      41.86892       6.655055      37.95832       4.738601  459.0453 37.66270 439.2466 27.92384 19.79868       46.88518 
1 1 1 -4  7  13 o 329.8348 29.35999 21.53591       3.721477      12.61080       6.257087      26.42124       4.629268  243.5859 64.95424 364.7375 33.04029 -121.1516      72.87464 
1 1 1 -4  7  14 o 527.5898 22.87953 54.46737       4.687826      57.23502       8.638964      53.31230       5.580964  534.4924 41.95615 520.3210 27.71906 14.17145       50.28583 
1 1 1 -4  7  15 o 324.0617 29.00709 20.80479       3.611948      23.10319       4.952219      18.19245       5.279615  339.2608 38.25491 297.9113 47.20781 41.34955       60.76195 
1 1 1 -4  7  16 o 820.4374 16.56420 131.2079       5.277689      122.7092       7.298860      140.5207       7.640409  791.8214 23.73558 847.4869 23.21430 -55.66547      33.20063 
1 1 1 -4  7  17 o 400.4738 26.09937 31.53778       4.036939      27.97674       5.420122      35.97433       6.049832  374.4383 37.79053 425.2627 37.00052 -50.82437      52.88821 
1 1 1 -4  7  18 o 452.1012 27.45847 40.15951       4.798204      36.10151       5.747235      49.49471       8.716962  426.9693 34.96711 497.2893 45.64601 -70.32001      57.50006 
1 1 1 -4  7  19 o 672.9395 19.95801 88.27236       5.215804      95.63792       7.331954      80.72602       7.421381  699.3368 26.99637 642.0216 29.76508 57.31519       40.18413 
1 1 1 -4  7  20 o 441.0288 27.61945 38.16703       4.706677      39.00603       6.584796      37.29059       6.730074  443.6953 38.59919 433.3267 40.46041 10.36865       55.91907 
1 1 1 -4  7  21 o 802.0993 19.31483 125.3123       6.016543      126.0713       8.359512      124.4965       8.666122  803.3824 26.79357 798.1395 27.95877 5.242859       38.72452 
1 1 1 -4  7  22 o 905.9272 19.41033 159.8811       6.828954      162.6870       9.491125      156.8692       9.833152  912.5043 26.78273 895.7252 28.26767 16.77905       38.94067 
1 1 1 -4  7  23 o 739.8591 21.98107 106.8032       6.315762      109.5442       8.782635      103.8677       9.088909  747.6926 30.24640 727.6319 32.16415 20.06067       44.15175 
1 1 1 -4  7  24 o 625.5916 25.49847 76.56904       6.194881      74.06180       8.501059      79.40807       9.046091  612.0003 35.92540 633.4545 36.93221 -21.45422      51.52303 
1 1 1 -4  7  25 o 850.1531 22.58679 141.2759       7.457265      145.6121       10.51477      136.8875       10.57784  860.4342 31.46692 833.8472 32.66499 26.58704       45.35603 
1 1 1 -4  7  26 o 221.7014 78.93803 9.483912       8.559314      12.44981       10.94521      4.814669       13.73312  249.7009 89.22646 223.9940 93.85877 25.70695       129.5022 
1 1 1 -4  7  27 o 567.4230 46.80877 65.22028       10.22276      0.000000       0.000000      65.22028       10.22276  ?        ?        567.4230 46.80877 0.000000       46.80877 
1 1 1 -4  7  28 o 385.4385 46.50690 30.54646       6.820796      36.98272       9.424981      23.46877       9.883470  417.5130 59.83863 320.8579 79.68047 96.65506       99.64758 
1 1 1 -4  7  29 o 214.9529 80.82159 9.434347       9.159917      0.000000       0.000000      9.434347       9.159917  ?        ?        214.9529 80.82159 0.000000       80.82159 
1 1 1 -4  7  30 o 249.1861 74.65737 14.81219       7.793347      3.280307       13.42666      20.67140       9.570560  199.1539 88.07574 289.3019 81.63084 -90.14807      120.0872 
1 1 1 -4  7  31 o 232.1882 82.67995 13.74948       9.390245      15.35537       12.82436      11.89331       13.78752  239.9678 94.21221 225.0072 94.14614 14.96062       133.1895 
1 1 1 -4  7  32 o 415.2243 53.01425 38.88046       8.353650      53.55173       13.94444      30.66788       10.43295  446.7599 83.43938 338.0907 80.59782 108.6692       116.0092 
1 1 1 -4  7  33 o 133.1180 60.16500 0.2969239E-02  6.639254      6.913108       9.801596      -5.855608      9.025047  178.9779 77.26259 130.6480 62.53995 48.32986       99.40198 
1 1 1 -4  8  1  o 774.9326 14.22536 116.7205       4.281097      113.2209       5.332312      123.0674       7.181020  763.0049 17.99535 795.0784 23.25671 -32.07349      29.40590 
1 1 1 -4  8  2  o 1635.226 15.04197 519.7979       9.552353      511.1799       10.88739      548.6158       19.90904  1621.325 17.29121 1677.041 30.56881 -55.71582      35.12034 
1 1 1 -4  8  3  o 1527.749 14.46438 453.6913       8.581826      452.4332       12.10729      454.9617       12.16599  1524.827 20.44553 1529.075 20.48759 -4.248169      28.94410 
1 1 1 -4  8  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -4  8  5  o 1110.957 13.11006 239.8883       5.656269      229.9507       7.761246      251.1453       8.260411  1087.199 18.38206 1136.159 18.72124 -48.95972      26.23709 
1 1 1 -4  8  6  o 408.4614 16.30404 32.44812       2.586273      33.93632       3.753184      31.10252       3.568858  416.7352 23.28369 398.9173 23.13597 17.81793       32.82382 
1 1 1 -4  8  7  o 529.7930 14.56333 54.57696       2.996366      52.28207       4.271637      56.79992       4.204171  518.1334 21.22877 540.1421 20.04215 -22.00873      29.19501 
1 1 1 -4  8  8  o 168.4892 37.84813 5.787027       2.416051      5.934630       3.487508      5.650814       3.350248  171.4338 49.57314 167.4382 48.63699 3.995636       69.44820 
1 1 1 -4  8  9  o 200.9127 40.82558 8.224921       3.076804      8.285661       3.902528      8.125145       5.001747  200.6317 50.20716 200.2000 59.77097 0.4317017      78.05978 
1 1 1 -4  8  10 o 582.7972 18.25278 66.16404       4.131184      66.65620       5.111743      65.23729       7.014582  584.4736 22.52040 576.0549 31.47437 8.418701       38.70148 
1 1 1 -4  8  11 o 543.0967 17.09428 57.46305       3.605422      57.69618       5.100453      57.23022       5.097222  543.3013 24.17353 541.0907 24.25691 2.210632       34.24554 
1 1 1 -4  8  12 o 364.7560 27.59915 26.23632       3.880605      29.16717       6.788196      24.81352       4.729654  379.4659 47.07408 353.0191 34.95827 26.44684       58.63488 
1 1 1 -4  8  13 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -4  8  14 o 304.8399 35.79862 18.62193       4.157381      2.890590       7.307272      26.15113       5.055299  170.2254 69.61179 361.7170 36.48580 -191.4916      78.59399 
1 1 1 -4  8  15 o 323.4052 29.60708 20.72887       3.677255      20.82861       5.259476      20.63348       5.143319  320.5664 43.35973 319.2857 42.53812 1.280701       60.74173 
1 1 1 -4  8  16 o 400.1249 25.61425 31.47936       3.959309      26.95021       5.610208      35.97348       5.588473  366.6819 40.04801 425.8955 34.07327 -59.21353      52.58166 
1 1 1 -4  8  17 o 373.3205 29.40695 27.49717       4.228918      33.59880       5.934951      21.20415       6.027306  410.9864 37.60118 322.4387 49.73299 88.54767       62.34757 
1 1 1 -4  8  18 o 630.4005 39.69841 78.70322       9.669270      0.000000       0.000000      78.70322       9.669270  ?        ?        630.4005 39.69841 0.000000       39.69841 
1 1 1 -4  8  19 o 1827.460 17.97938 650.3971       12.76000      643.6855       17.75579      657.5651       18.34958  1815.429 25.18446 1834.655 25.75394 -19.22583      36.02114 
1 1 1 -4  8  20 f 312.1620 40.01563 19.47466       4.739396      15.58096       6.372003      24.29589       7.090449  273.8562 61.42688 345.5338 54.65738 -71.67752      82.22342 
1 1 1 -4  8  21 o 355.6583 36.34999 25.07946       4.950150      27.95681       6.790077      21.81544       7.231934  373.0244 47.98412 325.8131 59.34180 47.21127       76.31464 
1 1 1 -4  8  22 f 168.7586 59.07978 5.129141       4.777834      6.066961       6.581420      4.084194       6.947160  188.9979 68.96507 177.2635 69.41594 11.73444       97.85067 
1 1 1 -4  8  23 o 953.9039 27.37713 178.0839       10.14193      178.0839       10.14193      0.000000       0.000000  953.9039 27.37713 ?        ?        0.000000       27.37713 
1 1 1 -4  8  24 o 185.3665 73.72627 4.337853       7.948898      0.000000       0.000000      4.337853       7.948898  ?        ?        185.3665 73.72627 0.000000       73.72627 
1 1 1 -4  8  25 o 1146.633 38.33312 260.2885       17.06973      260.2885       17.06973      0.000000       0.000000  1146.633 38.33312 ?        ?        0.000000       38.33312 
1 1 1 -4  8  26 o 206.4091 72.85689 8.191676       7.276162      9.097243       8.311817      5.221923       15.05206  217.5629 77.75386 232.2069 97.83035 -14.64406      124.9658 
1 1 1 -4  8  27 o 102.3719 49.63847 -9.593711      6.136201      -0.8683539E-01 8.215766      -21.58741      9.227962  161.0308 70.12291 110.0743 54.78034 50.95653       88.98376 
1 1 1 -4  8  28 o 200.1319 68.92184 8.265459       6.489488      15.74773       8.838119      -0.4877045     9.559293  262.6712 79.68675 168.3971 74.40285 94.27412       109.0219 
1 1 1 -4  8  29 o 148.8859 65.72697 -0.3578892     7.444575      -9.091674      12.39005      4.576689       9.313157  159.6154 75.50802 186.7820 77.69746 -27.16661      108.3437 
1 1 1 -4  8  30 f 140.8364 65.91083 -5.426846      9.003038      -10.62753      12.80062      -0.3358489     12.66490  155.4706 74.43788 181.9533 82.58302 -26.48274      111.1798 
1 1 1 -4  8  31 o 310.9386 60.80299 22.34295       7.079143      22.76095       10.02672      21.92748       9.996187  291.9811 83.94730 286.0049 84.28188 5.976257       118.9562 
1 1 1 -4  8  32 o 297.3705 67.56255 22.12897       7.625065      24.22910       12.95000      21.01448       9.433776  270.5191 97.01334 272.3502 82.26242 -1.831146      127.1955 
1 1 1 -4  8  33 o 266.0083 64.85392 18.17952       6.639206      21.33243       9.891792      15.59477       8.956270  260.9352 85.03326 226.8899 80.75175 34.04530       117.2668 
1 1 1 -4  9  1  o 874.0723 12.99503 148.4852       4.411157      150.1215       6.243769      146.8546       6.232882  878.4870 18.30137 868.8615 18.47185 9.625549       26.00287 
1 1 1 -4  9  2  o 1746.013 15.69049 592.7540       10.63927      578.7373       11.98452      644.8856       23.11260  1724.900 17.89076 1817.098 32.75235 -92.19824      37.32018 
1 1 1 -4  9  3  f 1023.946 12.83467 203.7769       5.103755      205.9546       7.289232      201.6826       7.148428  1028.917 18.24204 1018.207 18.07784 10.71002       25.68230 
1 1 1 -4  9  4  o 1170.327 13.30519 266.2350       6.047226      262.1576       8.426428      270.5648       8.683502  1160.742 18.69303 1179.172 18.96224 -18.43005      26.62697 
1 1 1 -4  9  5  f 541.2039 14.19867 56.94654       2.984260      57.38900       4.194622      56.49304       4.246620  542.9731 19.89237 538.6904 20.29907 4.282654       28.42109 
1 1 1 -4  9  6  o 394.9005 17.44241 30.34375       2.674990      32.90604       3.773658      27.75590       3.792426  410.1903 23.79132 376.3130 26.11172 33.87729       35.32491 
1 1 1 -4  9  7  o 809.7071 13.40230 127.4772       4.214396      131.8665       6.074822      123.4047       5.851557  822.9749 19.00724 796.1412 18.92576 26.83362       26.82274 
1 1 1 -4  9  8  o 869.0898 13.62447 146.8931       4.598459      155.5744       6.699765      139.1607       6.322986  893.7047 19.30357 845.2520 19.26229 48.45264       27.27020 
1 1 1 -4  9  9  o 191.9866 42.04984 7.553970       3.048414      6.780111       3.775604      9.003149       5.166737  182.0189 51.24118 209.1532 60.29792 -27.13425      79.12963 
1 1 1 -4  9  10 o 385.2639 21.03401 29.04862       3.135182      31.52332       4.509058      26.73248       4.362222  399.9784 29.23072 367.8456 30.82020 32.13281       42.47729 
1 1 1 -4  9  11 o 467.8563 19.35510 42.70621       3.516704      42.45665       5.063489      42.93876       4.887898  464.4213 28.20792 467.3128 27.04877 -2.891449      39.08098 
1 1 1 -4  9  12 o 293.7177 32.90957 17.20691       3.689352      1.423129       6.274079      25.54925       4.561296  152.0774 63.55957 358.5387 33.13326 -206.4613      71.67727 
1 1 1 -4  9  13 o 171.3626 58.75691 5.600416       4.713941      0.000000       0.000000      5.600416       4.713941  ?        ?        171.3626 58.75691 0.000000       58.75691 
1 1 1 -4  9  14 o 513.1214 20.21191 51.42505       4.027685      43.99901       5.663775      59.02257       5.728796  471.7773 31.08720 548.4911 26.89464 -76.71384      41.10639 
1 1 1 -4  9  15 o 955.5356 15.92857 177.8966       5.910872      176.9049       8.250623      178.9422       8.472252  951.3114 22.33243 956.6378 22.80465 -5.326416      31.91848 
1 1 1 -4  9  16 o 287.6385 34.85456 16.52720       3.813960      15.39735       5.452962      17.60928       5.336434  272.6291 53.41343 293.4568 48.52077 -20.82776      72.16134 
1 1 1 -4  9  17 o 167.9784 56.15751 5.390354       4.304967      -0.9917472E-02 5.278544      16.11691       7.439375  133.1262 57.07362 275.9286 69.46993 -142.8024      89.90811 
1 1 1 -4  9  18 o 441.7276 29.60215 38.36941       5.048777      37.50140       6.253081      39.99501       8.557310  435.0616 37.37246 445.9214 50.29255 -10.85977      62.65813 
1 1 1 -4  9  19 o 217.9281 52.58344 9.808307       4.399198      16.61753       5.948074      1.585844       6.536247  284.1297 55.89655 157.4648 65.26232 126.6648       85.92785 
1 1 1 -4  9  20 o 393.4569 32.18148 30.50976       4.874315      34.76652       6.562625      25.27202       7.279644  418.3905 40.91301 352.5957 54.95359 65.79480       68.51111 
1 1 1 -4  9  21 o 199.5928 59.38727 8.086406       4.943963      14.91435       6.746774      0.1678051      7.265664  267.2295 65.51520 156.8944 67.10353 110.3351       93.78233 
1 1 1 -4  9  22 o 276.8636 50.55882 15.68997       5.235825      13.52089       7.092369      18.28799       7.762009  253.8986 69.77444 294.7102 69.03040 -40.81160      98.15125 
1 1 1 -4  9  23 o 265.9573 61.48748 14.84443       6.223825      12.61475       9.912999      16.29524       7.996296  250.5970 85.20972 276.5577 73.27805 -25.96069      112.3849 
1 1 1 -4  9  24 o 847.7046 22.42190 140.4155       7.381505      134.8323       10.02491      147.0269       10.90910  828.2673 31.16606 864.4594 32.49500 -36.19202      45.02497 
1 1 1 -4  9  25 o 260.0767 69.59523 14.49310       7.167529      14.18762       8.318356      15.37372       14.12323  257.3312 77.13864 276.3634 100.9990 -19.03214      127.0873 
1 1 1 -4  9  26 o 503.9541 44.39710 51.20148       8.600327      51.20148       8.600327      0.000000       0.000000  503.9541 44.39710 ?        ?        0.000000       44.39710 
1 1 1 -4  9  27 o 470.2662 38.07889 44.41900       6.894642      37.89803       9.529956      51.58058       9.987093  424.1353 59.49394 500.0021 52.20242 -75.86676      79.14936 
1 1 1 -4  9  28 o 144.6990 63.12759 -0.3479245E-01 6.685933      -1.551461      8.469139      2.473945       10.89235  154.1971 68.96161 189.1301 81.54710 -34.93297      106.7972 
1 1 1 -4  9  29 o 310.6980 67.29976 21.94382       7.885554      24.04954       12.68518      20.61763       10.06701  304.1433 96.02439 289.7209 84.35375 14.42233       127.8133 
1 1 1 -4  9  30 o 178.3342 67.94139 6.324562       6.524660      9.152526       8.709241      2.707048       9.850280  204.5774 78.36304 175.8867 76.68172 28.69067       109.6396 
1 1 1 -4  9  31 o 152.6273 64.13100 3.073774       6.440248      -3.896940      9.104418      10.05512       9.111359  142.2997 66.49419 204.5725 79.66608 -62.27283      103.7698 
1 1 1 -4  9  32 o 343.2245 60.08941 28.17395       7.717657      48.16351       13.59611      18.67117       9.374291  409.3967 88.12403 252.6254 82.80119 156.7713       120.9210 
1 1 1 -4  9  33 o 213.4123 69.27415 12.45836       6.567478      5.015261       9.748760      18.64321       8.886624  168.4222 74.73888 247.5566 80.59344 -79.13445      109.9145 
1 1 1 -4  10 1  o 980.4045 13.25161 186.8409       5.045472      188.7524       7.151859      184.9469       7.119003  984.8866 18.69841 974.8961 18.80325 9.990479       26.51778 
1 1 1 -4  10 2  o 349.3984 17.96780 23.81512       2.429805      21.96139       2.867278      28.53795       4.576642  335.0641 22.16018 380.9586 31.20823 -45.89447      38.27567 
1 1 1 -4  10 3  o 786.5500 13.34122 120.2684       4.075211      119.9680       4.757827      121.0956       7.896151  785.4013 15.59872 788.0073 25.80223 -2.606018      30.15087 
1 1 1 -4  10 4  o 534.5444 14.39532 55.56197       2.988361      54.77475       4.176640      56.38769       4.277528  530.3766 20.27751 538.1147 20.46869 -7.738037      28.81223 
1 1 1 -4  10 5  o 766.8792 13.20573 114.3407       3.932941      111.6555       5.419153      117.3289       5.716815  757.3685 18.42452 776.3150 18.96218 -18.94647      26.43912 
1 1 1 -4  10 6  o 846.8765 13.46622 139.4641       4.428877      143.1173       6.280605      135.8507       6.246292  857.3044 18.86420 835.2070 19.25751 22.09741       26.95756 
1 1 1 -4  10 7  o 892.5253 19.00529 155.1746       6.587538      155.1746       6.587538      0.000000       0.000000  892.5253 19.00529 ?        ?        0.000000       19.00529 
1 1 1 -4  10 8  o 830.7901 15.76888 134.3576       5.087684      131.7469       6.235448      139.5573       8.799911  822.1332 19.52979 844.7260 26.82468 -22.59271      33.18095 
1 1 1 -4  10 9  f 549.5184 18.19942 58.85504       3.883897      54.97915       4.769350      66.48570       6.691981  530.5057 23.14947 581.5139 29.73179 -51.00818      37.68126 
1 1 1 -4  10 10 o 95.65421 41.56409 -0.3920178     2.874033      3.014257       4.222659      -3.331804      3.922870  143.3789 54.64943 94.97261 44.13305 48.40631       70.24448 
1 1 1 -4  10 11 o 454.0326 22.42079 40.30551       3.953356      43.49330       6.998795      38.81178       4.790872  466.9059 38.95375 443.8512 27.93642 23.05472       47.93577 
1 1 1 -4  10 12 o 238.1663 51.89806 11.84692       4.664543      0.000000       0.000000      11.84692       4.664543  ?        ?        238.1663 51.89806 0.000000       51.89806 
1 1 1 -4  10 13 o 619.9952 25.37301 75.32184       6.109257      0.000000       0.000000      75.32184       6.109257  ?        ?        619.9952 25.37301 0.000000       25.37301 
1 1 1 -4  10 14 o 604.7979 18.94900 71.36849       4.450661      69.49995       6.207012      73.34583       6.385137  595.3920 26.84427 611.6356 26.88125 -16.24359      37.98969 
1 1 1 -4  10 15 o 212.4145 47.05180 9.332376       3.779146      7.628818       5.199343      11.24044       5.502579  194.3757 61.48779 231.2607 60.55407 -36.88495      86.29916 
1 1 1 -4  10 16 f 455.3177 24.08295 40.62035       4.243314      38.22641       5.784811      43.40878       6.243284  439.6416 34.14946 468.5592 34.55381 -28.91757      48.58139 
1 1 1 -4  10 17 o 695.8326 21.83578 94.45175       5.900673      99.09439       7.342865      85.98841       9.914107  711.9444 26.55776 659.5466 38.87810 52.39783       47.08313 
1 1 1 -4  10 18 o 359.9605 36.47463 25.70537       5.028467      24.05419       6.098266      29.21286       8.888062  345.7420 46.60528 376.8018 62.96033 -31.05978      78.33298 
1 1 1 -4  10 19 o 205.0114 53.77909 8.654848       4.335007      10.04463       5.799052      6.894547       6.526461  221.1991 63.91318 195.6237 69.00668 25.57530       94.05751 
1 1 1 -4  10 20 o 728.6079 20.80395 103.4436       5.886642      100.7996       8.117404      106.3765       8.549315  718.0371 29.11001 737.5037 29.84964 -19.46655      41.69405 
1 1 1 -4  10 21 o 993.8947 19.18274 192.4329       7.404214      187.7413       10.17857      197.7056       10.79048  980.2172 26.73847 1005.681 27.62819 -25.46393      38.44818 
1 1 1 -4  10 22 o 220.2757 63.54724 10.05063       5.736853      11.36333       8.794100      9.078139       7.569249  238.9719 80.26174 217.1347 74.45469 21.83720       109.4781 
1 1 1 -4  10 23 o 724.9681 23.33384 102.7071       6.569510      104.9165       8.960342      100.1388       9.660496  730.8007 31.57168 713.0576 34.88565 17.74310       47.05081 
1 1 1 -4  10 24 o 737.6784 25.18759 106.5303       7.215752      126.1197       9.965684      84.94274       10.46160  800.6317 32.05135 652.9644 41.47047 147.6674       52.41268 
1 1 1 -4  10 25 o 435.3112 45.42865 38.25412       7.566795      38.15896       8.669225      38.55854       15.50519  431.9496 52.77731 410.9641 98.44544 20.98550       111.7003 
1 1 1 -4  10 26 o 356.9093 46.92585 26.04295       6.346595      26.10679       8.987420      25.97944       8.963509  347.9591 68.94620 347.1006 68.92661 0.8585205      97.49079 
1 1 1 -4  10 27 o 503.9438 39.09679 51.19212       7.591687      61.22203       9.521399      33.68748       12.57849  548.1211 45.13083 381.1663 86.90375 166.9548       97.92371 
1 1 1 -4  10 28 o 369.4771 56.25827 29.21671       7.817521      23.31345       13.70679      32.06274       9.517204  302.6927 100.1675 380.5282 66.84019 -77.83551      120.4207 
1 1 1 -4  10 29 o 502.8590 41.89076 52.25280       8.106312      62.03455       14.27096      47.59322       9.849603  518.9639 72.81277 469.7890 55.02941 49.17496       91.26848 
1 1 1 -4  10 30 o 193.2516 68.52670 8.443048       6.444070      7.110541       8.729723      10.03851       9.552310  190.5800 76.75991 209.7560 81.60267 -19.17604      112.0316 
1 1 1 -4  10 31 o 368.6671 50.39457 30.20345       7.026217      26.78602       9.743795      33.90536       10.14126  317.9164 79.20990 366.2512 73.84865 -48.33481      108.2951 
1 1 1 -4  10 32 o 136.7606 62.65055 -0.8064185     7.510425      17.72490       12.95150      -10.19510      9.218686  229.5388 93.12863 122.2378 59.62290 107.3009       110.5795 
1 1 1 -4  11 1  o 637.3098 14.24950 78.98298       3.526778      77.93236       4.916117      80.09702       5.062331  632.6083 20.01057 641.3046 20.32630 -8.696289      28.52334 
1 1 1 -4  11 2  o 713.9925 15.69347 99.16846       4.351517      100.4513       5.492983      97.00676       7.130509  718.2215 19.69345 705.0475 26.04199 13.17395       32.64992 
1 1 1 -4  11 3  o 1374.584 14.41979 367.4819       7.697648      360.2069       8.792624      391.3556       15.92797  1360.548 16.64089 1415.094 28.98327 -54.54529      33.42079 
1 1 1 -4  11 4  o 141.4522 42.60557 3.977920       2.533155      4.790591       3.056070      2.193667       4.528286  155.0324 46.81962 140.4660 55.71612 14.56636       72.77612 
1 1 1 -4  11 5  o 441.4024 16.97687 37.92858       2.910183      37.89540       4.078608      37.96299       4.153659  440.0154 23.95827 440.3472 24.38396 -0.3317871     34.18444 
1 1 1 -4  11 6  o 432.7859 17.07080 36.47236       2.869162      34.77278       3.919926      38.43363       4.210897  421.3247 24.05680 442.9339 24.57625 -21.60916      34.39072 
1 1 1 -4  11 7  o 959.6137 13.73194 179.1673       5.117481      177.3201       7.099406      181.1651       7.383364  953.7520 19.16720 963.9270 19.72342 -10.17505      27.50263 
1 1 1 -4  11 8  o 595.9702 18.03937 69.23061       4.175168      70.97109       5.181612      66.00880       7.049864  602.8373 22.13282 578.8698 31.47803 23.96759       38.48023 
1 1 1 -4  11 9  o 294.9418 25.39620 17.15392       2.880563      16.33893       4.106390      17.94348       4.041841  285.0726 38.04092 299.6042 35.42343 -14.53168      51.98010 
1 1 1 -4  11 10 o 502.6057 20.44775 49.33178       3.991176      41.26390       6.953332      53.29599       4.874071  454.4680 39.79793 521.8418 24.05055 -67.37384      46.50058 
1 1 1 -4  11 11 f 820.4940 17.53646 131.2875       5.587857      119.2571       9.542421      137.5656       6.893363  778.2504 31.57267 839.0604 21.15485 -60.81006      38.00475 
1 1 1 -4  11 12 o 370.1643 33.40987 27.22836       4.751068      0.000000       0.000000      27.22836       4.751068  ?        ?        370.1643 33.40987 0.000000       33.40987 
1 1 1 -4  11 13 o 310.9854 43.73738 19.60022       5.136290      0.000000       0.000000      19.60022       5.136290  ?        ?        310.9854 43.73738 0.000000       43.73738 
1 1 1 -4  11 14 f 795.6278 16.78914 123.3389       5.187598      125.0134       7.293430      121.6244       7.380080  799.7084 23.48401 788.6559 24.09603 11.05249       33.64695 
1 1 1 -4  11 15 o 846.6948 16.85872 139.6341       5.543440      134.8018       7.674655      144.9055       8.015676  830.6474 23.79108 861.1752 23.96738 -30.52777      33.77057 
1 1 1 -4  11 16 o 422.1404 26.78898 34.98338       4.369033      39.28297       6.159087      30.62845       6.198594  445.5897 35.89648 391.8201 41.36109 53.76959       54.76584 
1 1 1 -4  11 17 o 1060.151 19.42817 218.9743       7.998853      228.0837       10.00197      202.8103       13.32336  1081.065 23.82352 1016.840 33.73907 64.22485       41.30236 
1 1 1 -4  11 18 o 502.3228 29.42347 49.50858       5.714862      56.99099       7.271684      37.42154       9.242181  537.9637 34.99638 429.9607 56.73575 108.0030       66.66102 
1 1 1 -4  11 19 o 371.7833 35.01815 27.33306       4.996473      30.74460       6.962658      23.71101       7.174253  391.9225 46.66259 341.0709 56.11520 50.85156       72.98159 
1 1 1 -4  11 20 o 1222.359 20.55016 291.1508       9.755332      278.1754       15.83622      299.0856       12.38403  1191.117 34.23489 1237.666 25.76501 -46.54895      42.84698 
1 1 1 -4  11 21 o 836.6360 20.38907 136.4524       6.624634      133.0963       9.069677      140.2906       9.699276  824.7795 28.31562 846.5034 29.50412 -21.72394      40.89336 
1 1 1 -4  11 22 o 264.7344 54.57308 14.52900       5.424204      12.49243       7.239564      17.13543       8.190033  244.1119 71.66554 283.5115 73.70228 -39.39955      102.8007 
1 1 1 -4  11 23 o 300.4364 51.84905 18.56651       5.830912      12.48246       7.913004      25.79513       8.625268  244.0900 75.65166 350.3653 65.80685 -106.2753      100.2682 
1 1 1 -4  11 24 o 288.9372 61.83361 17.61467       6.728745      14.19849       7.515225      31.42139       15.10834  257.5165 72.22221 370.6106 101.8335 -113.0941      124.8443 
1 1 1 -4  11 25 o 484.0938 40.11474 46.91623       7.473615      54.52986       9.204287      32.18302       12.80391  519.7291 46.07996 378.6012 88.64526 141.1279       99.90668 
1 1 1 -4  11 26 o 421.7510 44.71993 36.17646       7.212875      44.66387       8.960044      20.54970       12.15785  466.4395 50.25732 298.2517 93.99057 168.1878       106.5834 
1 1 1 -4  11 27 o 464.8485 37.10376 43.55781       6.642380      49.00321       9.263509      37.79504       9.529631  486.3672 49.74372 420.6462 60.03880 65.72098       77.96856 
1 1 1 -4  11 28 o 205.8291 73.56503 9.026419       7.440487      9.105641       12.55291      8.983511       9.238237  222.9937 91.22002 210.9883 80.73412 12.00546       121.8158 
1 1 1 -4  11 29 o 186.2480 68.78693 7.222447       6.577029      2.715063       9.220287      11.89185       9.384535  173.4367 74.90336 224.8537 82.30612 -51.41705      111.2871 
1 1 1 -4  11 30 o 239.2229 67.24316 13.86128       6.507085      12.73094       9.148556      15.01863       9.257222  223.7910 81.36367 239.2720 82.32224 -15.48099      115.7454 
1 1 1 -4  11 31 o 187.3204 68.07177 8.500386       6.402526      -2.508829      8.997124      19.79518       9.113069  143.3246 66.67991 266.0629 80.96168 -122.7383      104.8857 
1 1 1 -4  11 32 o 106.1255 51.90173 -9.425667      7.121830      3.781495       13.88046      -14.14486      8.297224  178.2540 82.89418 106.3796 52.77343 71.87442       98.26739 
1 1 1 -4  12 1  f 225.0853 30.86255 10.10129       2.626748      14.68500       3.395007      3.264961       4.146137  271.7855 32.83044 145.7619 54.45968 126.0236       63.59005 
1 1 1 -4  12 2  o 510.7258 18.16911 50.80248       3.603707      53.31684       4.573744      46.68604       5.852188  522.7885 22.52775 487.2198 31.09114 35.56866       38.39477 
1 1 1 -4  12 3  o 692.9390 14.32575 93.42032       3.855142      92.46477       4.510705      96.00978       7.425443  689.1260 16.85458 700.6713 27.28853 -11.54523      32.07399 
1 1 1 -4  12 4  o 631.4224 15.19244 77.59679       3.725422      76.01872       4.309139      82.26675       7.412830  624.7038 17.76186 648.0806 29.45283 -23.37677      34.39408 
1 1 1 -4  12 5  o 267.1136 24.99141 14.06628       2.562345      17.22186       3.637304      10.95747       3.610255  294.4620 32.33954 232.0845 41.58294 62.37747       52.67814 
1 1 1 -4  12 6  o 558.9866 15.68753 60.84486       3.405524      64.46970       4.805068      57.18641       4.827285  574.6830 21.52996 541.0506 22.97402 33.63239       31.48563 
1 1 1 -4  12 7  o 492.2125 19.20319 47.25710       3.670742      46.45020       4.539106      48.78217       6.240304  487.3773 23.98154 496.9842 32.51137 -9.606842      40.39930 
1 1 1 -4  12 8  o 549.1379 22.99333 58.95864       4.903556      57.86852       7.053782      59.97812       6.821406  540.9007 33.74810 551.2078 32.00399 -10.30713      46.51010 
1 1 1 -4  12 9  o 226.7341 39.06017 10.46012       3.315230      20.96556       6.066140      5.986097       3.958719  319.5888 50.55779 172.2050 53.53131 147.3838       73.63213 
1 1 1 -4  12 10 o 357.3051 26.98677 25.17651       3.717088      30.98465       6.483340      22.33249       4.536767  392.2400 43.28257 334.4698 35.46824 57.77011       55.95870 
1 1 1 -4  12 11 o 156.1854 55.55704 4.355626       4.238818      0.000000       0.000000      4.355626       4.238818  ?        ?        156.1854 55.55704 0.000000       55.55704 
1 1 1 -4  12 12 o 109.9131 46.45661 0.3078861      3.411905      -1.431689      5.042720      1.776602       4.633533  121.3210 53.79927 137.3053 55.70467 -15.98431      77.44270 
1 1 1 -4  12 13 o 1113.828 15.44731 241.5808       6.681886      242.8828       9.535040      240.3244       9.366442  1115.203 22.01611 1109.393 21.74008 5.810181       30.94091 
1 1 1 -4  12 14 f 649.8251 18.65816 82.30206       4.708615      84.99181       6.729944      79.72282       6.590228  659.1503 26.29051 638.3390 26.58405 20.81134       37.38853 
1 1 1 -4  12 15 o 431.5865 25.60066 36.52420       4.271716      37.15804       5.993099      35.86964       6.090311  433.3076 35.93891 425.3834 37.24157 7.924225       51.75461 
1 1 1 -4  12 16 o 528.7727 32.68550 55.01168       6.679093      55.01168       6.679093      0.000000       0.000000  528.7727 32.68550 ?        ?        0.000000       32.68550 
1 1 1 -4  12 17 o 274.1850 49.10592 15.31027       5.036815      19.89833       6.148538      5.949871       8.782228  312.6438 52.50102 203.4649 78.49785 109.1789       94.43659 
1 1 1 -4  12 18 f 627.7990 25.84954 76.92991       6.302334      78.09309       7.660722      74.49409       11.08585  631.7766 31.22326 612.4377 46.96786 19.33893       56.39922 
1 1 1 -4  12 19 o 770.2039 23.23883 115.6870       6.951011      98.56199       10.87152      127.5288       9.040291  706.9108 39.76170 807.7273 28.81971 -100.8165      49.10772 
1 1 1 -4  12 20 o 759.3282 21.36951 112.4122       6.301619      113.0685       8.708332      111.6908       9.130304  760.1538 29.49888 755.1791 31.13202 4.974670       42.88807 
1 1 1 -4  12 21 o 651.3575 25.05574 82.91580       6.338035      95.18191       8.748461      69.36597       9.194862  696.3848 32.34851 591.4635 40.27005 104.9213       51.65369 
1 1 1 -4  12 22 o 309.5662 48.24084 19.52527       5.610589      14.43029       7.524804      25.90387       8.419508  260.5888 71.97612 352.2216 63.90558 -91.63275      96.25220 
1 1 1 -4  12 23 o 159.6499 65.81128 2.073582       6.596517      10.17105       7.339511      -31.95583      15.04596  223.6606 73.26371 144.3080 71.49706 79.35251       102.3689 
1 1 1 -4  12 24 o 546.8168 43.40506 59.94669       9.141647      59.94669       9.141647      0.000000       0.000000  546.8168 43.40506 ?        ?        0.000000       43.40506 
1 1 1 -4  12 25 o 489.4108 35.37172 47.70867       6.677645      56.52930       9.094849      37.39216       9.835852  529.1406 44.67619 422.0059 61.85155 107.1346       76.29925 
1 1 1 -4  12 26 o 291.0165 59.36386 18.17092       6.481859      33.51112       8.936828      1.143978       9.415344  397.5670 59.72864 175.3781 75.71675 222.1888       96.43929 
1 1 1 -4  12 27 o 198.6447 74.30509 7.654128       7.722905      -2.387316      13.37013      12.68199       9.460829  186.4984 84.72487 237.9798 83.14574 -51.48135      118.7077 
1 1 1 -4  12 28 o 219.3948 69.60925 10.98012       6.659714      10.05427       9.337812      11.93857       9.500818  216.0076 81.52100 228.3668 82.93241 -12.35916      116.2904 
1 1 1 -4  12 29 o 166.5819 66.42855 4.760221       6.468690      2.090204       8.854878      7.815718       9.472545  166.6967 72.68880 198.2855 79.92542 -31.58887      108.0358 
1 1 1 -4  12 30 o 125.2422 57.43110 -2.112868      6.332803      15.34099       8.861729      -20.32917      9.053213  239.3551 80.56889 105.1004 52.60474 134.2546       96.22165 
1 1 1 -4  12 31 o 236.2970 67.26514 14.36165       6.468866      16.61218       9.373507      12.31507       8.938692  237.9159 82.78154 210.6648 79.69836 27.25108       114.9113 
1 1 1 -4  12 32 o 152.5930 66.55643 3.360839       7.428205      15.42188       14.19699      -1.185709      8.716554  212.2172 92.29620 141.3788 65.72708 70.83844       113.3077 
1 1 1 -4  13 1  o 325.0038 23.61492 20.74065       2.960229      20.52009       3.779596      21.09064       4.761099  322.0526 30.58682 324.8229 38.49147 -2.770264      49.16449 
1 1 1 -4  13 2  o 808.2455 16.02044 127.2072       5.028585      126.1576       6.306093      129.0400       8.333354  804.2371 20.19056 812.0789 26.42370 -7.841797      33.25463 
1 1 1 -4  13 3  o 808.3655 16.50149 127.2791       5.180349      132.7941       6.584531      118.3201       8.392249  824.9913 20.55169 777.1921 27.80494 47.79919       34.57581 
1 1 1 -4  13 4  o 195.1063 43.79874 7.845716       3.237282      8.965030       4.153769      6.113985       5.166620  207.6410 51.70792 179.6618 61.51417 27.97919       80.35983 
1 1 1 -4  13 5  o 952.7302 16.77697 176.8629       6.207424      174.8342       7.694798      180.6433       10.50404  946.3417 20.93733 959.8516 28.17892 -13.50983      35.10588 
1 1 1 -4  13 6  f 666.3171 21.34594 86.71267       5.523626      95.26818       7.985186      78.86272       7.648839  696.5774 29.51805 633.3867 31.09557 63.19073       42.87482 
1 1 1 -4  13 7  o 201.5608 48.88037 8.449961       3.786791      10.53388       5.507046      6.580843       5.215503  223.7318 61.48350 183.8899 61.81008 39.84190       87.18203 
1 1 1 -4  13 8  o 889.6785 16.80034 154.2777       5.804691      144.3150       9.639036      159.9465       7.270948  857.2988 28.95166 904.9967 20.68788 -47.69788      35.58352 
1 1 1 -4  13 9  o 884.2597 17.12687 152.4242       5.881467      163.9348       10.64684      147.3689       7.055761  913.3599 30.01585 868.6408 20.91586 44.71906       36.58448 
1 1 1 -4  13 10 o 607.9927 23.90413 72.31055       5.644159      0.000000       0.000000      72.31055       5.644159  ?        ?        607.9927 23.90413 0.000000       23.90413 
1 1 1 -4  13 11 o 267.2878 39.20738 14.41687       3.948837      6.406885       7.450866      17.54551       4.656604  195.4792 73.01147 294.6836 41.86708 -99.20438      84.16369 
1 1 1 -4  13 12 o 260.3516 35.11379 13.57713       3.459744      15.22635       5.051032      12.11949       4.748595  272.3164 49.58850 241.7415 52.11522 30.57484       71.93758 
1 1 1 -4  13 13 o 1350.898 15.92318 355.2930       8.353727      351.6404       11.79154      358.9735       11.83650  1342.139 22.62273 1356.108 22.47506 -13.96899      31.88912 
1 1 1 -4  13 14 f 309.6861 32.85836 19.01793       3.891437      21.36705       5.537195      16.72542       5.470065  325.7195 44.97388 285.9426 51.13610 39.77692       68.09956 
1 1 1 -4  13 15 o 1003.901 16.80351 196.1791       6.551171      199.7455       9.463921      192.8980       9.077657  1011.669 24.08821 994.2971 23.50875 17.37231       33.65863 
1 1 1 -4  13 16 o 194.6814 59.52495 7.612932       4.917900      5.905730       6.045241      10.95376       8.456645  184.5148 66.27126 236.3162 78.70176 -51.80138      102.8875 
1 1 1 -4  13 17 o 1227.388 23.87902 293.8062       11.38221      286.9892       15.63407      301.4946       16.60337  1210.588 33.25431 1240.416 34.46679 -29.82837      47.89373 
1 1 1 -4  13 18 o 768.7228 40.60808 116.5326       12.07999      0.000000       0.000000      116.5326       12.07999  ?        ?        768.7228 40.60808 0.000000       40.60808 
1 1 1 -4  13 19 o 224.7719 73.78610 9.969000       7.443072      0.000000       0.000000      9.969000       7.443072  ?        ?        224.7719 73.78610 0.000000       73.78610 
1 1 1 -4  13 20 o 328.2586 42.53357 21.62728       5.294722      22.94545       7.052972      19.92515       8.014605  334.4622 56.29942 307.7024 68.79606 26.75983       88.89613 
1 1 1 -4  13 21 f 217.9148 61.70810 9.878295       5.458941      8.543447       7.337305      11.53325       8.169847  211.4946 73.26007 237.8217 77.26757 -26.32713      106.4768 
1 1 1 -4  13 22 o 564.1774 32.53837 62.80384       7.098928      65.03951       8.710836      58.38275       12.24954  572.0576 39.45072 533.7614 60.14232 38.29614       71.92676 
1 1 1 -4  13 23 o 449.4754 48.05604 40.84636       8.258459      40.84636       8.258459      0.000000       0.000000  449.4754 48.05604 ?        ?        0.000000       48.05604 
1 1 1 -4  13 24 o 236.1507 66.30346 11.90740       6.330266      14.65768       8.232068      7.927927       9.902224  260.0062 76.44550 217.2677 83.47872 42.73854       113.1928 
1 1 1 -4  13 25 o 484.6675 35.38415 46.90699       6.614075      58.70955       8.782562      31.44263       10.05308  539.4645 42.25875 380.4662 70.63914 158.9982       82.31458 
1 1 1 -4  13 26 o 207.8920 79.65972 7.999290       9.001750      7.999290       9.001750      0.000000       0.000000  207.8920 79.65972 ?        ?        0.000000       79.65972 
1 1 1 -4  13 27 o 505.9574 43.28644 52.68742       8.423502      55.38236       13.91535      51.12875       10.58272  492.8413 75.07607 488.6943 56.82193 4.147064       94.15491 
1 1 1 -4  13 28 o 499.9299 49.42504 53.05910       9.470191      53.05910       9.470191      0.000000       0.000000  499.9299 49.42504 ?        ?        0.000000       49.42504 
1 1 1 -4  13 29 o 307.7684 55.30351 21.23084       6.367074      26.85582       8.999530      15.59366       9.009282  332.5904 71.78059 245.1279 81.21337 87.46249       108.3885 
1 1 1 -4  13 30 o 147.5906 62.46975 2.812382       6.183358      1.638482       8.908601      3.903644       8.589314  158.6833 70.86527 166.9191 72.19142 -8.235779      101.1607 
1 1 1 -4  13 31 o 170.4319 65.95083 6.743490       6.213602      21.74248       9.082801      -6.451196      8.518992  274.5730 80.17625 125.8445 60.37776 148.7285       100.3679 
1 1 1 -4  14 1  o 473.5689 17.70192 43.71198       3.255604      47.98639       4.560789      39.27118       4.648708  495.4449 23.70372 446.9821 26.90559 48.46274       35.85774 
1 1 1 -4  14 2  o 452.2172 19.33473 39.89076       3.395574      44.82446       4.705819      34.53172       4.904472  477.9113 25.44645 418.2829 30.40000 59.62839       39.64444 
1 1 1 -4  14 3  o 765.9655 14.67476 114.2295       4.365241      121.3010       5.226424      97.91637       7.938128  788.9484 17.05800 706.4458 28.93419 82.50262       33.58813 
1 1 1 -4  14 4  o 721.3704 17.77255 101.4493       4.978930      101.9997       6.293094      100.5281       8.140941  722.4720 22.42927 715.6441 29.29203 6.827881       36.89303 
1 1 1 -4  14 5  o 535.7184 21.25162 56.05096       4.421367      55.74069       5.513525      56.60994       7.400507  533.3594 26.61837 534.4009 35.86671 -1.041565      44.66496 
1 1 1 -4  14 6  o 632.5760 30.96033 78.66380       7.605826      78.66380       7.605826      0.000000       0.000000  632.5760 30.96033 ?        ?        0.000000       30.96033 
1 1 1 -4  14 7  o 315.8197 29.46141 19.74818       3.571724      22.71973       6.126928      18.21849       4.395944  333.8320 48.69245 301.1523 38.46574 32.67966       62.05294 
1 1 1 -4  14 8  o 139.2220 49.47078 3.402951       3.360119      9.133007       6.049578      0.8465579      4.040726  211.0867 66.26634 122.9738 51.16858 88.11282       83.72247 
1 1 1 -4  14 9  o 692.6509 16.15209 93.45656       4.344814      98.59267       6.140379      88.30664       6.148620  710.4153 22.25640 672.0931 23.55701 38.32214       32.40803 
1 1 1 -4  14 10 o 445.1228 24.69667 38.86036       4.252443      33.93142       7.409047      41.28170       5.192946  410.2436 47.37537 457.9013 29.35674 -47.65771      55.73369 
1 1 1 -4  14 11 o 614.2707 17.91423 73.52119       4.273521      66.51641       5.994946      80.75842       6.093606  583.0909 26.47409 642.8495 24.40827 -59.75867      36.00890 
1 1 1 -4  14 12 o 556.5729 19.54802 60.37792       4.225253      54.90302       5.980737      65.83337       5.970098  528.7237 29.24075 580.2618 26.49290 -51.53809      39.45752 
1 1 1 -4  14 13 o 744.2130 17.61636 107.8496       5.091448      116.3871       7.549417      100.7266       6.895696  771.9739 25.18157 718.2365 24.72195 53.73749       35.28861 
1 1 1 -4  14 14 o 369.1389 29.07104 26.81092       4.133800      20.69077       5.894267      32.73494       5.799048  319.7165 49.03688 406.5770 37.13704 -86.86047      61.51240 
1 1 1 -4  14 15 o 124.3742 51.85381 0.7182833      4.161386      6.276117       6.029863      -4.336077      5.750264  187.5965 66.31278 117.4203 54.16592 70.17612       85.62320 
1 1 1 -4  14 16 o 899.8284 24.70944 157.9479       8.634767      151.9809       11.94922      164.4689       12.49164  880.6520 34.93875 916.0770 35.11232 -35.42499      49.53373 
1 1 1 -4  14 17 o 641.3811 24.84073 80.25485       6.187405      80.36652       7.568492      80.02982       10.74392  641.0797 30.39970 635.9131 43.77137 5.166565       53.29235 
1 1 1 -4  14 18 f 645.4050 23.16897 81.24060       5.807204      90.81001       8.142674      71.33514       8.284413  681.2162 30.77897 601.9667 35.59559 79.24951       47.05732 
1 1 1 -4  14 19 o 1059.493 19.20659 218.7236       7.902716      215.9611       10.85578      221.8382       11.52662  1051.119 26.59385 1064.980 27.86972 -13.86145      38.52212 
1 1 1 -4  14 20 o 762.4227 22.19242 113.4653       6.570956      117.2310       8.900018      108.9529       9.742493  773.3925 29.63214 744.5766 33.69246 28.81586       44.86920 
1 1 1 -4  14 21 o 140.2429 60.09184 0.1108648      5.845863      3.129670       7.210367      -5.679955      9.986421  172.1076 69.60580 157.8111 72.27527 14.29652       100.3428 
1 1 1 -4  14 22 o 874.0248 26.29906 149.6421       8.926723      149.7085       10.28093      149.4389       17.99469  872.9633 30.32554 859.8401 54.16568 13.12317       62.07705 
1 1 1 -4  14 23 o 190.7591 70.37999 6.366926       6.881646      8.223910       7.618114      -1.868349      16.04288  208.5482 74.44846 214.1511 95.40596 -5.602890      121.0160 
1 1 1 -4  14 24 o 227.1941 66.19215 11.04545       6.196940      6.957644       8.116261      16.75971       9.596019  200.6098 75.93167 274.7449 82.96253 -74.13515      112.4651 
1 1 1 -4  14 25 o 353.4185 47.65934 25.79972       6.374507      38.95446       8.622503      9.944392       9.466291  432.9597 52.34401 223.4195 82.52240 209.5402       97.72329 
1 1 1 -4  14 26 o 533.4279 42.35203 58.13625       8.701419      30.32978       14.18559      74.90982       11.01761  345.2150 100.0246 602.1514 47.50011 -256.9364      110.7302 
1 1 1 -4  14 27 o 230.3088 68.81392 12.19912       6.627780      13.83324       9.098517      10.35169       9.674135  241.1973 81.63599 218.6942 82.86990 22.50304       116.3265 
1 1 1 -4  14 28 o 185.4793 68.53062 7.313297       6.529415      15.16113       9.308521      -0.2881128     9.161214  244.8134 82.57415 158.9089 71.34949 85.90450       109.1295 
1 1 1 -4  14 29 o 246.3430 64.81951 14.68163       6.285069      12.21889       9.034781      16.99101       8.748967  217.9222 80.59421 252.7397 79.74131 -34.81752      113.3759 
1 1 1 -4  14 30 o 459.7740 37.57171 44.68395       6.649997      45.51113       9.706052      43.95213       9.129444  440.5826 58.14738 436.6774 55.05771 3.905212       80.07790 
1 1 1 -4  14 31 o 157.9702 64.11530 5.165151       6.141121      13.16261       9.071107      -1.601736      8.344087  210.8815 80.16497 138.2818 64.29401 72.59964       102.7626 
1 1 1 -4  15 1  o 732.7798 15.45179 104.5661       4.397243      109.4312       6.189884      99.60957       6.247801  748.6700 21.28943 714.0508 22.53046 34.61926       30.99777 
1 1 1 -4  15 2  o 662.4455 16.11530 85.48008       4.145879      86.52654       5.733578      84.33337       6.001942  665.5532 22.18273 656.8203 23.52974 8.732910       32.33763 
1 1 1 -4  15 3  o 260.6174 35.55326 13.62712       3.504524      14.10783       4.430657      12.82376       5.727725  262.8807 45.01832 246.8531 60.27086 16.02757       75.22782 
1 1 1 -4  15 4  o 655.4852 16.19010 83.69805       4.121359      82.91062       4.830963      85.80349       7.899476  651.9893 19.07942 660.9213 30.77659 -8.932007      36.21082 
1 1 1 -4  15 5  o 247.2305 38.34786 12.34912       3.562632      12.34912       3.562632      0.000000       0.000000  247.2305 38.34786 ?        ?        0.000000       38.34786 
1 1 1 -4  15 6  o 768.9576 20.90424 115.4176       6.242590      115.4176       6.242590      0.000000       0.000000  768.9576 20.90424 ?        ?        0.000000       20.90424 
1 1 1 -4  15 7  o 539.4174 17.63396 56.70548       3.694051      53.27837       5.004875      60.80680       5.475087  521.9550 24.69063 557.5175 25.28742 -35.56244      35.34234 
1 1 1 -4  15 8  o 95.64193 41.60625 -0.4365150     2.886414      0.1886485      3.999215      -1.116266      4.170160  117.6992 50.04774 111.3573 49.17447 6.341934       70.16341 
1 1 1 -4  15 9  o 766.8466 18.24302 114.5892       5.432918      106.9811       8.916988      119.0808       6.851462  738.4852 31.09198 781.0002 22.58937 -42.51495      38.43164 
1 1 1 -4  15 10 f 325.5541 33.25426 21.01382       4.145321      15.26436       7.640066      23.41257       4.934870  268.8499 71.81399 342.8616 37.68373 -74.01166      81.10063 
1 1 1 -4  15 11 o 383.0455 25.92694 28.79564       3.834110      25.32052       5.418179      32.28123       5.426331  356.3963 39.82746 404.0120 34.92824 -47.61566      52.97366 
1 1 1 -4  15 12 o 879.7996 16.31955 150.6475       5.575962      149.8795       7.981919      151.3796       7.792687  876.4854 23.44956 880.9781 22.77687 -4.492798      32.69048 
1 1 1 -4  15 13 o 549.8340 21.16551 58.91627       4.519477      59.25459       6.547596      58.60840       6.246072  549.4559 30.80890 546.6801 29.52974 2.775879       42.67544 
1 1 1 -4  15 14 o 1174.702 18.66959 268.6623       8.517074      281.3504       14.98766      262.6106       10.35082  1198.988 32.18778 1160.607 22.96474 38.38159       39.54026 
1 1 1 -4  15 15 o 471.7671 30.71833 43.69754       5.597300      45.41790       6.937470      40.48905       9.474177  479.7277 37.53659 448.3767 55.60199 31.35092       67.08633 
1 1 1 -4  15 16 o 178.8814 61.60111 5.871745       5.184080      1.584630       6.508391      13.31241       8.574267  157.5416 65.19458 255.2450 78.68996 -97.70337      102.1883 
1 1 1 -4  15 17 o 915.1116 21.96974 163.2415       7.807770      161.2062       9.542344      167.3643       13.58109  908.4827 27.04646 923.0759 37.88517 -14.59314      46.54886 
1 1 1 -4  15 18 o 592.6578 25.35556 68.60377       5.835864      67.15593       7.914398      70.32906       8.639506  583.8029 35.07053 596.8796 37.46120 -13.07678      51.31553 
1 1 1 -4  15 19 o 555.8324 29.53815 60.69780       6.353214      61.36769       7.875762      59.44968       10.75013  557.1790 36.60094 543.6767 51.53021 13.50226       63.20595 
1 1 1 -4  15 20 o 561.2839 30.60664 62.00498       6.646351      65.86912       8.329524      55.23328       11.02663  576.6899 37.39364 521.7126 55.26457 54.97723       66.72674 
1 1 1 -4  15 21 o 438.4224 37.23677 38.21812       6.280065      50.60338       8.551979      23.72236       9.251972  502.6686 44.25978 332.8750 73.53070 169.7937       85.82361 
1 1 1 -4  15 22 o 280.4725 67.61511 16.82309       7.278721      18.04994       8.174329      12.12661       15.99342  289.1903 72.82720 266.7849 105.0606 22.40536       127.8340 
1 1 1 -4  15 23 o 164.3963 63.76788 3.935253       5.819884      6.316514       7.536957      0.4184865      9.159341  193.5444 73.19225 172.4714 74.57062 21.07306       104.4887 
1 1 1 -4  15 24 o 430.9733 40.12947 37.48697       6.639279      40.73464       8.864099      33.33654       10.02063  443.6847 52.45895 392.6992 68.17942 50.98553       86.02544 
1 1 1 -4  15 25 o 264.4756 71.47623 15.77472       7.515981      24.77077       12.93816      11.19259       9.233803  317.3303 96.44711 228.8791 81.93645 88.45120       126.5529 
1 1 1 -4  15 26 o 207.8059 74.39964 9.236293       7.613386      6.183333       12.65679      10.96728       9.530391  210.5897 89.26868 224.1507 82.79956 -13.56097      121.7566 
1 1 1 -4  15 27 o 179.3549 68.47859 6.242724       6.637242      6.787397       9.148574      5.637468       9.643962  193.7695 78.39149 189.9463 79.04386 3.823242       111.3246 
1 1 1 -4  15 28 o 416.2448 41.80153 36.49293       6.665936      40.27282       9.635389      33.02316       9.231678  420.3697 60.78659 375.6678 65.66821 44.70193       89.48365 
1 1 1 -4  15 29 o 150.0769 62.60387 3.327410       6.070376      -0.3427706     8.859028      6.575902       8.334571  150.7901 68.68139 179.6335 74.00323 -28.84346      100.9634 
1 1 1 -4  15 30 o 181.1688 66.81824 8.103112       6.201665      11.16467       9.474673      5.808197       8.203076  201.4173 80.37138 170.6033 72.06710 30.81401       107.9501 
1 1 1 -4  16 1  o 524.3384 18.33590 53.58147       3.733722      53.40640       5.265391      53.75854       5.295298  522.5228 25.94761 524.2334 26.00984 -1.710632      36.73949 
1 1 1 -4  16 2  o 542.9252 25.49723 57.64618       5.376021      57.64618       5.376021      0.000000       0.000000  542.9252 25.49723 ?        ?        0.000000       25.49723 
1 1 1 -4  16 3  o 625.5886 24.24670 76.48428       5.890734      76.48428       5.890734      0.000000       0.000000  625.5886 24.24670 ?        ?        0.000000       24.24670 
1 1 1 -4  16 4  o 352.1893 28.86139 24.46066       3.912820      24.46066       3.912820      0.000000       0.000000  352.1893 28.86139 ?        ?        0.000000       28.86139 
1 1 1 -4  16 5  o 628.6365 20.39772 77.07426       4.979768      77.07426       4.979768      0.000000       0.000000  628.6365 20.39772 ?        ?        0.000000       20.39772 
1 1 1 -4  16 6  o 201.5147 50.82878 8.404141       3.977342      9.300820       5.078311      6.981393       6.396832  211.8887 59.34899 194.6098 68.34763 17.27888       90.51907 
1 1 1 -4  16 7  o 336.5504 27.92911 22.31260       3.617373      22.62650       4.224788      21.45030       7.002254  338.0675 32.58249 322.5575 58.03270 15.51001       66.55383 
1 1 1 -4  16 8  o 538.7626 21.06097 56.60006       4.406603      41.15762       7.085491      66.34031       5.627260  455.1449 40.50943 582.8005 24.86275 -127.6556      47.53073 
1 1 1 -4  16 9  o 1277.002 17.94214 317.5663       8.898026      328.4435       15.63904      312.3597       10.82006  1294.953 31.09771 1265.568 22.01488 29.38440       38.10147 
1 1 1 -4  16 10 o 425.0721 22.80227 35.34041       3.750430      33.43990       5.340040      37.19034       5.268501  411.6643 33.69735 434.7118 31.41899 -23.04742      46.07238 
1 1 1 -4  16 11 o 126.5113 49.96560 1.808517       3.627285      -1.134488      5.248935      4.498622       5.018343  126.6039 55.56430 164.9535 60.21667 -38.34966      81.93558 
1 1 1 -4  16 12 o 607.1040 22.45551 71.84457       5.294366      76.79563       9.049213      69.26779       6.528297  624.4510 37.48865 595.4545 28.23081 28.99652       46.92949 
1 1 1 -4  16 13 o 109.5173 48.78072 -1.555496      4.191661      -4.605646      7.278135      -0.4167292E-01 5.127399  135.2664 61.85870 131.7776 56.36635 3.488785       83.68790 
1 1 1 -4  16 14 f 199.5965 59.68538 8.038361       4.984509      6.267811       6.238232      11.16482       8.289600  189.1273 67.38493 237.9617 77.85717 -48.83441      102.9683 
1 1 1 -4  16 15 o 172.8997 61.11570 5.267821       5.121712      6.617100       6.361049      2.780702       8.636268  192.6816 68.10962 184.2535 75.55088 8.428146       101.7195 
1 1 1 -4  16 16 o 355.7716 40.97255 25.22161       5.557567      26.12318       6.840551      23.47099       9.532071  359.9019 50.31760 334.0641 75.27723 25.83780       90.54568 
1 1 1 -4  16 17 o 164.8023 59.90216 4.563768       4.958352      9.779955       6.718594      -1.675391      7.347928  220.4870 69.91209 148.2997 65.39217 72.18729       95.72793 
1 1 1 -4  16 18 o 819.0941 23.42774 131.0010       7.452331      126.3831       9.090994      140.4617       13.01210  803.3128 29.14061 843.7957 39.70835 -40.48291      49.25372 
1 1 1 -4  16 19 o 308.4525 47.31275 19.33651       5.486646      25.64078       7.702514      12.84288       7.817338  352.6344 58.28040 247.6416 74.90282 104.9928       94.90542 
1 1 1 -4  16 20 o 183.6735 64.35432 6.251505       5.669585      1.259532       7.737617      12.03885       8.331264  165.9289 70.03711 241.5527 77.98586 -75.62379      104.8188 
1 1 1 -4  16 21 o 461.5718 41.52604 42.62516       7.364003      38.75857       8.348096      56.18596       15.63386  437.0406 50.08994 511.3412 81.46085 -74.30057      95.62882 
1 1 1 -4  16 22 o 165.0295 69.55875 1.540086       7.614854      1.540086       7.614854      0.000000       0.000000  165.0295 69.55875 ?        ?        0.000000       69.55875 
1 1 1 -4  16 23 o 687.1504 27.15472 92.92647       7.246448      94.69424       9.708386      90.70261       10.88897  689.1094 36.40615 671.5062 41.96545 17.60315       55.55634 
1 1 1 -4  16 24 o 518.1714 49.41348 55.40252       9.823179      0.000000       0.000000      55.40252       9.823179  ?        ?        518.1714 49.41348 0.000000       49.41348 
1 1 1 -4  16 25 o 441.0604 49.35905 40.66949       8.309643      36.63237       13.57169      43.09057       10.50998  386.4394 91.79419 445.0394 62.53568 -58.60004      111.0715 
1 1 1 -4  16 26 o 167.4895 64.74400 4.958005       5.983373      3.073858       7.944472      7.427589       9.095351  168.4049 71.01843 198.7512 78.92255 -30.34625      106.1715 
1 1 1 -4  16 27 o 449.1101 36.79484 41.52802       6.361197      33.82490       9.119534      48.82773       8.877528  384.7956 63.22229 477.5334 48.54463 -92.73782      79.70972 
1 1 1 -4  16 28 o 284.9474 55.67738 18.56503       5.940364      26.40931       8.540751      11.21414       8.267784  328.5581 69.12500 210.8659 77.24359 117.6922       103.6573 
1 1 1 -4  16 29 o 163.8501 64.11958 5.703127       5.924388      14.22045       8.530842      -2.231296      8.233755  225.4054 78.94218 138.0093 64.06703 87.39607       101.6684 
1 1 1 -4  17 1  o 642.6002 30.42042 80.86903       7.591614      80.86903       7.591614      0.000000       0.000000  642.6002 30.42042 ?        ?        0.000000       30.42042 
1 1 1 -4  17 2  o 765.7908 23.36547 114.4483       6.948848      0.000000       0.000000      114.4483       6.948848  ?        ?        765.7908 23.36547 0.000000       23.36547 
1 1 1 -4  17 3  o 786.6860 16.48944 120.4736       5.037736      119.7027       6.941991      121.3313       7.322065  783.2657 22.82164 788.3906 23.91466 -5.124817      33.05659 
1 1 1 -4  17 4  o 143.7693 52.01522 3.459213       3.732369      3.459213       3.732369      0.000000       0.000000  143.7693 52.01522 ?        ?        0.000000       52.01522 
1 1 1 -4  17 5  o 653.6555 17.33537 83.18858       4.400582      88.93420       5.263621      69.84842       8.020412  675.5439 20.06333 595.5482 34.82953 79.99579       40.19494 
1 1 1 -4  17 6  o 1022.367 15.58772 203.3877       6.188957      201.4290       7.139462      209.3096       12.41413  1017.064 18.07545 1033.964 30.91598 -16.89941      35.81229 
1 1 1 -4  17 7  o 1417.979 16.04552 391.2721       8.835919      390.6657       10.21802      393.0698       17.59368  1416.358 18.57657 1416.683 31.97835 -0.3247070     36.98248 
1 1 1 -4  17 8  o 436.4381 31.47961 37.47202       5.299745      43.52113       7.426205      31.19353       7.565684  468.4717 41.23872 393.7027 50.65770 74.76901       65.32101 
1 1 1 -4  17 9  o 389.9758 24.34078 29.78149       3.667963      28.60736       5.039217      31.10452       5.349217  380.5480 34.47192 396.8217 35.07205 -16.27374      49.17685 
1 1 1 -4  17 10 o 624.6902 18.72871 75.97369       4.543605      72.77231       6.293906      79.45782       6.565982  610.5833 26.54284 638.0193 26.49951 -27.43604      37.50662 
1 1 1 -4  17 11 o 619.1248 21.90253 74.68769       5.266239      83.99638       9.052979      69.92661       6.474402  653.7501 35.79352 598.4315 27.85847 55.31860       45.35714 
1 1 1 -4  17 12 o 1189.933 16.26220 275.4527       7.515018      277.9890       10.54219      272.8322       10.71561  1194.347 22.72857 1183.105 23.32200 11.24243       32.56538 
1 1 1 -4  17 13 o 738.6735 22.04474 106.3143       6.323907      103.3775       7.621511      112.8049       11.33026  727.7814 26.96573 757.2479 38.65652 -29.46643      47.13255 
1 1 1 -4  17 14 o 774.8439 39.68200 118.2331       11.90080      0.000000       0.000000      118.2331       11.90080  ?        ?        774.8439 39.68200 0.000000       39.68200 
1 1 1 -4  17 15 o 234.7788 59.44276 11.42377       5.425167      9.444664       6.752886      15.02634       9.110884  218.1895 70.18675 269.0518 80.74728 -50.86226      106.9874 
1 1 1 -4  17 16 o 896.1169 22.34291 156.6326       7.775573      159.4373       9.606154      151.3035       13.24162  903.0850 27.39006 876.7537 38.88978 26.33130       47.56711 
1 1 1 -4  17 17 o 1053.492 18.93818 216.2831       7.748138      216.3020       10.81281      216.2632       11.10820  1051.738 26.47301 1051.438 27.20397 0.3001709      37.95887 
1 1 1 -4  17 18 o 1160.021 19.00053 262.3294       8.559718      266.3607       12.18188      258.3979       12.03009  1166.595 26.88848 1149.000 26.96004 17.59412       38.07669 
1 1 1 -4  17 19 o 597.9547 37.94415 70.87023       8.765678      0.000000       0.000000      70.87023       8.765678  ?        ?        597.9547 37.94415 0.000000       37.94415 
1 1 1 -4  17 20 o 895.4474 25.15142 156.9632       8.746426      165.0279       10.58440      139.5987       15.53109  916.6944 29.73129 834.2829 48.14038 82.41150       56.58131 
1 1 1 -4  17 21 o 136.5652 61.51575 -2.736205      6.873198      -1.172754      7.868105      -7.772179      14.12114  154.0285 67.80443 183.8479 84.83461 -29.81941      108.6018 
1 1 1 -4  17 22 o 677.7195 27.07654 90.33704       7.126417      102.2921       9.722567      76.45697       10.47612  718.1694 34.85989 615.6238 44.11082 102.5455       56.22256 
1 1 1 -4  17 23 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -4  17 24 o 331.0373 63.77148 24.07708       7.901069      37.34637       13.78583      17.58635       9.641747  391.9318 92.12686 273.0899 83.31642 118.8419       124.2135 
1 1 1 -4  17 25 o 499.7706 36.20123 50.69728       6.978615      43.77430       9.532221      58.69394       10.24476  451.3096 55.55983 527.3883 50.64270 -76.07870      75.17697 
1 1 1 -4  17 26 o 358.3374 47.04541 27.33783       6.388718      30.69968       8.970770      23.87793       9.100653  366.0175 65.51588 313.6344 75.60268 52.38306       100.0405 
1 1 1 -4  17 27 o 206.6311 66.26675 10.21292       6.023124      6.599003       8.755182      13.46010       8.299073  185.3135 76.03709 229.3004 77.96532 -43.98691      108.9047 
1 1 1 -4  17 28 o 133.3822 57.62651 1.382876       5.461565      3.595183       8.222527      -0.3637631     7.306078  163.1591 70.59915 139.4680 63.06735 23.69107       94.66642 
1 1 1 -4  17 29 o 382.6683 40.56309 31.64184       5.936206      31.29814       9.202494      31.88677       7.768603  347.9076 70.52482 368.2885 56.08717 -20.38089      90.10838 
1 1 1 -4  18 1  o 182.9301 49.07979 6.845881       3.559087      7.093690       5.390472      6.654360       4.738868  191.4901 62.78983 184.1599 58.74940 7.330154       85.98869 
1 1 1 -4  18 2  o 1189.947 17.81231 275.6295       8.231440      279.8477       13.57993      273.1796       10.34943  1196.522 29.22460 1183.774 22.51228 12.74817       36.89010 
1 1 1 -4  18 3  o 487.8271 31.82362 46.76561       5.995951      39.53889       7.162680      63.68856       10.96082  446.3529 41.80793 565.0326 50.48228 -118.6797      65.54665 
1 1 1 -4  18 4  o 907.1709 21.75848 160.3831       7.665593      169.5481       11.04773      151.8740       10.64505  931.0870 30.55305 881.1066 31.10939 49.98047       43.60371 
1 1 1 -4  18 5  o 571.6907 20.85067 63.67240       4.629235      69.68393       5.712257      52.17014       7.901448  597.6835 24.60982 513.7455 39.91663 83.93799       46.89329 
1 1 1 -4  18 6  o 98.92448 44.51018 -1.723426      3.586506      -0.1775920     4.376578      -4.883943      6.257952  120.9497 51.91440 121.7762 56.29126 -0.8265076     76.57552 
1 1 1 -4  18 7  o 753.4803 23.64421 110.6903       6.918702      113.0333       9.614792      108.1742       9.963572  760.0280 32.57484 743.1610 34.52265 16.86700       47.46508 
1 1 1 -4  18 8  o 647.5303 21.14286 81.67558       5.316820      93.51285       6.641469      60.55113       8.872196  692.4682 24.69655 553.5362 41.57586 138.9320       48.35775 
1 1 1 -4  18 9  f 482.6755 31.34933 45.73285       5.844571      37.44959       7.896430      55.76838       8.691614  433.2800 47.71944 530.9796 42.50607 -97.69955      63.90548 
1 1 1 -4  18 10 o 370.0565 33.63961 27.01053       4.781645      32.83287       5.885473      15.70466       8.201335  407.5690 37.60785 274.6564 74.84688 132.9126       83.76398 
1 1 1 -4  18 11 o 927.5109 19.37677 167.4742       6.979565      172.9585       8.530003      156.3639       12.14089  942.0359 23.31598 893.6394 34.98325 48.39655       42.04120 
1 1 1 -4  18 12 o 796.1526 20.95975 123.4613       6.480527      126.6129       7.902903      116.9918       11.32293  805.6891 25.25755 772.3467 37.75012 33.34241       45.42043 
1 1 1 -4  18 13 o 1085.818 20.15498 229.6302       8.498988      238.7975       10.55260      212.7052       14.33845  1106.468 24.55798 1041.741 35.44169 64.72681       43.11853 
1 1 1 -4  18 14 o 502.9790 30.68766 49.68615       5.965667      50.67507       7.251309      47.61493       10.49420  506.6710 37.11029 485.7628 56.69511 20.90820       67.76067 
1 1 1 -4  18 15 o 183.7242 63.35388 6.262775       5.484179      11.70009       6.724654      -4.535291      9.476557  237.5339 68.88071 158.1302 71.63749 79.40378       99.38049 
1 1 1 -4  18 16 o 338.6062 39.79564 22.91189       5.133283      28.25646       7.458776      18.10249       7.075494  372.8450 53.00467 294.1317 63.77962 78.71329       82.92970 
1 1 1 -4  18 17 o 1277.392 18.28214 317.9962       9.069412      340.4101       13.31475      298.5954       12.38755  1319.207 25.98917 1235.590 25.81566 83.61707       36.63175 
1 1 1 -4  18 18 o 579.1578 26.95864 65.68049       6.063492      69.16469       8.785851      62.51168       8.378773  590.5694 38.51849 561.2796 38.67513 29.28979       54.58424 
1 1 1 -4  18 19 o 542.4274 29.99686 57.95440       6.294410      65.56847       8.979807      50.59979       8.825479  573.7955 40.55915 501.9317 45.77938 71.86386       61.16205 
1 1 1 -4  18 20 o 874.1969 25.51902 149.7841       8.663656      145.3457       10.29891      160.5277       16.02328  859.3052 30.86141 894.4688 46.28580 -35.16357      55.63095 
1 1 1 -4  18 21 o 815.0797 23.71512 130.2459       7.506775      122.3599       10.44527      138.6701       10.79577  785.9694 34.22049 837.1968 33.20458 -51.22742      47.68213 
1 1 1 -4  18 22 o 184.4362 66.64909 6.437744       6.125267      3.493433       8.414913      9.755890       8.933169  179.6327 74.21693 220.7276 80.37723 -41.09489      109.4013 
1 1 1 -4  18 23 o 542.7725 34.04791 59.05671       7.140546      57.69899       9.933523      60.50837       10.27147  527.7633 49.02610 540.2116 49.51074 -12.44830      69.67691 
1 1 1 -4  18 24 o 621.9792 36.00116 78.22825       8.658831      76.81783       14.69396      78.97857       10.71730  590.7444 65.13144 618.1960 44.94836 -27.45166      79.13570 
1 1 1 -4  18 25 o 252.4439 64.89704 14.71700       6.397489      12.37150       8.961033      17.15518       9.136344  228.1409 80.81841 262.7804 81.26388 -34.63943      114.6099 
1 1 1 -4  18 26 f 166.9319 65.16926 5.270772       6.108724      12.81290       8.631708      -2.297031      8.646390  225.9913 79.39289 146.0370 67.01836 79.95438       103.8975 
1 1 1 -4  18 27 o 123.8729 55.85202 -0.8932701     5.681696      6.149956       8.664994      -6.205529      7.525270  179.3893 74.81062 121.2515 57.78385 58.13776       94.52831 
1 1 1 -4  18 28 o 400.2975 37.72905 34.00841       5.796060      33.38428       8.637260      34.51971       7.817624  371.8346 61.99633 387.8456 53.31219 -16.01108      81.76635 
1 1 1 -4  19 1  o 1137.881 15.67171 251.8262       6.925346      253.1682       9.680454      250.4195       9.911467  1140.029 21.86511 1133.716 22.51156 6.313354       31.38238 
1 1 1 -4  19 2  o 998.9009 19.06257 194.2219       7.394893      191.3754       8.545466      202.7092       14.75576  991.1254 22.20134 1016.992 37.36079 -25.86652      43.45950 
1 1 1 -4  19 3  o 176.2857 52.33448 6.234241       3.842620      5.047171       5.288240      7.562141       5.593139  172.3264 61.97374 197.2387 63.92104 -24.91229      89.03169 
1 1 1 -4  19 4  o 669.0459 23.85324 87.24868       6.197711      86.19437       8.585891      88.39573       8.955566  662.9525 33.45641 671.1840 34.47400 -8.231506      48.03944 
1 1 1 -4  19 5  o 684.3355 24.91536 91.31068       6.621619      90.38809       9.290520      92.26319       9.440039  678.5574 35.37790 685.5373 35.58037 -6.979858      50.17529 
1 1 1 -4  19 6  f 703.9283 24.54086 96.59749       6.708822      96.26974       9.467709      96.92802       9.507833  701.3470 34.76033 703.7362 34.78913 -2.389160      49.17891 
1 1 1 -4  19 7  o 1028.479 22.47958 206.0705       8.978661      207.3060       12.62395      204.8057       12.77284  1029.918 31.56202 1023.568 32.13237 6.349792       45.04054 
1 1 1 -4  19 8  o 740.2717 24.97405 106.8425       7.179731      104.5495       10.01611      109.2659       10.29706  730.8102 35.29121 747.0784 35.49109 -16.26819      50.05084 
1 1 1 -4  19 9  o 449.9850 27.32877 39.65565       4.753188      41.70778       5.684120      34.88402       8.667524  460.8188 31.95930 416.3364 54.94986 44.48233       63.56795 
1 1 1 -4  19 10 o 922.6212 19.47368 165.7168       6.977494      166.5071       8.437849      164.0079       12.40867  924.2734 23.50733 915.2416 34.91095 9.031799       42.08763 
1 1 1 -4  19 11 o 207.6418 55.96189 8.849713       4.614832      9.343897       5.600802      7.804822       8.144072  214.3347 63.06626 212.3668 76.83474 1.967941       99.40286 
1 1 1 -4  19 12 o 701.7515 23.42916 96.03267       6.385105      102.4873       7.836146      83.28040       11.01442  724.3131 27.85789 648.5974 43.98795 75.71570       52.06728 
1 1 1 -4  19 13 o 242.0323 57.00979 12.14180       5.270297      6.472620       6.510831      22.91625       8.975809  191.9239 68.79248 330.4027 71.98778 -138.4788      99.57231 
1 1 1 -4  19 14 o 609.8535 33.24921 73.17634       7.844989      73.17634       7.844989      0.000000       0.000000  609.8535 33.24921 ?        ?        0.000000       33.24921 
1 1 1 -4  19 15 o 331.6075 39.78225 21.98925       5.020942      27.52219       7.267624      16.93702       6.944743  368.0493 52.31901 284.1482 64.41930 83.90109       82.98870 
1 1 1 -4  19 16 o 533.8969 27.81588 55.96077       5.747420      68.65938       8.455009      45.05247       7.836359  589.1324 37.14519 475.1410 42.93194 113.9914       56.77073 
1 1 1 -4  19 17 o 200.0527 62.31342 8.127181       5.361117      11.98897       7.686102      4.468192       7.481565  240.1276 74.58147 182.9057 71.91128 57.22189       103.6032 
1 1 1 -4  19 18 o 309.1008 50.16280 19.58201       5.815155      21.04993       8.321671      18.18112       8.129439  314.1230 70.00485 291.0709 72.25388 23.05219       100.6047 
1 1 1 -4  19 19 o 981.7360 24.26151 188.7323       9.249973      200.5520       11.64552      168.5286       15.22546  1009.904 29.69279 919.6849 42.62883 90.21906       51.95073 
1 1 1 -4  19 20 o 516.2440 33.01347 52.90993       6.584068      54.93254       9.147727      50.73591       9.483928  520.9437 45.67744 498.6808 49.63018 22.26288       67.45060 
1 1 1 -4  19 21 o 524.0444 45.80852 55.95816       9.229035      55.95816       9.229035      0.000000       0.000000  524.0444 45.80852 ?        ?        0.000000       45.80852 
1 1 1 -4  19 22 o 362.1728 45.52229 27.09185       6.261306      24.70641       8.598972      29.78395       9.134962  333.5766 68.66640 368.5777 66.25461 -35.00116      95.41880 
1 1 1 -4  19 23 o 314.3786 66.59761 22.21409       7.878035      8.631132       13.74959      28.85257       9.612287  225.5091 94.15714 355.5676 72.07832 -130.0585      118.5785 
1 1 1 -4  19 24 o 408.9438 40.61832 34.57653       6.365452      30.43568       8.516335      39.81827       9.581778  369.6447 61.48517 425.1038 59.68390 -55.45911      85.68893 
1 1 1 -4  19 25 o 236.5294 65.63129 13.24667       6.240952      11.79538       8.588004      14.87081       9.085030  220.1563 78.99747 241.5046 81.57626 -21.34837      113.5574 
1 1 1 -4  19 26 o 413.9126 40.31990 36.20061       6.398923      38.30454       9.226874      34.25107       8.881870  406.9954 60.19205 382.9898 61.82122 24.00558       86.28410 
1 1 1 -4  19 27 o 387.0325 41.34746 32.20642       6.118584      51.66397       9.126270      16.31971       8.246437  481.3210 49.53075 243.4579 77.48195 237.8631       91.96058 
1 1 1 -4  20 1  o 1057.756 19.01701 217.7232       7.811882      221.3903       9.268723      208.7299       14.51503  1066.184 22.38514 1032.770 36.18980 33.41382       42.55345 
1 1 1 -4  20 2  o 608.1063 24.02065 72.05501       5.672732      71.78110       6.428128      73.01929       12.06095  606.6444 27.28490 606.2597 51.72125 0.3847046      58.47695 
1 1 1 -4  20 3  o 1031.922 16.75440 207.1254       6.714345      210.8567       9.422146      203.2756       9.570632  1040.344 23.32088 1021.352 24.12889 18.99213       33.55692 
1 1 1 -4  20 4  o 978.8816 18.89486 186.4714       7.182935      191.6985       9.039214      177.5155       11.83196  991.9165 23.46538 953.1405 31.96479 38.77600       39.65314 
1 1 1 -4  20 5  o 547.0996 25.44101 58.35513       5.405411      60.33102       6.907645      55.23396       8.681743  554.6981 32.20466 528.6928 42.64679 26.00531       53.44051 
1 1 1 -4  20 6  f 163.3816 69.37685 0.4835090      7.665660      0.000000       0.000000      0.4835090      7.665660  ?        ?        163.3816 69.37685 0.000000       69.37685 
1 1 1 -4  20 7  o 1109.020 19.86670 239.4355       8.556437      225.5147       10.35531      269.3940       15.19112  1075.531 24.79203 1173.636 33.32946 -98.10510      41.53911 
1 1 1 -4  20 8  o 401.1416 28.63709 31.57566       4.431913      33.50633       5.245422      26.75871       8.285382  412.5934 33.01283 362.0979 61.09369 50.49554       69.44268 
1 1 1 -4  20 9  o 378.4952 33.07732 28.24214       4.813205      34.72210       6.003589      16.58329       8.052902  419.1994 37.26621 281.7423 73.00498 137.4571       81.96645 
1 1 1 -4  20 10 o 136.4449 55.47533 1.560369       4.607041      8.802750       5.529566      -14.87786      8.330628  208.6507 62.97081 116.0893 56.63588 92.56142       84.69324 
1 1 1 -4  20 11 o 910.1653 24.60050 161.6622       8.695455      161.6622       8.695455      0.000000       0.000000  910.1653 24.60050 ?        ?        0.000000       24.60050 
1 1 1 -4  20 12 o 713.3876 23.32876 99.30259       6.463163      103.4173       7.899368      90.96994       11.24123  727.2466 27.96937 677.5980 42.94024 49.64856       51.24597 
1 1 1 -4  20 13 o 219.0582 55.62222 9.957364       4.740565      9.615017       6.781496      10.28453       6.629434  218.9435 70.32541 224.3994 69.19448 -5.455856      98.65870 
1 1 1 -4  20 14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -4  20 15 o 675.6672 23.28967 89.16800       6.111167      103.0983       8.931809      76.90694       8.379589  724.7191 31.73524 624.3499 34.69627 100.3691       47.02081 
1 1 1 -4  20 16 o 144.8847 59.15410 1.818958       5.266063      9.170085       7.546717      -5.157309      7.351782  216.9764 74.34459 132.7982 61.25496 84.17822       96.32906 
1 1 1 -4  20 17 o 644.6000 25.69827 81.36452       6.433127      84.08665       9.195940      78.75554       9.002767  651.5588 36.48920 630.3495 36.93742 21.20929       51.92143 
1 1 1 -4  20 18 o 334.0585 53.80062 23.07274       6.742700      26.63950       8.364091      16.45238       11.39522  355.8870 62.81353 276.0127 91.33111 79.87433       110.8463 
1 1 1 -4  20 19 o 341.7934 96.99288 27.24444       13.47186      0.000000       0.000000      27.24444       13.47186  ?        ?        341.7934 96.99288 0.000000       96.99288 
1 1 1 -4  20 20 o 486.1728 34.31923 47.20951       6.438101      55.97640       9.128651      38.53347       9.081234  524.4057 45.26775 429.2192 55.79980 95.18646       71.85253 
1 1 1 -4  20 21 o 848.6664 23.12083 141.6441       7.620236      134.1675       10.52902      149.8678       11.04259  820.5764 33.04008 867.4337 32.77984 -46.85730      46.54207 
1 1 1 -4  20 22 o 374.6300 55.88144 30.10753       7.881461      17.92243       13.81380      35.98853       9.596756  270.1283 99.70450 405.2386 63.02803 -135.1103      117.9556 
1 1 1 -4  20 23 o 194.8775 72.45397 7.883111       7.321009      20.21794       12.98499      2.134957       8.864199  276.7768 97.36795 169.7728 73.38166 107.0040       121.9237 
1 1 1 -4  20 24 o 198.0052 66.73833 8.971844       6.080513      2.422153       8.196542      16.98754       9.067566  163.7999 70.68230 258.1763 81.14192 -94.37639      107.6104 
1 1 1 -4  20 25 o 137.4117 59.56382 1.165493       5.873750      -5.025052      8.235073      7.576311       8.380304  132.0846 62.19988 188.6281 75.47742 -56.54350      97.80421 
1 1 1 -4  20 26 o 193.4173 66.65434 9.197471       6.070003      13.08495       8.811676      5.686895       8.373628  219.1037 79.82224 174.1283 73.14375 44.97536       108.2663 
1 1 1 -4  21 1  o 576.5094 25.18590 64.78553       5.638867      67.74571       6.472802      55.46659       11.48461  589.2383 28.28612 526.3827 57.09605 62.85559       63.71862 
1 1 1 -4  21 2  o 168.3423 53.29611 5.521609       3.905649      -1.039713      5.290754      13.37898       5.789759  128.0919 56.01177 254.7674 59.58123 -126.6755      81.77555 
1 1 1 -4  21 3  o 133.6765 55.55993 0.9014660      4.756474      -0.2012430E-01 5.285490      4.826302       10.90755  134.1144 57.29371 213.3313 85.84477 -79.21687      103.2080 
1 1 1 -4  21 4  o 150.7250 65.91738 -1.311618      7.329683      0.000000       0.000000      -1.311618      7.329683  ?        ?        150.7250 65.91738 0.000000       65.91738 
1 1 1 -4  21 5  o 560.4252 33.34630 61.64915       7.224828      57.81223       11.89632      63.89133       9.094010  536.7755 57.98931 568.9232 41.44484 -32.14764      71.27716 
1 1 1 -4  21 6  o 430.7469 26.23517 36.33197       4.367765      38.48483       5.073356      30.16660       8.585514  442.8673 29.66963 385.3617 59.26664 57.50562       66.27837 
1 1 1 -4  21 7  o 504.1104 24.31791 49.55906       4.760800      49.38133       5.515448      50.07851       9.429122  502.0248 28.40614 501.1774 49.07500 0.8474426      56.70330 
1 1 1 -4  21 8  o 523.0355 24.56838 53.36910       4.990404      51.37697       5.816124      58.92904       9.716497  511.8421 29.38282 544.4861 46.39347 -32.64401      54.91543 
1 1 1 -4  21 9  o 552.3732 29.04519 59.82067       6.208790      56.44946       8.084688      64.66746       9.693858  534.4079 39.22906 570.9126 44.06280 -36.50470      58.99534 
1 1 1 -4  21 10 o 719.0721 20.68390 100.7801       5.776074      99.98299       6.804869      102.8347       10.92526  715.6847 24.48330 721.8696 39.11731 -6.184875      46.14755 
1 1 1 -4  21 11 o 782.0898 22.24659 119.3207       6.756909      112.1546       8.236627      134.0674       11.81561  757.2216 28.00905 825.7036 36.84716 -68.48206      46.28412 
1 1 1 -4  21 12 o 683.7916 30.50898 91.62703       8.101762      91.62703       8.101762      0.000000       0.000000  683.7916 30.50898 ?        ?        0.000000       30.50898 
1 1 1 -4  21 13 o 538.6171 25.62116 56.71601       5.359286      65.34366       7.878003      49.28363       7.311962  575.3170 35.43224 498.6773 38.04306 76.63968       51.98768 
1 1 1 -4  21 14 o 589.6656 24.68736 67.96834       5.653384      67.81522       7.943802      68.12549       8.047390  586.0181 35.06618 587.2534 35.45214 -1.235291      49.86473 
1 1 1 -4  21 15 o 182.4937 60.97062 6.462458       5.074493      5.573967       7.307338      7.290009       7.052289  188.9238 71.91885 199.9369 71.60313 -11.01306      101.4856 
1 1 1 -4  21 16 o 120.3111 54.28005 -2.441783      5.376142      4.271077       7.694399      -8.844935      7.514807  182.5132 72.55377 121.7304 57.93798 60.78285       92.84858 
1 1 1 -4  21 17 o 178.1857 64.19010 5.742766       5.675529      -1.058651      8.057011      12.44183       7.996155  156.2357 68.69850 242.0341 76.21841 -85.79843      102.6096 
1 1 1 -4  21 18 o 372.0702 48.90609 28.42440       6.895484      32.43740       8.303085      19.50539       12.37836  394.8491 55.69456 292.7310 95.10912 102.1182       110.2163 
1 1 1 -4  21 19 o 820.9456 23.09152 132.3023       7.361985      136.6095       10.48259      128.1101       10.34168  829.7793 32.52954 803.2202 33.15343 26.55908       46.44697 
1 1 1 -4  21 20 o 451.4274 36.70213 41.09406       6.378677      46.43569       9.143312      36.02941       8.903105  472.4756 50.61856 411.8652 57.20670 60.61041       76.38615 
1 1 1 -4  21 21 o 163.3647 68.68886 2.509020       7.396284      -5.255498      14.81984      5.084520       8.535264  185.4320 86.03586 185.3984 75.45836 0.3359985E-01  114.4383 
1 1 1 -4  21 22 o 146.0172 64.62202 -0.2937665     7.240536      -19.27429      12.61455      9.031879       8.842135  138.4054 67.97327 207.4969 79.08260 -69.09152      104.2805 
1 1 1 -4  21 23 o 226.5727 64.31796 11.98697       5.922918      9.237546       8.096200      15.15273       8.687574  203.2315 76.06814 245.8979 79.66188 -42.66644      110.1471 
1 1 1 -4  21 24 o 109.3817 51.69699 -4.805863      5.783918      5.307364       8.034355      -15.68547      8.333219  174.8901 72.40955 107.1785 53.12058 67.71160       89.80501 
1 1 1 -4  21 25 o 176.0917 64.67492 7.092195       5.801536      5.288537       8.317104      8.801465       8.096560  172.5584 72.71181 192.1195 75.02020 -19.56104      104.4751 
1 1 1 -4  22 1  o 395.5904 28.26761 30.70943       4.314126      30.97595       5.879507      30.39858       6.349787  395.5009 38.77824 390.9952 42.50223 4.505646       57.53427 
1 1 1 -4  22 2  o 311.6056 36.42346 19.28296       4.324553      17.93428       5.905852      20.84209       6.349949  296.6931 53.21124 320.4861 52.86245 -23.79303      75.00584 
1 1 1 -4  22 3  o 712.9000 22.62289 99.05329       6.263322      97.22047       10.10727      100.1959       7.980270  703.1143 37.14702 716.1922 28.69195 -13.07794      46.93750 
1 1 1 -4  22 4  o 374.7468 40.93215 27.92643       5.860165      16.99992       10.91726      32.34900       6.945609  286.6508 88.86243 402.6821 45.19418 -116.0313      99.69476 
1 1 1 -4  22 5  o 990.7228 20.16397 191.1930       7.758116      191.1930       7.758116      0.000000       0.000000  990.7228 20.16397 ?        ?        0.000000       20.16397 
1 1 1 -4  22 6  o 258.2341 44.62912 13.51519       4.313797      14.00946       5.008198      12.09429       8.491449  261.5720 51.13446 245.1270 78.68939 16.44492       93.84430 
1 1 1 -4  22 7  o 477.5565 26.00677 44.66721       4.805068      45.75049       5.623223      41.73572       9.250403  482.6265 30.15279 455.2939 53.32691 27.33261       61.26133 
1 1 1 -4  22 8  o 625.1609 22.05130 76.21628       5.353699      75.86156       6.229080      77.21898       10.47305  623.2207 25.73677 623.9689 43.49172 -0.7481689     50.53624 
1 1 1 -4  22 9  o 857.6014 19.50972 143.3172       6.497771      146.2617       7.579578      135.1540       12.62043  865.8567 22.54089 828.3998 39.22890 37.45685       45.24377 
1 1 1 -4  22 10 f 587.5323 28.76586 67.56575       6.563524      72.23150       8.541318      60.83756       10.25684  604.9521 36.52730 551.5582 48.37300 53.39398       60.61510 
1 1 1 -4  22 11 o 1002.018 21.57048 195.8762       8.393888      216.2984       10.86441      165.6335       13.22105  1051.680 26.60079 917.2322 37.11579 134.4479       45.66381 
1 1 1 -4  22 12 o 479.1383 32.00624 45.25642       5.921308      51.50903       7.372021      33.88850       9.940235  509.9376 37.48842 404.1776 65.57530 105.7599       75.53477 
1 1 1 -4  22 13 o 833.7941 20.02992 135.6097       6.485836      148.2651       9.435475      124.2737       8.930091  869.9709 27.92744 796.2374 28.87921 73.73346       40.17400 
1 1 1 -4  22 14 o 684.2151 23.32231 91.51629       6.197153      101.0674       8.903486      82.54068       8.631057  716.9262 31.97847 646.3519 34.50964 70.57434       47.04825 
1 1 1 -4  22 15 o 464.9656 32.12485 42.77402       5.765253      56.91194       8.472137      30.58069       7.867945  533.6557 41.19828 385.8591 53.98349 147.7966       67.90814 
1 1 1 -4  22 16 o 623.7022 26.04567 76.35152       6.308714      86.55162       9.232858      67.41862       8.640326  659.8693 36.16662 581.2369 38.49592 78.63239       52.82007 
1 1 1 -4  22 17 o 519.9598 66.76678 57.47087       13.17065      0.000000       0.000000      57.47087       13.17065  ?        ?        519.9598 66.76678 0.000000       66.76678 
1 1 1 -4  22 18 o 847.6192 22.80558 141.0480       7.507059      137.8611       10.45340      144.4419       10.78766  833.4265 32.29700 852.9313 32.56756 -19.50476      45.86657 
1 1 1 -4  22 19 o 404.4178 39.65563 33.26028       6.148080      35.21313       8.541334      31.16059       8.856632  407.9164 55.34625 379.3429 62.28060 28.57349       83.31915 
1 1 1 -4  22 20 o 210.0775 65.12640 9.771280       5.863917      15.56415       8.222498      3.775882       8.365001  258.0479 76.54357 177.0062 73.63401 81.04167       106.2115 
1 1 1 -4  22 21 o 174.6035 70.38845 4.838180       7.347824      -0.9696004     12.97001      7.583195       8.916773  183.3824 83.36256 198.7589 78.39080 -15.37648      114.4309 
1 1 1 -4  22 22 o 230.8115 63.97786 12.42634       5.933716      7.275836       8.088673      18.42761       8.731194  190.4318 74.80339 271.2905 78.43476 -80.85875      108.3862 
1 1 1 -4  22 23 o 173.8097 64.38245 6.481486       5.770155      4.146876       7.902122      9.148147       8.445406  168.1350 70.86269 199.2740 76.95064 -31.13904      104.6084 
1 1 1 -4  22 24 o 142.2192 59.81929 2.543415       5.612730      0.6604744      7.853137      4.509596       8.024845  148.4395 66.39507 167.6676 71.07810 -19.22804      97.26460 
1 1 1 -4  23 1  o 893.1681 20.20893 155.4126       7.009782      163.2441       11.14913      150.2931       9.014353  913.2792 31.43472 877.3105 26.45777 35.96863       41.08717 
1 1 1 -4  23 2  o 189.3809 56.10124 7.258282       4.419205      3.871948       6.008889      11.24764       6.521996  168.1338 64.91305 233.6574 67.85742 -65.52362      93.90598 
1 1 1 -4  23 3  o 447.3077 35.06347 39.48225       6.042229      43.25230       11.17628      37.92527       7.182351  460.1393 64.29979 436.6043 42.91396 23.53494       77.30505 
1 1 1 -4  23 4  o 150.9213 56.33445 3.516024       4.434471      0.5998141      6.033525      6.941934       6.539577  146.1465 61.77506 195.9008 69.07906 -49.75429      92.67186 
1 1 1 -4  23 5  o 540.4787 23.84483 57.00508       5.004961      58.04802       5.905035      54.34461       9.431302  544.1780 28.03703 522.0019 47.02835 22.17615       54.75163 
1 1 1 -4  23 6  o 189.3450 61.12605 7.044122       5.118443      7.044122       5.118443      0.000000       0.000000  189.3450 61.12605 ?        ?        0.000000       61.12605 
1 1 1 -4  23 7  o 812.9335 22.47904 128.9275       7.096771      128.9275       7.096771      0.000000       0.000000  812.9335 22.47904 ?        ?        0.000000       22.47904 
1 1 1 -4  23 8  o 370.0837 33.87942 27.10488       4.815236      27.68466       5.591728      25.44133       9.471809  372.8869 39.20055 347.5107 72.52774 25.37619       82.44366 
1 1 1 -4  23 9  o 632.7065 23.24016 78.15169       5.710439      73.61267       6.585684      91.90486       11.46361  613.3753 27.64691 680.2189 43.62552 -66.84357      51.64821 
1 1 1 -4  23 10 o 490.8820 28.58055 47.34629       5.424906      42.83956       6.257943      60.97431       10.88222  465.4888 34.87077 550.5662 51.49357 -85.07739      62.18969 
1 1 1 -4  23 11 o 240.1372 56.38392 12.03493       5.168413      14.00649       6.080351      6.900958       9.811849  258.2556 61.50554 213.7658 82.83154 44.48978       103.1697 
1 1 1 -4  23 12 o 916.6866 24.15017 164.3172       8.597440      152.8935       10.75901      184.4985       14.30026  882.1214 31.40624 966.3373 38.10546 -84.21594      49.37994 
1 1 1 -4  23 13 o 399.0014 40.02799 31.86709       6.118872      31.92842       7.491871      31.74421       10.60439  396.2165 49.78834 385.4218 73.53008 10.79471       88.80063 
1 1 1 -4  23 14 o 447.3536 32.91734 39.69557       5.678611      43.19672       8.061597      36.24746       8.000291  462.4991 45.47081 421.6617 49.81798 40.83746       67.44943 
1 1 1 -4  23 15 o 205.7670 61.80107 8.910594       5.335507      11.64608       7.581169      6.225925       7.510423  233.7055 74.28162 192.1868 72.97094 41.51869       104.1274 
1 1 1 -4  23 16 o 312.5224 57.98119 20.72900       6.778038      20.78396       8.343645      20.62234       11.62300  306.9801 71.34413 298.1941 91.56597 8.786011       116.0789 
1 1 1 -4  23 17 o 362.1793 50.69916 27.34844       6.935589      38.12230       8.555527      6.696694       11.84512  427.4861 52.64690 215.0027 88.35691 212.4835       102.8525 
1 1 1 -4  23 18 o 323.8856 48.30583 21.95572       5.890208      20.17778       8.412658      23.66546       8.249755  297.3946 73.30821 326.2506 67.34445 -28.85599      99.54581 
1 1 1 -4  23 19 o 635.2669 26.97508 80.03087       6.654982      83.06071       9.077703      76.51034       9.785200  640.6490 36.63823 611.3336 41.46091 29.31543       55.32962 
1 1 1 -4  23 20 o 473.6153 40.68156 46.28328       7.409950      36.78838       11.68297      52.67345       9.584397  391.2381 79.60119 498.0106 50.24293 -106.7725      94.13129 
1 1 1 -4  23 21 o 433.0799 37.73365 38.72199       6.282949      37.76636       8.833262      39.70053       8.938536  413.1447 56.53783 424.5719 55.54262 -11.42722      79.25597 
1 1 1 -4  23 22 o 214.8483 63.68825 11.00963       5.693895      8.781318       7.806436      13.54270       8.323147  195.6986 74.37336 229.6352 78.07832 -33.93663      107.8314 
1 1 1 -4  23 23 o 110.4130 51.59396 -3.414558      5.481224      1.093797       7.655592      -8.156433      7.851358  149.1708 66.21176 118.5310 57.14783 30.63985       87.46355 
1 1 1 -4  24 1  o 951.2054 18.16510 176.1968       6.710271      172.0394       9.186127      180.9532       9.825633  938.6689 25.19950 962.4447 26.28795 -23.77576      36.41526 
1 1 1 -4  24 2  f 292.2043 53.61677 17.49760       5.860145      32.99868       11.21102      11.66999       6.873999  396.5763 75.55192 237.6142 69.85400 158.9621       102.8964 
1 1 1 -4  24 3  f 804.8407 19.69070 126.2223       6.154590      122.5230       8.444528      130.4137       8.988750  791.6537 27.46706 816.5685 28.34515 -24.91479      39.47007 
1 1 1 -4  24 4  o 742.0797 31.20423 107.8908       8.992737      0.000000       0.000000      107.8908       8.992737  ?        ?        742.0797 31.20423 0.000000       31.20423 
1 1 1 -4  24 5  o 552.0261 23.74699 59.48836       5.090919      58.66055       5.972921      61.68694       9.734089  546.8619 28.22046 556.4730 45.43915 -9.611084      53.48935 
1 1 1 -4  24 6  o 261.3667 46.52761 13.92589       4.549576      11.70591       5.343748      19.77426       8.673386  237.0440 58.42318 305.2890 73.94006 -68.24504      94.23587 
1 1 1 -4  24 7  o 341.0331 36.81102 23.14908       4.797999      20.44174       5.589462      30.73000       9.353202  317.8064 46.67854 385.0530 64.85244 -67.24658      79.90447 
1 1 1 -4  24 8  o 333.9808 45.14682 22.50274       5.705592      22.50274       5.705592      0.000000       0.000000  333.9808 45.14682 ?        ?        0.000000       45.14682 
1 1 1 -4  24 9  o 644.4521 23.68145 81.15800       5.926892      78.89008       6.841014      87.98387       11.86822  634.6351 27.75674 663.6062 46.34279 -28.97113      54.01936 
1 1 1 -4  24 10 o 435.5938 32.27232 37.50794       5.420497      42.42142       6.403092      25.08161       10.18279  462.4460 35.93559 340.7303 78.56069 121.7158       86.38952 
1 1 1 -4  24 11 o 173.4318 61.39179 5.493009       5.169873      1.947070       5.948384      16.44238       10.45269  152.3446 62.61126 276.1830 87.16276 -123.8383      107.3197 
1 1 1 -4  24 12 o 674.6121 26.92649 89.31923       7.054428      98.25391       8.610286      71.07565       12.30363  706.2018 31.39502 590.0970 54.29768 116.1048       62.72070 
1 1 1 -4  24 13 o 181.8926 63.30370 6.348536       5.481581      4.184045       6.480774      11.78982       10.27542  171.1946 67.04374 241.4939 86.43631 -70.29932      109.3897 
1 1 1 -4  24 14 o 172.8293 66.60326 4.686674       6.316803      -22.04442      12.09557      14.71126       7.407151  134.5314 66.16858 258.8116 71.38085 -124.2802      97.33194 
1 1 1 -4  24 15 o 145.6967 62.38250 0.6644820      6.291656      8.954857       7.632648      -16.91089      11.11323  210.3772 74.58130 135.1202 65.80891 75.25696       99.46448 
1 1 1 -4  24 16 o 183.9857 67.91877 6.348094       6.410530      5.665347       7.796072      7.773501       11.26458  186.9011 73.43111 216.4339 87.18732 -29.53287      113.9902 
1 1 1 -4  24 17 o 418.4754 36.97674 35.48791       5.947506      36.76857       8.566040      34.29593       8.264168  416.4294 54.25630 401.9570 54.33335 14.47247       76.78450 
1 1 1 -4  24 18 o 487.2650 32.04660 47.73464       6.030391      48.31823       8.379869      47.10780       8.684826  482.2250 45.27671 474.3624 47.79478 7.862549       65.83556 
1 1 1 -4  24 19 o 119.6949 55.46099 -3.643463      6.128131      -18.53294      9.883164      5.656803       7.810952  117.7411 58.26506 181.2173 72.74220 -63.47623      93.20002 
1 1 1 -4  24 20 o 297.7065 57.46915 19.96128       6.403687      3.427499       9.756928      32.47278       8.487541  177.0982 76.76747 379.7000 59.51490 -202.6018      97.13531 
1 1 1 -4  24 21 o 285.1301 54.30561 18.34637       5.793732      21.05114       7.819550      15.05418       8.626976  293.0652 69.71871 239.7122 79.47407 53.35298       105.7205 
1 1 1 -4  24 22 o 337.8349 46.18283 24.93438       5.900476      22.05929       8.166873      28.07400       8.534315  294.6910 71.97980 339.2579 67.15225 -44.56689      98.44041 
1 1 1 -4  25 1  o 1059.860 21.67190 219.1247       8.920177      206.7901       15.50389      225.2282       10.90611  1024.365 38.97249 1073.394 26.16269 -49.02966      46.93976 
1 1 1 -4  25 2  o 631.6990 23.03538 77.89521       5.651106      74.29790       7.632053      82.26107       8.407904  614.6100 32.08653 646.3997 33.60928 -31.78967      46.46643 
1 1 1 -4  25 3  o 457.5458 53.33942 42.33998       9.299979      0.000000       0.000000      42.33998       9.299979  ?        ?        457.5458 53.33942 0.000000       53.33942 
1 1 1 -4  25 4  o 344.4273 37.75068 23.64569       4.966787      25.84006       6.730137      21.02118       7.360280  356.9819 49.91041 317.7920 61.86359 39.18988       79.48681 
1 1 1 -4  25 5  o 631.1310 21.79257 77.74560       5.341410      81.02434       6.316708      69.51839       10.00608  643.7323 25.26722 590.6429 43.93695 53.08936       50.68420 
1 1 1 -4  25 6  o 670.2119 22.16366 87.70996       5.768747      87.25460       6.826781      88.84707       10.78796  667.7057 26.32709 668.5873 41.75733 -0.8815308     49.36386 
1 1 1 -4  25 7  o 233.6770 54.42524 11.39689       4.847100      10.17316       5.659422      14.76559       9.389888  220.6467 62.95297 264.0755 82.50253 -43.42885      103.7774 
1 1 1 -4  25 8  o 975.0439 18.78048 185.4457       7.111463      193.2652       8.342141      164.6526       13.60345  994.6631 21.59601 912.2123 38.39947 82.45081       44.05573 
1 1 1 -4  25 9  o 126.5656 54.54981 -0.1371960     4.870199      3.213360       5.630983      -10.08461      9.702437  157.9858 62.29974 140.7117 66.63985 17.27412       91.22569 
1 1 1 -4  25 10 o 224.6679 65.89256 10.69366       6.122846      10.69366       6.122846      0.000000       0.000000  224.6679 65.89256 ?        ?        0.000000       65.89256 
1 1 1 -4  25 11 o 554.3959 27.33968 60.42780       5.886287      62.32454       6.843693      55.03557       11.53905  561.0461 31.53763 514.9744 58.74891 46.07166       66.67876 
1 1 1 -4  25 12 o 247.4539 57.84132 13.07799       5.458797      13.49536       6.459224      12.03491       10.21133  249.3402 65.76105 241.2825 86.18695 8.057663       108.4099 
1 1 1 -4  25 13 o 334.0681 45.73275 22.95500       5.777430      24.36967       6.734205      19.01042       11.24499  341.5103 52.45281 286.5150 90.40395 54.99524       104.5188 
1 1 1 -4  25 14 o 660.1881 25.95486 85.92540       6.654484      92.56496       7.857926      69.09079       12.51238  683.6769 29.59573 573.5955 56.92195 110.0814       64.15618 
1 1 1 -4  25 15 o 286.8091 60.70336 17.98488       6.550554      18.52611       8.396207      17.14301       10.47159  284.0023 75.01051 269.2398 87.47767 14.76254       115.2342 
1 1 1 -4  25 16 o 425.7059 42.20484 37.27973       6.885547      23.54919       11.66759      44.61698       8.529119  307.1898 91.19309 462.2458 48.22189 -155.0561      103.1578 
1 1 1 -4  25 17 o 190.5066 62.76469 7.917234       5.383799      9.882458       7.531052      5.863156       7.699424  210.6454 74.14677 183.2812 72.66629 27.36426       103.8178 
1 1 1 -4  25 18 o 227.8007 61.61269 11.90372       5.582162      0.6341372      7.713952      24.29293       8.088069  152.8698 67.21922 324.1563 66.47939 -171.2865      94.54063 
1 1 1 -4  25 19 o 315.7663 51.46501 21.89984       6.093706      20.33558       9.296658      23.07819       8.068794  280.5223 80.88589 310.8919 68.66315 -30.36957      106.0997 
1 1 1 -4  25 20 o 307.8522 45.47625 20.51881       5.273269      16.87873       6.978786      25.36284       8.050583  262.4005 67.94682 325.8031 65.89148 -63.40265      94.64913 
1 1 1 -4  25 21 o 106.4122 49.84475 -3.520494      5.168556      1.712586       7.127048      -9.325787      7.506597  148.4515 64.95944 112.3284 54.56618 36.12305       84.83630 
1 1 1 -4  26 1  f 241.3679 56.03492 12.18069       5.151536      6.836678       6.381274      22.18053       8.729119  192.6178 68.20377 322.5327 71.56078 -129.9148      98.85696 
1 1 1 -4  26 2  o 454.6186 32.54035 40.85280       5.707107      44.67287       7.107942      33.92180       9.574283  473.7383 38.98058 404.1262 63.06372 69.61209       74.13851 
1 1 1 -4  26 3  o 432.3191 31.51062 36.93309       5.253986      40.57179       7.166241      32.70399       7.725785  450.4757 41.42724 401.0753 50.73551 49.40039       65.50044 
1 1 1 -4  26 4  o 909.8448 19.76798 161.5627       6.984857      170.0376       9.819655      152.8831       9.937560  931.3120 27.15020 882.4940 28.99613 48.81799       39.72290 
1 1 1 -4  26 5  o 633.0782 26.09274 78.54607       6.415124      75.02235       8.031673      84.75550       10.66181  615.9500 33.70407 651.4697 42.37176 -35.51965      54.14176 
1 1 1 -4  26 6  o 232.4743 53.36415 11.32878       4.715923      11.13372       5.660713      11.77128       8.525933  229.2398 62.06257 238.2810 79.00765 -9.041214      100.4688 
1 1 1 -4  26 7  o 375.5044 33.97288 28.07626       4.900571      33.65545       5.791745      14.01483       9.194727  410.5849 36.70995 255.6086 81.86521 154.9763       89.71919 
1 1 1 -4  26 8  o 634.4386 23.53875 78.86694       5.799640      77.13007       6.754258      83.74181       11.31552  626.3129 27.76888 644.4417 45.50545 -18.12878      53.30907 
1 1 1 -4  26 9  o 565.1042 25.71927 62.72876       5.644365      59.41454       6.471611      73.26340       11.53801  547.8806 30.53717 599.4229 50.02133 -51.54230      58.60591 
1 1 1 -4  26 10 o 389.7799 35.50650 30.43788       5.315763      30.78525       6.172853      29.44104       10.45694  389.8956 41.40049 364.4324 76.33098 25.46323       86.83559 
1 1 1 -4  26 11 o 389.3234 37.47663 30.54038       5.596292      32.78704       6.469845      23.86493       11.15232  401.6548 42.10353 320.2090 87.28795 81.44577       96.91178 
1 1 1 -4  26 12 o 451.0890 39.03471 41.14455       6.770794      41.14455       6.770794      0.000000       0.000000  451.0890 39.03471 ?        ?        0.000000       39.03471 
1 1 1 -4  26 13 o 189.6360 64.62328 7.442900       5.701830      9.224554       6.760565      3.052913       10.61214  207.9090 70.37005 189.7305 81.12136 18.17845       107.3900 
1 1 1 -4  26 14 o 136.6648 61.16812 -1.483948      6.676887      -1.483948      6.676887      0.000000       0.000000  136.6648 61.16812 ?        ?        0.000000       61.16812 
1 1 1 -4  26 15 o 604.8059 27.97515 72.75354       6.570771      73.95169       7.632988      69.32486       12.91227  606.4621 32.52743 564.9102 59.76411 41.55188       68.04250 
1 1 1 -4  26 16 o 92.42920 45.13228 -8.792468      5.322844      -9.387172      7.542159      -8.202322      7.513201  115.9069 55.91521 118.9218 56.96231 -3.014885      79.81989 
1 1 1 -4  26 17 o 204.7730 67.04504 9.719967       6.146694      22.18151       10.04404      2.258576       7.771993  292.8955 83.96437 160.2510 68.98987 132.6445       108.6721 
1 1 1 -4  26 18 o 241.7333 65.23190 13.97381       6.265678      4.327044       9.942062      20.32968       8.069988  180.0383 77.76711 286.8436 72.42941 -106.8054      106.2720 
1 1 1 -4  26 19 o 98.66956 47.23951 -5.640361      5.153734      -4.168074      7.063729      -7.316165      7.536148  124.2995 58.23854 118.7326 56.91856 5.566917       81.43372 
1 1 1 -4  27 1  o 551.2490 25.93313 59.61206       5.551761      52.73064       7.164202      69.95651       8.783793  514.8372 36.05956 592.4359 38.38444 -77.59869      52.66552 
1 1 1 -4  27 2  o 425.7930 31.78199 35.94605       5.217546      30.34617       6.981100      43.03220       7.853079  385.9918 47.57835 461.8241 44.33073 -75.83234      65.03010 
1 1 1 -4  27 3  o 703.2791 22.21528 96.79722       6.067469      93.89320       8.098558      100.5129       9.160659  690.3616 30.20669 713.2665 33.07097 -22.90485      44.78988 
1 1 1 -4  27 4  o 990.7026 19.25583 191.7499       7.408557      194.4024       10.14583      188.7201       10.84350  994.9330 26.25824 979.2983 28.51192 15.63470       38.76113 
1 1 1 -4  27 5  o 838.0612 22.52476 137.5701       7.331012      140.3316       9.258116      132.9277       12.00389  844.3464 28.23410 817.3930 37.81493 26.95343       47.19251 
1 1 1 -4  27 6  o 100.8431 47.02331 -3.879379      4.515405      -4.113648      5.291358      -3.251688      8.661301  110.5838 51.34377 151.6214 68.60596 -41.03761      85.69108 
1 1 1 -4  27 7  o 142.0499 56.67276 2.453852       4.710259      4.831176       5.615708      -3.187499      8.650713  168.8189 63.32023 151.3874 68.52627 17.43144       93.30220 
1 1 1 -4  27 8  o 435.9900 30.93430 37.80478       5.203747      36.31416       6.071827      41.92864       10.09919  425.0504 37.15672 445.6645 59.86511 -20.61404      70.45888 
1 1 1 -4  27 9  o 655.5705 25.42202 84.62527       6.472282      90.30880       7.762447      71.66131       11.72354  675.5690 29.58700 588.6760 51.80856 86.89301       59.66169 
1 1 1 -4  27 10 o 442.4679 31.94516 39.11067       5.452369      37.62894       6.276711      43.66649       11.00605  431.5476 37.83397 449.2867 64.96461 -17.73914      75.17853 
1 1 1 -4  27 11 o 420.2367 34.84569 35.56796       5.635536      36.84393       6.491424      31.66369       11.35509  425.5037 39.74353 368.7062 81.47201 56.79752       90.64897 
1 1 1 -4  27 12 o 285.5279 51.38065 17.39840       5.487888      19.07476       6.424799      12.87494       10.55384  295.8858 57.98576 239.0282 87.31534 56.85757       104.8156 
1 1 1 -4  27 13 o 234.0136 68.15529 12.53628       6.570992      12.53628       6.570992      0.000000       0.000000  234.0136 68.15529 ?        ?        0.000000       68.15529 
1 1 1 -4  27 14 f 153.0674 64.02592 2.482868       6.373889      2.482868       6.373889      0.000000       0.000000  153.0674 64.02592 ?        ?        0.000000       64.02592 
1 1 1 -4  27 15 o 259.0139 59.73689 15.25614       5.886226      20.92472       6.921535      0.4444633      11.18839  303.8437 60.78036 174.9039 78.66352 128.9397       99.40926 
1 1 1 -4  27 16 o 140.9009 60.16448 1.600447       5.823455      -0.9877498     6.713160      9.469677       11.70562  135.3961 60.91032 210.7370 87.33849 -75.34084      106.4804 
1 1 1 -4  27 17 o 364.6205 45.63961 28.61113       6.321079      35.74335       10.56194      24.63095       7.890105  380.3743 74.16416 322.3109 65.27278 58.06342       98.79706 
1 1 1 -4  27 18 o 157.3555 60.66707 4.863188       5.242800      4.078188       7.142019      5.780531       7.720616  162.0585 67.77937 174.6560 71.50349 -12.59755      98.52306 
1 1 1 -4  28 1  o 141.5675 57.09958 2.223425       4.837945      3.296332       6.150339      0.4820592      7.835434  161.4635 64.64161 159.9490 69.06396 1.514557       94.59582 
1 1 1 -4  28 2  o 478.5409 29.69083 45.39301       5.490608      45.08481       7.320882      45.78925       8.300915  472.9175 40.24380 474.1772 45.64100 -1.259735      60.84952 
1 1 1 -4  28 3  o 633.9918 36.32816 80.34423       8.907207      0.000000       0.000000      80.34423       8.907207  ?        ?        633.9918 36.32816 0.000000       36.32816 
1 1 1 -4  28 4  o 211.2371 58.88018 9.576918       5.011088      11.08154       6.798436      7.786926       7.415156  226.0647 70.13100 201.0121 73.22530 25.05261       101.3918 
1 1 1 -4  28 5  o 387.0834 38.84950 30.30308       5.761276      33.80516       7.390543      24.87826       9.198266  405.0109 47.91611 334.2456 72.91346 70.76529       87.24865 
1 1 1 -4  28 6  o 207.1481 56.49282 9.228105       4.670151      7.269741       5.539109      14.04272       8.685087  188.4501 63.69703 249.9221 79.51353 -61.47206      101.8809 
1 1 1 -4  28 7  o 441.3342 30.38638 38.81698       5.176308      38.49425       6.078568      39.66853       9.873822  437.1928 36.12503 430.4875 60.74891 6.705322       70.67848 
1 1 1 -4  28 8  o 168.6162 59.12383 5.586930       4.785865      4.716322       5.558443      8.082100       9.410049  165.5387 62.79450 208.8749 81.06710 -43.33621      102.5428 
1 1 1 -4  28 9  o 328.8231 39.74224 22.16167       4.972103      30.28274       5.799723      -0.3585910     9.657999  385.2051 39.32052 167.6911 74.40346 217.5140       84.15449 
1 1 1 -4  28 10 o 319.8526 42.81815 21.22923       5.185240      25.11876       6.070778      10.73763       9.970506  346.5582 46.26167 223.7664 84.28541 122.7919       96.14661 
1 1 1 -4  28 11 o 299.6583 47.43364 19.02773       5.336226      17.45083       6.170836      23.70316       10.62561  280.9104 58.46701 309.0789 85.59275 -28.16846      103.6557 
1 1 1 -4  28 12 o 309.2600 52.94645 20.77887       6.130324      20.77887       6.130324      0.000000       0.000000  309.2600 52.94645 ?        ?        0.000000       52.94645 
1 1 1 -4  28 13 o 164.8499 65.56160 4.588613       6.285409      4.588613       6.285409      0.000000       0.000000  164.8499 65.56160 ?        ?        0.000000       65.56160 
1 1 1 -4  28 14 o 448.9069 35.37046 41.37257       6.116351      45.03043       7.140432      31.29305       11.85307  465.0546 39.92304 343.5320 88.34740 121.5226       96.94902 
1 1 1 -4  28 15 o 200.5430 69.66145 9.509079       6.636410      9.509079       6.636410      0.000000       0.000000  200.5430 69.66145 ?        ?        0.000000       69.66145 
1 1 1 -4  28 16 o 204.1346 72.17342 10.15729       7.143134      7.751048       8.809755      14.77515       12.20434  190.6606 76.99888 231.6076 91.59464 -40.94701      119.6595 
1 1 1 -4  29 1  o 341.3990 36.72821 23.60193       4.792957      17.00204       6.313090      32.58249       7.364192  279.6808 59.92669 395.9851 48.92778 -116.3044      77.36366 
1 1 1 -4  29 2  f 376.7134 33.61062 28.51845       4.865529      29.53650       6.602957      27.30892       7.197176  378.0963 45.91029 359.8204 53.10069 18.27591       70.19571 
1 1 1 -4  29 3  o 279.9611 66.47055 17.46528       7.119081      0.000000       0.000000      17.46528       7.119081  ?        ?        279.9611 66.47055 0.000000       66.47055 
1 1 1 -4  29 4  o 155.3329 58.31247 4.175807       4.764594      5.213419       6.454054      2.933016       7.063406  174.8088 67.33508 164.1200 67.91724 10.68886       95.63872 
1 1 1 -4  29 5  o 156.9080 60.57692 3.989029       5.232786      8.762885       6.681875      -3.582058      8.414781  202.9698 69.93390 144.9709 66.37630 57.99889       96.41869 
1 1 1 -4  29 6  o 234.0387 52.29478 11.83728       4.633351      7.262292       5.371434      25.13776       9.158600  185.8200 62.72594 330.8621 73.21548 -145.0421      96.41084 
1 1 1 -4  29 7  o 513.9113 26.88819 52.51752       5.347683      50.80083       6.209546      57.44622       10.52154  502.9941 31.95422 520.8166 52.74701 -17.82245      61.67105 
1 1 1 -4  29 8  o 136.1157 56.10669 1.927924       4.794153      1.652373       5.623628      2.660830       9.171473  142.2136 59.85030 175.0590 75.14597 -32.84540      96.06755 
1 1 1 -4  29 9  o 399.3692 34.11523 32.39207       5.240395      35.66679       6.177331      23.98561       9.897378  416.7008 38.61103 312.8740 80.86823 103.8268       89.61296 
1 1 1 -4  29 10 o 143.8965 57.98013 2.886500       4.982831      5.350941       5.873525      -3.441378      9.411714  168.7302 64.41932 150.4523 69.36636 18.27795       94.66541 
1 1 1 -4  29 11 o 369.1378 45.61202 28.91434       6.399672      28.91434       6.399672      0.000000       0.000000  369.1378 45.61202 ?        ?        0.000000       45.61202 
1 1 1 -4  29 12 o 195.4375 67.98756 8.738880       6.322422      8.738880       6.322422      0.000000       0.000000  195.4375 67.98756 ?        ?        0.000000       67.98756 
1 1 1 -4  29 13 o 292.8655 50.67945 18.89951       5.555390      15.24092       6.434678      29.60953       11.00944  252.7472 65.14480 335.2678 84.56610 -82.52055      106.7486 
1 1 1 -4  30 1  o 438.7826 29.26081 38.50733       4.957537      40.21341       6.712613      36.46014       7.353115  443.3018 39.40173 418.1080 46.04856 25.19388       60.60500 
1 1 1 -4  30 2  o 418.6101 43.37477 36.30311       6.949066      36.30311       6.949066      0.000000       0.000000  418.6101 43.37477 ?        ?        0.000000       43.37477 
1 1 1 -4  30 3  o 360.1580 36.89116 26.50050       5.087111      28.79316       7.145348      24.14396       7.244194  367.4023 51.49316 331.8524 58.33997 35.54993       77.81451 
1 1 1 -4  30 4  o 347.8102 37.39636 24.79473       4.971907      26.19838       6.793183      23.17541       7.296435  349.7884 51.55388 323.2554 60.34079 26.53293       79.36507 
1 1 1 -4  30 5  o 249.9310 57.15868 13.89423       5.427355      21.95297       6.851157      0.3158481      8.893127  315.2910 58.09360 161.7771 71.60636 153.5139       92.20812 
1 1 1 -4  30 6  o 278.2522 45.89743 16.46753       4.786745      17.37324       5.703885      14.31062       8.802227  281.4491 54.15054 242.4834 80.27170 38.96568       96.82885 
1 1 1 -4  30 7  o 474.0493 28.59833 45.09285       5.240274      43.60788       6.138373      49.08323       10.06236  462.8429 34.39589 474.3800 55.67799 -11.53708      65.44552 
1 1 1 -4  30 8  o 392.0807 34.82557 31.45195       5.247554      36.37508       6.199243      19.00749       9.856121  419.5604 38.47522 271.4971 84.47768 148.0633       92.82684 
1 1 1 -4  30 9  o 285.5552 46.98318 17.56960       5.029019      17.97328       5.852075      16.42961       9.834269  283.9009 55.06507 251.5008 84.87381 32.40012       101.1718 
1 1 1 -4  30 10 o 427.5268 38.63313 37.98378       6.345030      37.98378       6.345030      0.000000       0.000000  427.5268 38.63313 ?        ?        0.000000       38.63313 
1 1 1 -4  30 11 o 362.6618 45.80683 28.22391       6.307604      28.22391       6.307604      0.000000       0.000000  362.6618 45.80683 ?        ?        0.000000       45.80683 
1 1 1 -4  31 1  o 175.3328 59.90133 6.575754       4.899142      7.102091       6.122813      5.639096       8.167878  183.6600 66.59470 182.3774 73.96987 1.282623       99.53088 
1 1 1 -4  31 2  o 357.1709 35.24454 26.11936       4.824985      30.33481       6.670642      21.49393       6.987500  378.3900 46.36419 308.9010 60.41152 69.48901       76.15241 
1 1 1 -4  31 3  o 198.6616 57.83180 8.887950       4.732133      8.267817       6.527584      9.574857       6.870035  193.6397 68.93668 204.7125 70.89018 -11.07280      98.88217 
1 1 1 -4  31 4  o 169.9296 58.84484 6.132854       4.733727      5.347738       6.618311      6.955193       6.773381  171.7450 67.59970 183.8403 69.41853 -12.09525      96.89506 
1 1 1 -4  31 5  o 171.0377 62.50438 6.030984       5.408962      -10.99233      6.773003      36.00379       8.987169  102.9847 50.41832 400.8789 59.53581 -297.8943      78.01614 
1 1 1 -4  31 6  o 136.1973 55.45165 2.426882       4.611197      -0.7262831     5.437779      10.49861       8.700246  124.5044 55.50063 211.7535 78.93394 -87.24912      96.49294 
1 1 1 -3  0  1  o 311.9166 15.39540 19.05418       1.854547      19.05418       1.854547      19.05418       1.854547  311.9166 15.39540 311.9166 15.39540 0.000000       0.000000 
1 1 1 -3  0  2  f 499.5789 14.88665 48.64718       2.882409      48.64718       2.882409      48.64718       2.882409  499.5789 14.88665 499.5789 14.88665 0.000000       0.000000 
1 1 1 -3  0  3  o 428.0200 15.94205 35.76461       2.641598      35.76461       2.641598      35.76461       2.641598  428.0200 15.94205 428.0200 15.94205 0.000000       0.000000 
1 1 1 -3  0  4  f 890.5084 16.07487 154.2991       5.555132      154.2991       5.555132      154.2991       5.555132  890.5084 16.07487 890.5084 16.07487 0.000000       0.000000 
1 1 1 -3  0  5  o 747.1561 16.17171 108.6522       4.687439      108.6522       4.687439      108.6522       4.687439  747.1561 16.17171 747.1561 16.17171 0.000000       0.000000 
1 1 1 -3  0  6  o 646.6853 16.72931 81.43502       4.195092      81.43502       4.195092      81.43502       4.195092  646.6853 16.72931 646.6853 16.72931 0.000000       0.000000 
1 1 1 -3  0  7  o 129.3009 49.42308 4.427127       2.340894      4.427127       2.340894      4.427127       2.340894  129.3009 49.42308 129.3009 49.42308 -0.000000      0.000000 
1 1 1 -3  0  8  o 608.7045 17.95317 72.18842       4.235648      72.18842       4.235648      72.18842       4.235648  608.7045 17.95317 608.7045 17.95317 -0.000000      0.000000 
1 1 1 -3  0  9  o 905.5066 17.77602 159.5132       6.245632      159.5132       6.245632      159.5132       6.245632  905.5066 17.77602 905.5066 17.77602 0.000000       0.000000 
1 1 1 -3  0  10 o 1773.940 22.51768 612.0914       15.50718      612.0914       15.50718      612.0914       15.50718  1773.940 22.51768 1773.940 22.51768 0.000000       0.000000 
1 1 1 -3  0  11 o 594.4580 21.02200 68.95734       4.839381      68.95734       4.839381      68.95734       4.839381  594.4580 21.02200 594.4580 21.02200 0.000000       0.000000 
1 1 1 -3  0  12 o 172.3456 60.35324 7.608480       3.658867      7.608480       3.658867      7.608480       3.658867  172.3456 60.35324 172.3456 60.35324 -0.000000      0.000000 
1 1 1 -3  0  13 o 420.0300 38.53496 35.29897       6.164202      35.29897       6.164202      35.29897       6.164202  420.0300 38.53496 420.0300 38.53496 0.000000       0.000000 
1 1 1 -3  0  14 o 556.0731 33.70211 61.01671       7.216848      61.01671       7.216848      61.01671       7.216848  556.0731 33.70211 556.0731 33.70211 0.000000       0.000000 
1 1 1 -3  0  15 o 241.8024 52.59180 12.97688       4.327940      12.97688       4.327940      12.97688       4.327940  241.8024 52.59180 241.8024 52.59180 -0.000000      0.000000 
1 1 1 -3  0  16 o 76.44712 51.40512 -1.707348      4.344674      -1.707348      4.344674      -1.707348      4.344674  76.44712 51.40512 76.44712 51.40512 0.000000       0.000000 
1 1 1 -3  0  17 o 485.1936 42.13142 47.26571       7.800994      47.26571       7.800994      47.26571       7.800994  485.1936 42.13142 485.1936 42.13142 0.000000       0.000000 
1 1 1 -3  0  18 o 233.8202 88.37711 14.81281       7.522301      14.81281       7.522301      14.81281       7.522301  233.8202 88.37711 233.8202 88.37711 0.000000       0.000000 
1 1 1 -3  0  19 o 622.1337 27.69925 75.92155       6.662171      75.92155       6.662171      75.92155       6.662171  622.1337 27.69925 622.1337 27.69925 0.000000       0.000000 
1 1 1 -3  0  20 o 1322.860 23.16694 340.9846       11.89351      340.9846       11.89351      340.9846       11.89351  1322.860 23.16694 1322.860 23.16694 -0.000000      0.000000 
1 1 1 -3  0  21 f 1422.033 23.97720 393.9507       13.23298      393.9507       13.23298      393.9507       13.23298  1422.033 23.97720 1422.033 23.97720 0.000000       0.000000 
1 1 1 -3  0  22 o 1221.143 24.38645 290.5549       11.55453      290.5549       11.55453      290.5549       11.55453  1221.143 24.38645 1221.143 24.38645 0.000000       0.000000 
1 1 1 -3  0  23 o 589.0445 34.38699 68.35587       7.804939      68.35587       7.804939      68.35587       7.804939  589.0445 34.38699 589.0445 34.38699 -0.000000      0.000000 
1 1 1 -3  0  24 o 96.81437 64.90308 -2.434636      6.828145      -2.434636      6.828145      -2.434636      6.828145  96.81437 64.90308 96.81437 64.90308 -0.000000      0.000000 
1 1 1 -3  0  25 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -3  0  26 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -3  0  27 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -3  0  28 o 194.6428 95.07667 11.51350       8.488948      11.51350       8.488948      11.51350       8.488948  194.6428 95.07667 194.6428 95.07667 0.000000       0.000000 
1 1 1 -3  0  29 o 83.66674 59.65466 -11.73197      8.588430      -11.73197      8.588430      -11.73197      8.588430  83.66674 59.65466 83.66674 59.65466 0.000000       0.000000 
1 1 1 -3  0  30 o 130.4175 88.03944 -3.514271      12.98094      -3.514271      12.98094      -3.514271      12.98094  130.4175 88.03944 130.4175 88.03944 0.000000       0.000000 
1 1 1 -3  0  31 o 208.4607 99.29384 14.08691       9.187521      14.08691       9.187521      14.08691       9.187521  208.4607 99.29384 208.4607 99.29384 -0.000000      0.000000 
1 1 1 -3  0  32 o 125.7013 81.55341 1.669266       9.479402      1.669266       9.479402      1.669266       9.479402  125.7013 81.55341 125.7013 81.55341 0.000000       0.000000 
1 1 1 -3  0  33 o 223.7931 117.3896 20.11862       13.46616      20.11862       13.46616      20.11862       13.46616  223.7931 117.3896 223.7931 117.3896 0.000000       0.000000 
1 1 1 -3  0  34 o 222.3408 116.8892 21.26522       13.37400      21.26522       13.37400      21.26522       13.37400  222.3408 116.8892 222.3408 116.8892 -0.000000      0.000000 
1 1 1 -3  1  1  o 677.3141 10.28812 89.18269       2.706164      84.72975       3.720111      94.18742       3.943871  659.8104 14.51807 695.6520 14.59832 -35.84161      20.58847 
1 1 1 -3  1  2  o 221.6500 13.50730 9.593136       1.157143      10.81415       1.642758      8.390704       1.630208  234.8945 18.14909 206.4035 20.61321 28.49107       27.46441 
1 1 1 -3  1  3  o 107.2729 25.50193 2.338557       1.046816      2.136333       1.438320      2.566321       1.526452  104.4749 32.23250 113.2179 32.81341 -8.743050      45.99624 
1 1 1 -3  1  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -3  1  5  o 335.1392 13.48053 21.83864       1.754527      22.11222       2.552987      21.59378       2.415288  336.4133 19.62623 332.5209 18.78028 3.892334       27.16409 
1 1 1 -3  1  6  o 681.7150 11.68738 90.31593       3.094198      88.14517       4.350973      92.53706       4.401173  673.1855 16.64270 689.7673 16.43001 -16.58179      23.38642 
1 1 1 -3  1  7  o 684.2081 12.14851 90.97412       3.228042      88.98943       4.485214      93.10686       4.649498  676.4429 17.07356 691.9004 17.30352 -15.45746      24.30881 
1 1 1 -3  1  8  o 484.6095 13.57084 45.64362       2.554034      45.33287       3.604255      45.95704       3.619692  482.7344 19.22557 486.0485 19.17626 -3.314148      27.15422 
1 1 1 -3  1  9  o 1110.285 13.07971 239.5698       5.639760      240.5570       7.982781      238.5860       7.968887  1112.104 18.48335 1107.534 18.52731 4.569702       26.17051 
1 1 1 -3  1  10 o 927.8217 13.07750 167.3073       4.712130      173.2950       6.809841      161.8067       6.527066  943.8494 18.57832 912.0406 18.42790 31.80872       26.16756 
1 1 1 -3  1  11 o 480.6719 15.87921 44.93039       2.964187      46.56565       4.216164      43.33210       4.168235  488.9947 22.20165 471.6767 22.75516 17.31805       31.79167 
1 1 1 -3  1  12 o 305.5838 22.86994 18.29823       2.694405      20.51082       3.856632      16.18851       3.765915  322.4616 31.18599 285.5219 34.67432 36.93973       46.63556 
1 1 1 -3  1  13 o 126.7730 50.69722 1.629521       3.778471      2.906570       5.461362      0.4570042      5.233074  155.8030 61.38119 136.0711 57.52474 19.73196       84.12340 
1 1 1 -3  1  14 f 311.0130 29.48120 19.11507       3.518304      22.44044       6.111897      17.46702       4.302697  332.6664 48.75547 295.3316 38.42487 37.33475       62.07710 
1 1 1 -3  1  15 o 229.4189 35.72097 10.61680       3.079010      5.013207       4.272780      16.66986       4.440836  163.3613 55.94057 287.3024 40.96109 -123.9411      69.33367 
1 1 1 -3  1  16 o 439.9429 29.92290 38.22902       5.082056      0.000000       0.000000      38.22902       5.082056  ?        ?        439.9429 29.92290 0.000000       29.92290 
1 1 1 -3  1  17 o 290.9361 47.00102 17.34784       5.129425      15.00566       7.114386      19.88349       7.402389  264.2175 68.69479 305.8966 64.35056 -41.67905      94.12740 
1 1 1 -3  1  18 o 151.9754 54.56207 4.046088       4.097352      8.449287       5.022144      -4.719067      7.085733  201.8023 59.81179 130.9579 60.30887 70.84442       84.93886 
1 1 1 -3  1  19 o 215.4387 46.20465 9.576561       3.749835      11.81245       5.303212      7.340919       5.302923  237.3731 58.01767 192.0030 62.24229 45.37003       85.08909 
1 1 1 -3  1  20 o 865.8781 17.14465 146.0190       5.765187      157.0620       8.338940      135.9079       7.979354  896.7526 23.94474 834.0376 24.63509 62.71503       34.35460 
1 1 1 -3  1  21 o 850.2080 18.04600 140.7723       5.958461      142.7411       8.452478      138.8274       8.400832  854.8989 25.45900 843.0591 25.65880 11.83978       36.14602 
1 1 1 -3  1  22 o 656.3098 21.46548 83.95017       5.471136      88.10573       7.817533      79.96084       7.659594  671.1790 29.99186 639.2698 30.85273 31.90924       43.02792 
1 1 1 -3  1  23 o 434.4724 30.00902 37.08798       5.032362      40.07875       7.081087      34.03603       7.153128  449.5333 41.01265 412.9539 45.34994 36.57938       61.14454 
1 1 1 -3  1  24 o 550.8876 26.40211 59.28962       5.648454      60.11766       7.856163      58.40352       8.126958  551.9424 36.86327 543.5262 38.75558 8.416138       53.48734 
1 1 1 -3  1  25 o 459.0671 31.97727 41.55276       5.665327      26.27231       7.955783      57.27273       8.069390  357.0298 59.47071 537.5107 38.92021 -180.4809      71.07425 
1 1 1 -3  1  26 o 808.5975 22.34801 127.7141       7.017770      113.1150       9.635139      144.2098       10.24188  758.4211 32.71294 856.9634 30.77439 -98.54224      44.91324 
1 1 1 -3  1  27 o 569.8502 41.92947 64.82917       9.213970      64.82917       9.213970      0.000000       0.000000  569.8502 41.92947 ?        ?        0.000000       41.92947 
1 1 1 -3  1  28 o 153.4688 62.82233 2.189163       5.958863      4.822435       8.460187      -0.4033201     8.394408  190.3043 75.94370 162.3118 70.77525 27.99258       103.8103 
1 1 1 -3  1  29 o 243.5040 71.89528 12.98498       7.267725      28.33156       8.926410      -17.19279      12.51741  362.7889 65.77932 146.7540 71.09579 216.0349       96.85831 
1 1 1 -3  1  30 o 273.7403 81.65468 17.46705       9.337815      18.82305       13.03557      16.03789       13.38260  279.6573 97.60403 264.2731 98.01796 15.38422       138.3259 
1 1 1 -3  1  31 o 197.6143 69.40500 8.378389       6.596309      -1.962834      9.272303      18.97458       9.385914  156.6707 70.92914 279.5533 81.46660 -122.8826      108.0174 
1 1 1 -3  1  32 o 534.6686 35.30009 58.43987       7.288493      54.68514       10.26318      62.26014       10.35237  501.3077 53.54520 538.7055 50.05586 -37.39777      73.29855 
1 1 1 -3  1  33 o 216.8892 82.26508 12.24643       9.539219      0.000000       0.000000      12.24643       9.539219  ?        ?        216.8892 82.26508 0.000000       82.26508 
1 1 1 -3  1  34 o 416.9016 67.66949 43.44495       10.58041      53.53736       15.71170      35.07064       14.31198  410.7304 99.54115 317.0826 102.1976 93.64780       142.6632 
1 1 1 -3  2  1  o 295.3392 11.51500 16.95982       1.320727      16.52843       1.852191      17.40606       1.883788  290.8945 16.46294 298.5569 16.30886 -7.662384      23.17342 
1 1 1 -3  2  2  o 151.1286 17.93792 4.510893       1.032246      4.585635       1.481547      4.440380       1.439015  151.0411 26.20793 148.6294 25.87035 2.411667       36.82568 
1 1 1 -3  2  3  o 659.7980 10.71514 84.61861       2.745596      84.77801       3.884439      84.45947       3.881282  660.0804 15.15317 658.8378 15.16941 1.242676       21.44131 
1 1 1 -3  2  4  o 256.0095 14.86504 12.79232       1.471554      13.60989       2.077161      11.96852       2.085046  263.5090 20.45807 246.8151 21.98296 16.69392       30.02970 
1 1 1 -3  2  5  o 763.4034 11.43250 113.2649       3.389404      119.2581       4.917701      107.8418       4.677963  782.9893 16.17254 744.5693 16.17796 38.41998       22.87526 
1 1 1 -3  2  6  o 365.4651 13.96082 25.96460       1.981458      27.38745       2.788743      24.51395       2.815863  374.6652 19.23104 354.2827 20.55437 20.38245       28.14809 
1 1 1 -3  2  7  o 552.4616 12.79326 59.31591       2.744803      57.49062       3.877548      61.14910       3.885940  543.6501 18.36580 560.7086 17.84559 -17.05847      25.60796 
1 1 1 -3  2  8  o 822.5226 12.48861 131.4701       3.989237      135.2208       5.719789      127.9176       5.566597  833.8533 17.66291 811.0218 17.67377 22.83148       24.98681 
1 1 1 -3  2  9  o 542.1581 14.40372 57.13398       3.032696      58.29386       4.280005      55.96442       4.297809  547.3667 20.13436 536.2918 20.63564 11.07489       28.83092 
1 1 1 -3  2  10 o 474.8538 15.57479 43.84066       2.872170      44.85101       4.042231      42.81043       4.081781  480.0047 21.68441 468.9183 22.41427 11.08643       31.18674 
1 1 1 -3  2  11 o 673.4287 14.04854 88.16505       3.674100      88.29234       5.242027      88.04214       5.151090  673.5015 20.04161 672.5723 19.72115 0.9292603      28.11743 
1 1 1 -3  2  12 o 715.8096 16.56566 99.68462       4.605049      102.1910       5.690773      94.92967       7.838181  724.4112 20.22824 697.1549 28.95063 27.25629       35.31743 
1 1 1 -3  2  13 o 510.6523 19.71954 50.80087       3.910660      50.22767       4.835052      51.88519       6.650055  507.3081 24.54152 513.4244 33.53614 -6.116333      41.55670 
1 1 1 -3  2  14 f 565.1816 19.64114 62.27976       4.311046      68.06019       7.557323      59.49140       5.248827  587.6940 33.24858 551.7609 24.49533 35.93311       41.29757 
1 1 1 -3  2  15 o 108.9736 44.11986 1.061707       2.900272      1.365210       4.162096      0.7752278      4.043674  128.5755 52.55308 122.4473 51.08829 6.128220       73.29283 
1 1 1 -3  2  16 o 176.4881 50.29610 6.431882       3.614646      4.597772       6.032562      7.459222       4.514880  171.6700 65.34656 190.0970 56.79492 -18.42703      86.57849 
1 1 1 -3  2  17 o 344.4269 32.16343 23.57291       4.252382      37.58199       7.205811      16.08722       5.267369  432.0562 43.53860 278.8778 50.49437 153.1784       66.67302 
1 1 1 -3  2  18 o 423.6726 27.96024 35.36830       4.574573      36.25389       5.551782      33.49549       8.073517  427.5789 33.70734 404.8910 52.58644 22.68790       62.46214 
1 1 1 -3  2  19 f 678.9142 18.58292 89.86334       4.899557      86.50871       6.878040      93.31930       6.981151  664.7079 26.64439 690.5068 26.03341 -25.79883      37.25134 
1 1 1 -3  2  20 o 893.7444 17.15470 155.5623       5.954215      154.6324       8.415586      156.4944       8.425486  889.7408 24.35526 895.1071 24.23773 -5.366333      34.36054 
1 1 1 -3  2  21 o 764.4333 18.94691 113.8297       5.624786      121.4989       8.047740      106.5054       7.864714  788.6121 26.27741 738.1494 27.43536 50.46277       37.98949 
1 1 1 -3  2  22 o 858.2023 18.45355 143.4019       6.150317      143.0479       8.662041      143.7619       8.734132  855.9912 26.05691 858.0977 26.20928 -2.106506      36.95793 
1 1 1 -3  2  23 o 226.0964 53.72964 10.54931       4.648175      16.44300       6.606815      4.772978       6.540709  281.5100 62.09928 179.3030 68.09299 102.2070       92.15734 
1 1 1 -3  2  24 o 513.5338 39.17519 52.19502       7.753881      0.000000       0.000000      52.19502       7.753881  ?        ?        513.5338 39.17519 0.000000       39.17519 
1 1 1 -3  2  25 o 421.5185 34.43463 35.15621       5.587663      27.31378       7.597661      44.39520       8.246446  365.5157 55.24744 470.9349 45.66354 -105.4192      71.67593 
1 1 1 -3  2  26 o 260.1355 57.56989 14.15433       5.662122      10.12033       7.782045      18.69207       8.253648  225.0620 75.50266 295.5573 72.46490 -70.49532      104.6509 
1 1 1 -3  2  27 o 545.5318 42.55586 59.49789       8.944557      0.000000       0.000000      59.49789       8.944557  ?        ?        545.5318 42.55586 0.000000       42.55586 
1 1 1 -3  2  28 o 416.2984 39.09343 34.72509       6.246251      26.79210       8.511476      43.98368       9.195151  355.9119 63.92894 463.8496 51.93633 -107.9377      82.36681 
1 1 1 -3  2  29 o 501.9893 41.74367 50.90858       8.064110      58.38616       9.897966      36.14634       13.90726  534.4560 48.20652 393.4312 92.56701 141.0248       104.3672 
1 1 1 -3  2  30 o 177.1862 70.63515 4.712194       7.311791      -1.604102      12.17411      8.276258       9.144899  181.9315 81.91808 209.0691 80.24798 -27.13766      114.6748 
1 1 1 -3  2  31 o 202.9512 73.93990 8.765248       7.560889      0.8178967      12.75520      13.07052       9.388068  189.2029 84.62329 236.1170 82.80679 -46.91412      118.3979 
1 1 1 -3  2  32 o 252.0149 82.39331 16.22881       9.284327      0.000000       0.000000      16.22881       9.284327  ?        ?        252.0149 82.39331 0.000000       82.39331 
1 1 1 -3  2  33 o 261.4237 74.47233 17.68100       7.926364      23.01766       13.91095      15.11543       9.645266  267.5875 99.79797 234.6381 83.76926 32.94945       130.2955 
1 1 1 -3  2  34 o 100.7682 50.10284 -14.57422      7.646510      -21.95475      9.476941      -0.8062734     12.94372  104.1292 52.35464 166.4885 78.27016 -62.35921      94.16595 
1 1 1 -3  3  1  o 735.4849 10.60995 105.1421       3.030504      105.5877       4.290611      104.6984       4.280966  736.6774 14.99732 733.5657 15.02709 3.111755       21.23048 
1 1 1 -3  3  2  o 303.5676 12.07909 17.91607       1.424025      18.46175       2.010425      17.36664       2.017343  307.5136 16.89915 298.1657 17.49852 9.347900       24.32651 
1 1 1 -3  3  3  o 592.6006 10.79528 68.25481       2.484415      66.92946       3.474725      69.64100       3.553588  586.5424 15.25433 598.3030 15.29389 -11.76056      21.60087 
1 1 1 -3  3  4  o 512.6689 11.39387 51.08197       2.268487      50.27592       3.194128      51.90231       3.222309  508.3727 16.17864 516.5367 16.06342 -8.163971      22.79873 
1 1 1 -3  3  5  o 411.5648 12.70225 32.92331       2.030238      32.47049       2.853967      33.38723       2.888729  408.5220 17.98894 414.2503 17.95626 -5.728271      25.41710 
1 1 1 -3  3  6  o 281.7955 16.56524 15.49551       1.804868      13.79967       2.552872      17.19027       2.552066  264.9565 25.10972 296.3022 22.34271 -31.34567      33.61093 
1 1 1 -3  3  7  o 320.6090 16.67196 20.04118       2.068662      20.41669       2.920712      19.66317       2.930373  322.9717 23.44588 316.8643 23.99129 6.107452       33.54537 
1 1 1 -3  3  8  o 643.7075 12.87364 80.52387       3.218236      85.22522       4.665853      76.25756       4.444739  661.9693 18.14952 626.1672 18.27797 35.80206       25.75829 
1 1 1 -3  3  9  o 898.8152 12.81457 156.9983       4.473037      160.3106       6.390370      153.8164       6.263207  907.8754 18.12474 889.2954 18.13522 18.57996       25.63966 
1 1 1 -3  3  10 o 1626.108 15.29964 514.1062       9.661815      523.6428       13.91853      505.2370       13.42269  1640.029 21.85314 1611.024 21.45406 29.00500       30.62411 
1 1 1 -3  3  11 o 634.9873 14.60882 78.39777       3.602535      80.31484       5.030219      76.37907       5.161839  642.3191 20.16545 626.2983 21.22243 16.02081       29.27520 
1 1 1 -3  3  12 o 498.2786 19.56602 48.34496       3.786193      46.09794       4.607969      53.01457       6.642731  485.5658 24.51545 519.4178 33.10321 -33.85199      41.19260 
1 1 1 -3  3  13 o 790.7015 14.78861 121.6355       4.541171      119.7413       6.182366      123.8551       6.692268  783.8519 20.30920 797.0105 21.62127 -13.15863      29.66383 
1 1 1 -3  3  14 o 873.0762 17.07648 148.4880       5.790000      152.9413       10.20066      146.3712       7.032697  883.2094 29.73969 866.1409 20.90766 17.06848       36.35353 
1 1 1 -3  3  15 o 759.0827 15.67331 112.2462       4.620382      112.7084       6.518453      111.7796       6.550077  759.4407 22.10155 756.2610 22.30215 3.179688       31.39848 
1 1 1 -3  3  16 o 492.9386 23.05822 47.54338       4.414145      51.84011       7.796787      45.51650       5.355004  509.5114 39.71714 480.4609 28.83282 29.05048       49.07935 
1 1 1 -3  3  17 o 741.2601 16.70471 107.1194       4.808808      104.8513       6.779823      109.4157       6.821735  731.8611 23.85403 747.7119 23.49268 -15.85083      33.48015 
1 1 1 -3  3  18 f 539.9064 23.81734 57.02588       4.993898      59.26290       6.061686      52.29999       8.810483  548.7902 28.54041 510.4268 44.90353 38.36343       53.20604 
1 1 1 -3  3  19 o 180.8707 56.58407 6.564515       4.415192      5.692506       5.287592      8.572722       8.024197  176.6028 62.13264 214.7377 76.43362 -38.13496      98.50159 
1 1 1 -3  3  20 f 743.0246 18.65515 107.5695       5.383069      107.8631       7.579348      107.2706       7.646718  742.7922 26.27462 740.6906 26.58338 2.101685       37.37689 
1 1 1 -3  3  21 o 843.5571 18.22062 138.5729       5.969056      147.5950       8.565367      130.0544       8.322893  869.4121 25.36835 815.9535 26.26521 53.45862       36.51595 
1 1 1 -3  3  22 o 156.1860 56.58219 4.075252       4.418664      -2.230482      5.991570      11.59416       6.542596  130.2608 58.14839 236.9904 67.71159 -106.7296      89.25298 
1 1 1 -3  3  23 o 1054.282 25.35798 216.9400       10.38244      216.9400       10.38244      0.000000       0.000000  1054.282 25.35798 ?        ?        0.000000       25.35798 
1 1 1 -3  3  24 f 480.9919 29.30812 45.43772       5.448499      42.77462       7.552089      48.32851       7.868318  463.7360 42.40351 493.3941 41.44791 -29.65808      59.29576 
1 1 1 -3  3  25 o 389.3889 36.89184 30.12572       5.512268      37.36408       7.669446      22.39104       7.928032  431.3628 46.51791 327.2136 64.68137 104.1492       79.67179 
1 1 1 -3  3  26 o 312.3281 48.76252 19.90560       5.721320      21.87756       7.851993      17.67364       8.353621  322.4455 64.94971 286.9601 74.35490 35.48541       98.72749 
1 1 1 -3  3  27 o 520.5923 47.09883 54.57981       9.419056      0.000000       0.000000      54.57981       9.419056  ?        ?        520.5923 47.09883 0.000000       47.09883 
1 1 1 -3  3  28 o 116.7063 55.48838 -7.858304      6.857124      -7.226981      8.183207      -9.346661      12.56468  133.4628 62.58030 167.0379 78.07439 -33.57503      100.0595 
1 1 1 -3  3  29 o 135.2313 61.67794 -3.476392      7.174999      -6.302284      8.647802      2.766290       12.85327  139.9083 65.18459 205.5744 88.61076 -65.66609      110.0041 
1 1 1 -3  3  30 o 216.3820 69.55490 10.27424       6.632762      4.157716       9.362551      16.43695       9.397833  186.8562 77.83041 265.1580 82.48784 -78.30183      113.4100 
1 1 1 -3  3  31 o 186.7651 73.01688 6.398069       7.676969      1.559037       13.25193      8.842345       9.418350  193.8627 86.51376 208.7298 81.07716 -14.86711      118.5670 
1 1 1 -3  3  32 o 149.4697 66.54845 0.7488553E-02  7.792533      3.454250       13.50461      -1.713005      9.541201  194.8364 87.11333 155.6640 71.04660 39.17242       112.4115 
1 1 1 -3  3  33 o 324.1893 58.69308 24.40575       7.117420      24.66920       10.12418      24.14832       10.00793  299.2264 83.79309 296.3077 83.42887 2.918701       118.2441 
1 1 1 -3  3  34 o 97.71298 48.78649 -15.82445      7.571116      -10.70861      9.611639      -24.18823      12.28967  124.3172 60.69069 120.3156 60.37230 4.001671       85.60475 
1 1 1 -3  4  1  f 141.8637 20.42374 3.999972       1.092780      2.621986       1.506104      5.531882       1.587996  114.3131 32.42740 166.5175 25.35690 -52.20437      41.16441 
1 1 1 -3  4  2  f 766.8862 10.90446 114.2964       3.247605      114.7134       4.586514      113.8770       4.599128  767.9584 15.37861 765.1451 15.47760 2.813232       21.81875 
1 1 1 -3  4  3  o 556.9882 11.06291 60.29025       2.393003      61.74456       3.397557      58.85855       3.371032  563.4415 15.52709 550.1014 15.77946 13.34009       22.13779 
1 1 1 -3  4  4  o 1019.081 11.88764 201.8301       4.704705      198.2755       6.549246      205.6202       6.762808  1009.648 16.70296 1028.153 16.93719 -18.50568      23.78776 
1 1 1 -3  4  5  o 204.0426 20.60225 8.185145       1.610182      7.455655       2.269807      8.924141       2.284547  192.9908 31.36150 212.0381 28.46185 -19.04729      42.35116 
1 1 1 -3  4  6  o 292.8797 16.92120 16.73576       1.916436      17.61933       2.659729      15.78172       2.763763  299.9536 23.00795 283.5059 25.37034 16.44775       34.24938 
1 1 1 -3  4  7  o 959.4041 12.39565 178.8651       4.618476      176.7274       6.479147      181.0733       6.585168  953.3004 17.50089 964.9444 17.57262 -11.64404      24.80077 
1 1 1 -3  4  8  o 518.8104 14.00202 52.31533       2.821157      51.13483       3.968707      53.52118       4.011067  512.6729 19.93337 524.5114 19.69142 -11.83850      28.01948 
1 1 1 -3  4  9  o 1512.834 14.64450 444.8970       8.603872      461.3714       12.65696      430.7445       11.73114  1539.666 21.16775 1487.823 20.30305 51.84387       29.33065 
1 1 1 -3  4  10 o 1235.975 13.93555 296.9622       6.689011      300.4626       9.558842      293.6033       9.363562  1242.533 19.80932 1228.293 19.62959 14.23987       27.88781 
1 1 1 -3  4  11 o 303.3244 22.62783 18.02385       2.646314      16.09707       3.698269      20.04553       3.788259  284.8535 34.10936 318.8242 30.98718 -33.97076      46.08311 
1 1 1 -3  4  12 o 1023.102 16.09545 203.6568       6.395139      203.7523       7.816392      203.4636       11.12245  1022.839 19.67755 1020.551 28.06321 2.287964       34.27462 
1 1 1 -3  4  13 o 636.0145 15.99411 78.73687       3.950529      74.43459       5.459560      83.46529       5.723567  617.6329 22.76141 654.0593 22.53314 -36.42633      32.02849 
1 1 1 -3  4  14 o 172.7090 48.00775 6.124874       3.336160      2.153509       5.684342      8.211627       4.120461  151.5928 61.62609 198.9261 52.55124 -47.33331      80.99017 
1 1 1 -3  4  15 o 755.5147 18.17137 111.3309       5.331613      103.7182       9.105460      115.3028       6.577013  725.7546 32.30607 768.0687 22.04960 -42.31403      39.11351 
1 1 1 -3  4  16 o 585.2742 20.67748 66.92474       4.699862      65.37069       7.912800      67.77182       5.841988  573.9281 35.67795 588.0110 25.58275 -14.08289      43.90209 
1 1 1 -3  4  17 o 874.3597 16.12395 148.9921       5.475069      145.6150       7.698451      152.4483       7.788160  862.7760 22.97615 882.8613 22.71509 -20.08527      32.30911 
1 1 1 -3  4  18 o 410.1391 52.85503 34.30966       8.222802      0.000000       0.000000      34.30966       8.222802  ?        ?        410.1391 52.85503 0.000000       52.85503 
1 1 1 -3  4  19 o 692.1282 21.43102 93.48624       5.760462      95.21410       7.064617      90.05829       9.950647  697.6579 26.07463 674.6528 38.13514 23.00507       46.19713 
1 1 1 -3  4  20 o 242.5253 63.03592 12.28584       5.991726      0.000000       0.000000      12.28584       5.991726  ?        ?        242.5253 63.03592 0.000000       63.03592 
1 1 1 -3  4  21 o 355.3809 32.70079 24.94829       4.462525      20.14557       6.133474      30.35015       6.504810  314.6501 52.01106 389.8988 43.71155 -75.24863      67.94004 
1 1 1 -3  4  22 o 1239.412 17.16545 298.9702       8.262260      290.0375       11.40885      308.8220       11.98136  1219.398 24.09176 1258.164 24.52116 -38.76599      34.37587 
1 1 1 -3  4  23 o 376.6887 33.93161 28.02780       4.910531      24.47282       6.869259      31.74299       7.022349  347.5252 52.53707 398.3553 46.25338 -50.83008      69.99657 
1 1 1 -3  4  24 o 895.3196 19.70357 156.2161       6.850954      151.5564       9.558915      161.1378       9.823945  880.2549 27.96225 907.6752 27.86939 -27.42029      39.47899 
1 1 1 -3  4  25 o 597.6018 25.83925 69.85211       5.996802      69.96313       8.484327      69.74127       8.477194  594.7471 36.91539 593.7930 36.94424 0.9540405      52.22665 
1 1 1 -3  4  26 o 179.2244 63.78220 5.808216       5.587456      10.62483       7.916809      1.027824       7.886987  229.2895 76.13817 165.9656 70.41684 63.32396       103.7090 
1 1 1 -3  4  27 o 211.9297 65.51436 9.292142       5.938758      6.485026       8.169613      12.43774       8.648148  199.7641 76.04421 244.1717 79.50535 -44.40755      110.0174 
1 1 1 -3  4  28 o 535.6389 69.69064 60.83649       14.15353      0.000000       0.000000      60.83649       14.15353  ?        ?        535.6389 69.69064 0.000000       69.69064 
1 1 1 -3  4  29 o 196.0810 73.17326 7.066815       7.480771      5.577539       12.53409      7.890837       9.323406  214.7871 89.80829 210.3561 80.95783 4.430939       120.9119 
1 1 1 -3  4  30 o 304.3176 58.84451 20.11991       6.702870      24.04987       9.178299      15.62856       9.811976  323.9406 74.51001 258.2445 84.71549 65.69604       112.8205 
1 1 1 -3  4  31 o 192.9600 80.02621 5.732944       9.837352      0.000000       0.000000      5.732944       9.837352  ?        ?        192.9600 80.02621 0.000000       80.02621 
1 1 1 -3  4  32 o 226.4716 77.80618 12.69788       8.267965      -13.18143      14.87775      24.26146       9.945048  159.9804 77.50488 307.1044 81.88739 -147.1240      112.7499 
1 1 1 -3  4  33 o 130.3747 59.59430 -1.597534      6.745133      6.409932       9.665805      -9.198347      9.417172  183.7033 77.94916 128.7754 62.21112 54.92798       99.73111 
1 1 1 -3  4  34 o 155.5517 68.28754 2.961343       7.932719      -6.506615      10.03856      18.70462       12.94467  136.5638 65.52629 234.5455 93.82213 -97.98170      114.4390 
1 1 1 -3  5  1  o 598.2975 11.14084 69.55968       2.588590      71.24230       3.068990      65.41129       4.818831  605.4062 13.05331 579.5991 21.40849 25.80713       25.07414 
1 1 1 -3  5  2  o 1151.218 12.22189 257.5681       5.464167      256.9331       7.699557      258.2123       7.755747  1149.300 17.25060 1152.148 17.33354 -2.847778      24.45475 
1 1 1 -3  5  3  o 114.2667 28.73577 2.646378       1.273916      4.085656       1.755681      1.046059       1.851299  141.8318 32.56257 92.59507 35.95173 49.23670       48.50616 
1 1 1 -3  5  4  o 479.7461 12.15562 44.72586       2.264731      43.70654       3.168542      45.79050       3.238222  474.0626 17.21059 485.2340 17.18412 -11.17136      24.32074 
1 1 1 -3  5  5  o 700.8534 11.79178 95.44469       3.209479      93.89703       4.474248      97.08516       4.606415  694.9140 16.57910 706.6008 16.78653 -11.68677      23.59352 
1 1 1 -3  5  6  o 1039.007 12.49280 209.7787       5.040877      216.0984       7.301787      204.0241       6.967698  1054.129 17.83641 1024.284 17.51623 29.84473       24.99912 
1 1 1 -3  5  7  o 1382.027 13.87718 371.2207       7.448106      360.1548       10.21804      383.7657       10.87947  1360.681 19.33674 1404.495 19.94618 -43.81311      27.78056 
1 1 1 -3  5  8  o 1262.850 13.58382 309.9557       6.661958      314.6996       9.549485      305.4581       9.298394  1271.880 19.33328 1253.093 19.10718 18.78723       27.18198 
1 1 1 -3  5  9  o 399.2838 17.27964 31.00729       2.679441      33.11582       3.826511      28.97883       3.753158  411.6290 24.04150 384.8309 25.25311 26.79813       34.86708 
1 1 1 -3  5  10 o 947.3402 13.39076 174.4552       4.926507      177.1954       7.034393      171.8174       6.901765  954.2257 18.98224 939.6411 18.91343 14.58459       26.79633 
1 1 1 -3  5  11 o 268.3213 29.79073 14.23692       3.051901      13.87439       3.796213      14.89936       5.131663  263.3015 38.24371 270.3791 50.73519 -7.077545      63.53456 
1 1 1 -3  5  12 o 160.9527 61.10656 3.795529       5.266437      0.000000       0.000000      3.795529       5.266437  ?        ?        160.9527 61.10656 0.000000       61.10656 
1 1 1 -3  5  13 o 531.3964 17.62772 55.00729       3.637832      50.07005       5.116395      60.05521       5.173423  505.3589 26.15931 554.4874 24.02472 -49.12851      35.51755 
1 1 1 -3  5  14 o 987.4525 16.95227 190.0043       6.500879      187.8001       10.99629      191.1887       8.060271  978.4133 28.93983 989.6003 20.97306 -11.18707      35.74049 
1 1 1 -3  5  15 o 441.3385 30.95782 38.50544       5.272454      0.000000       0.000000      38.50544       5.272454  ?        ?        441.3385 30.95782 0.000000       30.95782 
1 1 1 -3  5  16 o 332.9755 29.15245 21.95143       3.731797      13.75229       5.162795      30.92239       5.400331  256.5346 53.55143 393.9514 35.68531 -137.4168      64.35213 
1 1 1 -3  5  17 o 332.2357 28.66298 21.82828       3.662045      20.10815       4.979788      23.85397       5.404012  315.5629 41.65265 344.2465 41.24321 -28.68362      58.61694 
1 1 1 -3  5  18 o 298.5134 39.91857 17.92892       4.511815      15.26491       5.424304      23.91020       8.127801  271.4247 53.36180 337.6587 64.33121 -66.23395      83.58222 
1 1 1 -3  5  19 o 456.3350 28.09587 40.91977       4.954937      40.28808       6.053274      42.20245       8.625859  451.3609 34.80193 457.9836 49.27334 -6.622650      60.32442 
1 1 1 -3  5  20 o 732.9434 18.94147 104.6553       5.391531      102.8768       7.537897      106.5182       7.714730  725.5101 26.75339 738.2100 26.90995 -12.69989      37.94587 
1 1 1 -3  5  21 o 800.7133 18.62833 124.8491       5.792672      124.5992       8.080394      125.1133       8.308518  798.8304 26.04653 800.3591 26.73072 -1.528687      37.32229 
1 1 1 -3  5  22 o 645.5659 21.82942 81.22442       5.472816      76.87065       7.489103      86.21401       8.017330  626.8851 30.76195 663.8375 31.09854 -36.95233      43.74262 
1 1 1 -3  5  23 o 291.7042 44.61767 17.15915       4.893820      12.48123       6.724087      22.42789       7.136088  245.1120 68.16408 330.9518 57.61545 -85.83980      89.25179 
1 1 1 -3  5  24 o 280.5174 47.85228 16.02406       5.025999      26.75128       6.892322      3.841746       7.344919  363.6226 50.14130 178.6495 70.92823 184.9731       86.86175 
1 1 1 -3  5  25 o 764.9814 22.27581 114.2627       6.617781      126.6776       9.376806      101.9418       9.341208  803.6535 30.04403 720.0837 33.40350 83.56976       44.92702 
1 1 1 -3  5  26 o 901.7830 21.36744 158.7986       7.483118      158.3736       10.38149      159.2582       10.79613  898.2090 29.76147 900.3417 30.87684 -2.132629      42.88502 
1 1 1 -3  5  27 o 452.2587 43.91338 41.13113       7.615568      38.88557       8.930406      47.11750       14.58113  435.8836 53.90517 465.1477 83.80069 -29.26407      99.64097 
1 1 1 -3  5  28 o 252.6618 80.02894 13.84502       8.805556      16.39269       11.51986      10.26440       13.65699  273.2772 91.86174 245.1224 96.90739 28.15472       133.5276 
1 1 1 -3  5  29 o 342.3365 52.08284 24.52589       6.705963      29.37479       9.229788      19.10420       9.759711  367.2064 67.19861 288.0616 82.82248 79.14478       106.6547 
1 1 1 -3  5  30 o 435.4680 57.27703 40.59575       9.451451      40.59575       9.451451      0.000000       0.000000  435.4680 57.27703 ?        ?        0.000000       57.27703 
1 1 1 -3  5  31 o 284.7301 84.97414 20.38908       10.11064      0.000000       0.000000      20.38908       10.11064  ?        ?        284.7301 84.97414 0.000000       84.97414 
1 1 1 -3  5  32 o 305.0237 72.21098 22.74632       8.421360      39.13860       15.00262      15.20522       10.17570  365.0803 101.9210 240.2884 86.01472 124.7919       133.3657 
1 1 1 -3  5  33 o 192.3454 74.96755 8.860126       8.073543      9.543958       10.05317      7.617977       13.54926  199.0799 81.55820 197.9761 87.96995 1.103867       119.9602 
1 1 1 -3  5  34 o 98.85868 48.77518 -11.18330      6.746692      -11.17047      9.985309      -11.19408      9.151635  125.4697 61.38211 119.4338 58.50005 6.035973       84.79399 
1 1 1 -3  6  1  o 924.9627 11.72378 166.2452       4.211334      167.7106       4.960952      162.4651       7.967571  928.9090 13.75194 913.5376 22.45802 15.37140       26.33398 
1 1 1 -3  6  2  o 338.3245 13.33511 22.24618       1.752097      21.95591       2.490317      22.53071       2.465547  335.4024 19.19852 339.8164 18.75537 -4.414001      26.83928 
1 1 1 -3  6  3  o 329.5367 14.00409 21.10687       1.792201      21.25424       2.556116      20.96438       2.513529  329.9140 20.04539 327.6657 19.84623 2.248352       28.20798 
1 1 1 -3  6  4  f 427.2834 12.96595 35.47981       2.151535      34.88248       3.053618      36.06870       3.031958  423.4915 18.56701 430.6486 18.12893 -7.157104      25.94980 
1 1 1 -3  6  5  o 629.3967 12.17376 76.97531       2.975619      80.99951       4.275507      73.19505       4.143898  645.4213 17.05754 613.5234 17.39202 31.89795       24.36066 
1 1 1 -3  6  6  o 502.2482 13.49103 49.02406       2.631427      50.65308       3.815836      47.54687       3.633646  510.2966 19.25480 494.4173 18.92435 15.87927       26.99775 
1 1 1 -3  6  7  o 720.4809 12.85932 100.8774       3.598062      93.07903       4.952136      109.5975       5.236629  691.7775 18.43309 750.6873 17.96242 -58.90973      25.73766 
1 1 1 -3  6  8  f 778.9539 13.08983 117.9269       3.959805      123.9785       5.722333      112.3664       5.485209  798.3353 18.45695 760.0201 18.58404 38.31519       26.19209 
1 1 1 -3  6  9  o 480.8248 15.67204 44.95650       2.926445      45.14754       4.143216      44.76632       4.134037  481.5020 22.15703 479.4621 22.20200 2.039917       31.36658 
1 1 1 -3  6  10 o 773.1936 13.95978 116.2334       4.191745      117.2013       5.978909      115.2978       5.878413  775.8992 19.84215 769.5900 19.66857 6.309265       27.93856 
1 1 1 -3  6  11 o 312.0237 26.96719 19.14921       3.235652      19.43124       3.922198      18.54837       5.724863  313.4001 32.70761 302.2898 50.55064 11.11026       60.20926 
1 1 1 -3  6  12 o 708.9103 15.17136 97.79145       4.176802      94.84055       5.909698      100.7367       5.904085  697.3441 21.82178 718.7892 21.15062 -21.44513      30.38978 
1 1 1 -3  6  13 o 178.0952 44.00199 6.536382       3.025650      4.336357       4.267941      8.759182       4.289975  156.7566 55.74892 205.3518 53.32101 -48.59515      77.14320 
1 1 1 -3  6  14 f 759.1953 18.33845 112.4113       5.406847      110.1817       9.452352      113.4956       6.591736  748.1206 32.53421 762.0558 22.27332 -13.93524      39.42811 
1 1 1 -3  6  15 o 805.6418 22.26814 126.9174       6.967129      0.000000       0.000000      126.9174       6.967129  ?        ?        805.6418 22.26814 0.000000       22.26814 
1 1 1 -3  6  16 o 280.2679 32.36318 15.67323       3.457753      15.00808       4.850512      16.36051       4.930471  269.9905 48.02036 282.6121 46.54373 -12.62164      66.87506 
1 1 1 -3  6  17 o 794.1324 23.03058 123.3055       7.102737      123.3055       7.102737      0.000000       0.000000  794.1324 23.03058 ?        ?        0.000000       23.03058 
1 1 1 -3  6  18 o 198.7270 49.02798 8.182997       3.760441      10.16141       5.180401      5.979359       5.467325  220.5425 59.23030 180.2597 63.19387 40.28284       86.61231 
1 1 1 -3  6  19 f 288.1003 41.84769 16.71840       4.545184      21.00588       5.706309      9.277261       7.517503  322.2581 46.97718 218.6955 74.20409 103.5625       87.82428 
1 1 1 -3  6  20 o 783.5074 18.53672 119.5627       5.640325      129.4199       8.105663      110.3091       7.853557  814.0458 25.63963 751.3227 26.91609 62.72308       37.17346 
1 1 1 -3  6  21 o 831.7913 18.73066 134.7197       6.050557      134.2739       8.527777      135.1715       8.586082  829.2684 26.47968 832.0192 26.57258 -2.750854      37.51366 
1 1 1 -3  6  22 o 684.1566 21.44251 91.21341       5.697169      87.45920       7.826675      95.44456       8.308965  668.7688 30.13515 698.5519 30.62811 -29.78314      42.96753 
1 1 1 -3  6  23 o 145.8771 57.07464 2.644815       4.693334      0.4352088      6.403135      5.210170       6.899362  149.2271 63.38786 184.9927 70.01122 -35.76558      94.44359 
1 1 1 -3  6  24 o 855.8271 20.44111 142.8196       6.793891      139.4985       9.232762      146.7413       10.03308  844.2369 28.16043 865.4533 29.85127 -21.21643      41.03789 
1 1 1 -3  6  25 o 835.4684 29.89126 136.9272       9.698448      136.9272       9.698448      0.000000       0.000000  835.4684 29.89126 ?        ?        0.000000       29.89126 
1 1 1 -3  6  26 o 382.0744 46.53656 29.50838       6.762462      35.44854       10.81414      25.69387       8.665863  409.8925 70.47572 349.2586 66.31586 60.63391       96.77097 
1 1 1 -3  6  27 o 254.3102 96.60432 11.92045       13.16701      0.000000       0.000000      11.92045       13.16701  ?        ?        254.3102 96.60432 0.000000       96.60432 
1 1 1 -3  6  28 o 347.6220 48.62947 24.85461       6.385289      33.88942       8.745512      14.53971       9.344548  402.7743 57.54680 257.6025 82.53218 145.1718       100.6141 
1 1 1 -3  6  29 o 374.6191 46.85329 28.97500       6.667373      30.93503       9.176137      26.78290       9.704184  377.6172 64.91177 345.1703 74.57155 32.44699       98.86584 
1 1 1 -3  6  30 o 156.3117 64.72854 2.642773       6.421803      15.64293       9.165090      -9.895322      9.000741  257.0586 81.67033 130.1850 62.35452 126.8736       102.7528 
1 1 1 -3  6  31 o 171.2307 74.85426 1.860453       9.443208      -6.159831      13.09319      10.55514       13.63256  168.0924 78.92677 226.2025 94.04224 -58.11015      122.7737 
1 1 1 -3  6  32 o 200.8440 75.88505 9.381372       8.097174      38.25722       14.13014      -4.736965      9.880319  364.3195 97.81241 146.5123 68.71986 217.8073       119.5395 
1 1 1 -3  6  33 o 143.8736 62.84880 1.678180       6.646163      -7.218978      9.806178      9.237389       9.038832  135.4495 64.93110 194.8215 78.23416 -59.37202      101.6692 
1 1 1 -3  6  34 o 215.5735 69.97750 12.49454       6.701499      20.63321       10.19752      6.307788       8.890965  256.3317 86.42746 174.1425 74.34897 82.18925       114.0065 
1 1 1 -3  7  1  o 502.1697 12.86656 49.00400       2.509234      52.75759       3.554381      45.27477       3.542832  520.8750 17.57124 482.4698 18.90829 38.40515       25.81225 
1 1 1 -3  7  2  o 576.0784 12.23890 64.48551       2.738117      63.48478       3.199723      67.22279       5.291934  571.5143 14.41642 587.6513 23.18818 -16.13696      27.30430 
1 1 1 -3  7  3  o 493.3402 12.54660 47.29405       2.403813      48.93534       3.428867      45.70781       3.370883  501.6512 17.60033 484.8138 17.90361 16.83737       25.10600 
1 1 1 -3  7  4  o 886.4300 11.98523 152.6779       4.125901      154.2426       5.856213      151.1358       5.813828  890.6654 16.93068 881.6462 16.98009 9.019165       23.97855 
1 1 1 -3  7  5  o 1297.296 13.30936 327.0682       6.705395      314.1812       9.101324      342.3680       9.916790  1270.995 18.43881 1326.689 19.24748 -55.69446      26.65437 
1 1 1 -3  7  6  o 694.5906 12.50765 93.75350       3.373904      93.09766       4.758287      94.41663       4.784665  691.8916 17.70861 696.7772 17.68193 -4.885559      25.02490 
1 1 1 -3  7  7  o 626.6992 13.23779 76.33325       3.221830      73.57776       4.536770      79.13685       4.576197  614.9858 18.99563 637.8276 18.47453 -22.84180      26.49797 
1 1 1 -3  7  8  o 935.3923 13.14209 170.0649       4.774042      170.0417       6.769053      170.0879       6.734112  934.8611 18.64459 934.9980 18.54563 -0.1369019     26.29755 
1 1 1 -3  7  9  o 535.1682 15.32163 55.69653       3.184368      54.99856       4.557756      56.36216       4.450899  531.3765 22.08619 537.9815 21.30357 -6.605042      30.68618 
1 1 1 -3  7  10 o 638.8566 17.03506 79.41870       4.226444      79.31185       5.232518      79.61927       7.168843  638.0653 21.11629 638.3961 28.91551 -0.3307495     35.80509 
1 1 1 -3  7  11 o 525.5808 19.37910 53.81189       3.955497      53.80895       4.919973      53.81726       6.651545  525.1016 24.12634 523.0168 32.91546 2.084778       40.81063 
1 1 1 -3  7  12 o 113.6451 44.39290 1.584027       2.835900      0.9371062      3.972551      2.256319       4.049699  123.1381 50.94397 135.1570 52.97907 -12.01897      73.49877 
1 1 1 -3  7  13 o 627.9825 16.43168 76.82949       4.007352      75.44946       5.681552      78.19570       5.653058  621.2381 23.54946 632.5392 23.01272 -11.30115      32.92662 
1 1 1 -3  7  14 o 130.7023 53.94107 1.230986       4.438003      0.000000       0.000000      1.230986       4.438003  ?        ?        130.7023 53.94107 0.000000       53.94107 
1 1 1 -3  7  15 o 407.2791 28.15148 32.72015       4.425353      35.66552       7.732387      31.28550       5.396544  419.1903 48.38668 396.3969 35.42897 22.79340       59.97068 
1 1 1 -3  7  16 o 373.1456 25.72096 27.40556       3.704530      25.87129       5.171496      29.02263       5.309210  359.7405 37.57115 381.5856 36.26282 -21.84503      52.21670 
1 1 1 -3  7  17 o 343.4832 29.27724 23.31186       3.868103      23.02574       5.424489      23.60787       5.517339  338.2436 42.21439 342.5092 42.38395 -4.265656      59.82017 
1 1 1 -3  7  18 o 197.3944 49.55443 8.060688       3.793123      12.13814       5.304320      3.793498       5.426333  241.1797 57.45189 161.6447 61.86983 79.53502       84.43102 
1 1 1 -3  7  19 o 1079.451 19.00052 227.0206       7.965193      240.0476       10.03995      204.8961       13.08416  1109.049 23.31057 1022.058 32.96420 86.99078       40.37352 
1 1 1 -3  7  20 o 1212.048 16.68536 285.9200       7.853864      277.7475       10.74764      295.2849       11.50509  1193.313 23.19159 1230.195 24.08176 -36.88220      33.43323 
1 1 1 -3  7  21 o 755.7903 19.63252 111.2477       5.762424      109.2527       7.872280      113.5505       8.457783  747.9788 27.10087 762.3096 28.56914 -14.33075      39.37833 
1 1 1 -3  7  22 o 297.0902 43.88923 17.75443       4.911316      16.21996       6.624710      19.62702       7.318265  279.5146 62.58640 307.8567 63.32478 -28.34207      89.03419 
1 1 1 -3  7  23 o 181.8940 61.49131 6.251891       5.162138      7.740162       7.094242      4.577145       7.525568  205.1453 71.98100 185.2004 72.32426 19.94493       102.0395 
1 1 1 -3  7  24 o 410.8058 34.42931 33.39919       5.442135      23.43948       7.496920      44.49392       7.912573  336.7918 59.49397 472.1149 43.65019 -135.3231      73.78938 
1 1 1 -3  7  25 o 561.2236 33.15501 62.15879       7.194173      67.35475       11.89346      59.16071       9.034356  577.0148 53.69149 544.4683 43.07821 32.54657       68.83682 
1 1 1 -3  7  26 o 554.7511 34.93564 60.92722       7.488085      56.08455       8.731126      74.39547       14.56074  529.5913 42.81865 600.7949 63.36203 -71.20355      76.47341 
1 1 1 -3  7  27 o 244.7553 70.85089 12.84264       7.120415      11.14920       8.311395      17.51416       13.80443  232.6017 78.02836 285.5411 100.3971 -52.93935      127.1534 
1 1 1 -3  7  28 o 819.5497 23.81434 131.8146       7.579521      129.0105       10.42651      134.9572       11.03771  806.7328 33.27983 824.5025 34.47141 -17.76971      47.91477 
1 1 1 -3  7  29 o 475.0894 36.71986 45.48030       6.722329      65.31300       9.401267      24.73130       9.615988  566.1232 43.08437 329.1439 76.65614 236.9793       87.93421 
1 1 1 -3  7  30 o 183.3183 75.39372 4.778122       8.632613      7.566873       12.41336      2.166275       12.01319  214.8603 89.56699 191.0005 83.93777 23.85982       122.7509 
1 1 1 -3  7  31 o 130.5021 59.26246 -1.975194      6.533093      -1.225746      9.070148      -2.783238      9.418046  155.2925 70.24229 152.2663 69.90211 3.026260       99.09735 
1 1 1 -3  7  32 o 251.2684 75.08189 16.19336       7.889951      -4.095259      13.78256      26.08308       9.622673  170.0634 80.20095 317.9027 78.42727 -147.8392      112.1741 
1 1 1 -3  7  33 o 124.0509 57.27390 -2.188138      6.449644      2.596748       9.798103      -5.846653      8.567590  165.1162 73.98643 129.4383 61.67723 35.67790       96.32275 
1 1 1 -3  8  1  o 651.7538 12.52726 82.54151       3.170791      82.69798       4.442995      82.37910       4.526524  652.1497 17.54287 650.8722 17.90775 1.277466       25.06870 
1 1 1 -3  8  2  o 950.8873 12.36423 175.6948       4.565876      176.3016       5.342975      174.0520       8.791388  952.4069 14.44550 945.5260 23.94175 6.880859       27.96212 
1 1 1 -3  8  3  o 1311.621 13.34781 334.3289       6.799022      333.0132       9.581102      335.6636       9.649805  1308.500 18.85445 1313.690 18.91463 -5.189819      26.70680 
1 1 1 -3  8  4  o 1363.042 13.65261 361.0789       7.226912      368.3690       10.42129      354.3252       10.03069  1376.097 19.50044 1349.656 19.13726 26.44116       27.32219 
1 1 1 -3  8  5  o 1261.838 13.34315 309.4501       6.538676      312.5951       9.323837      306.4066       9.172195  1267.663 18.93925 1255.067 18.81822 12.59656       26.69870 
1 1 1 -3  8  6  o 658.6384 12.83424 84.30894       3.282806      88.94546       4.758057      80.09671       4.535138  676.2120 18.11835 641.6895 18.19858 34.52246       25.68002 
1 1 1 -3  8  7  o 1088.301 13.11318 230.2113       5.542239      229.9327       7.840420      230.4896       7.835402  1087.101 18.57127 1088.421 18.53687 -1.319824      26.23943 
1 1 1 -3  8  8  o 203.5367 42.19227 8.429643       3.225550      0.000000       0.000000      8.429643       3.225550  ?        ?        203.5367 42.19227 0.000000       42.19227 
1 1 1 -3  8  9  o 139.8631 40.77438 3.916779       2.350806      3.199187       3.322876      4.635812       3.326210  137.4779 49.15903 154.5403 49.21142 -17.06241      69.55842 
1 1 1 -3  8  10 o 609.7844 17.44878 72.38474       4.132086      76.82061       5.224218      64.97269       6.753064  627.7889 21.42790 575.4761 30.32363 52.31287       37.13054 
1 1 1 -3  8  11 f 613.0651 15.85161 73.16305       3.774051      71.82243       5.302945      74.53899       5.372362  606.6566 22.50848 618.0402 22.38312 -11.38354      31.74328 
1 1 1 -3  8  12 o 746.5176 15.19758 108.5033       4.405978      110.1113       6.220195      106.8842       6.241848  751.0545 21.32576 739.8937 21.72280 11.16077       30.44123 
1 1 1 -3  8  13 o 289.9274 29.99147 16.68498       3.328056      14.59097       4.788337      18.64184       4.628877  266.3618 48.05796 304.1709 40.16858 -37.80911      62.63451 
1 1 1 -3  8  14 o 312.0145 41.67366 19.67688       4.923481      0.000000       0.000000      19.67688       4.923481  ?        ?        312.0145 41.67366 0.000000       41.67366 
1 1 1 -3  8  15 o 180.1117 52.80709 6.675058       3.933050      9.714475       6.558283      4.967990       4.914964  217.0998 69.09797 166.8048 59.77196 50.29495       91.36311 
1 1 1 -3  8  16 o 608.9789 18.88239 72.34091       4.465675      78.63991       6.392658      66.33741       6.240912  633.6524 25.97780 581.6539 27.62838 51.99854       37.92326 
1 1 1 -3  8  17 o 450.5166 24.28343 39.78810       4.232938      45.46535       5.888690      33.71828       6.088883  480.1250 31.76119 411.5390 38.54677 68.58603       49.94624 
1 1 1 -3  8  18 o 899.7228 16.84114 157.6263       5.884481      158.4180       8.176990      156.7759       8.474826  900.8164 23.37379 895.9292 24.35730 4.887207       33.75814 
1 1 1 -3  8  19 o 1001.034 19.33274 195.2191       7.515713      192.1618       9.028834      202.1175       13.56243  992.4025 23.42695 1014.966 34.40791 -22.56299      41.62603 
1 1 1 -3  8  20 o 427.4900 28.33050 35.86488       4.676703      37.78769       6.305984      33.51466       6.971727  437.1532 37.50747 409.9477 44.50583 27.20551       58.20291 
1 1 1 -3  8  21 o 363.0162 33.94154 26.03271       4.729508      27.81034       6.424600      23.92968       6.987924  372.9341 45.28876 343.3264 54.20905 29.60770       70.63776 
1 1 1 -3  8  22 o 931.1882 19.03586 168.8673       6.883955      169.2396       9.546105      168.4639       9.936386  930.9566 26.40394 928.5887 27.55352 2.367920       38.16235 
1 1 1 -3  8  23 o 575.8076 29.92834 65.09539       6.669424      55.76486       10.92186      70.64352       8.422036  526.0878 54.23545 598.3647 36.41616 -72.27698      65.32703 
1 1 1 -3  8  24 f 256.4069 55.54393 13.66830       5.370939      22.45756       7.521028      4.521340       7.672547  328.7348 61.16294 185.0117 72.79653 143.7231       95.08018 
1 1 1 -3  8  25 o 850.8002 21.71412 141.3552       7.174602      137.6312       9.698659      145.8562       10.66253  837.4261 29.82203 861.4370 31.87197 -24.01086      43.64832 
1 1 1 -3  8  26 o 617.3771 32.46111 75.25439       7.755580      75.36142       9.029893      74.95343       15.14231  615.9711 37.93251 601.0630 65.95378 14.90802       76.08401 
1 1 1 -3  8  27 o 434.8907 38.84457 37.88416       6.491474      38.33387       9.008965      37.39853       9.361863  431.0322 55.07859 424.1772 58.37811 6.855042       80.25992 
1 1 1 -3  8  28 o 248.6758 70.90064 13.63377       7.181176      10.51030       8.786506      19.91756       12.46260  225.7176 80.02028 292.0773 95.45840 -66.35974      124.5614 
1 1 1 -3  8  29 o 250.2426 67.08925 14.02698       6.653231      15.12663       9.189319      12.81546       9.645423  255.6191 81.83824 239.3844 83.93516 16.23473       117.2289 
1 1 1 -3  8  30 o 185.3738 72.22479 6.292936       7.491555      -0.2057475     12.22194      10.20413       9.481609  182.5627 82.15211 217.3796 82.12041 -34.81691      116.1582 
1 1 1 -3  8  31 o 336.7342 53.22485 24.88319       6.729001      20.64769       9.488443      29.16868       9.544291  284.2142 81.64796 348.6542 72.83733 -64.43994      109.4151 
1 1 1 -3  8  32 o 175.5865 71.24538 6.039842       7.580677      6.236116       13.92671      5.957202       9.036734  197.6468 88.41029 180.6867 75.94614 16.96010       116.5513 
1 1 1 -3  8  33 o 153.6288 66.83443 2.892503       7.448624      11.08891       13.43866      -0.7421605     8.949038  204.8601 89.43286 147.4522 67.85712 57.40787       112.2623 
1 1 1 -3  9  1  o 1413.490 14.07927 388.3252       7.728605      368.9155       10.33599      412.9395       11.63956  1377.135 19.32624 1456.816 20.57329 -79.68091      28.22701 
1 1 1 -3  9  2  o 761.8196 12.47942 112.7801       3.692108      116.3903       4.370580      103.7838       6.899341  773.8114 14.54374 730.0262 24.33555 43.78516       28.35029 
1 1 1 -3  9  3  o 764.6978 12.70323 113.6398       3.772523      113.2646       4.400810      114.6795       7.326319  763.3212 14.84559 767.3339 24.58518 -4.012695      28.71973 
1 1 1 -3  9  4  o 734.9789 12.56698 104.9807       3.587019      107.4747       5.107841      102.5539       5.038493  743.3544 17.69349 726.1256 17.86738 17.22876       25.14563 
1 1 1 -3  9  5  o 2054.199 17.19013 820.7219       13.71355      815.8539       19.20163      825.7899       19.59203  2046.461 24.16054 2058.790 24.50414 -12.32849      34.41198 
1 1 1 -3  9  6  f 833.5048 12.80953 135.0327       4.146381      136.4626       5.818665      133.5574       5.910143  837.5173 17.88964 828.5118 18.36840 9.005554       25.64054 
1 1 1 -3  9  7  o 411.0903 16.60748 32.87408       2.651362      33.45770       3.826655      32.33522       3.677006  413.6400 23.92362 406.6830 23.37985 6.957031       33.45081 
1 1 1 -3  9  8  o 946.1549 13.35129 174.0538       4.905839      180.0370       7.085629      168.5447       6.799050  961.6475 18.97293 930.4691 18.81561 31.17847       26.72077 
1 1 1 -3  9  9  o 1043.892 15.73922 212.0326       6.380679      208.5398       7.851223      218.8272       10.95049  1034.683 19.53898 1058.460 26.63981 -23.77673      33.03712 
1 1 1 -3  9  10 o 460.4317 17.69537 41.29079       3.164120      41.24640       4.483068      41.33485       4.466462  458.7772 25.25934 459.2925 25.13604 -0.5153503     35.63502 
1 1 1 -3  9  11 o 448.8843 27.36769 39.60011       4.748115      0.000000       0.000000      39.60011       4.748115  ?        ?        448.8843 27.36769 0.000000       27.36769 
1 1 1 -3  9  12 o 339.3642 37.18567 23.01469       4.820586      0.000000       0.000000      23.01469       4.820586  ?        ?        339.3642 37.18567 0.000000       37.18567 
1 1 1 -3  9  13 f 418.4180 25.79942 34.43216       4.171813      19.15352       7.264874      41.94918       5.095755  300.6062 64.18254 461.3623 28.58130 -160.7561      70.25873 
1 1 1 -3  9  14 o 654.2772 35.85393 84.83626       9.075480      84.83626       9.075480      0.000000       0.000000  654.2772 35.85393 ?        ?        0.000000       35.85393 
1 1 1 -3  9  15 o 340.3286 31.76444 22.97664       4.149716      15.20436       6.858141      27.46581       5.212128  267.1915 66.38709 371.1421 36.63980 -103.9507      75.82691 
1 1 1 -3  9  16 o 165.0448 50.85923 5.464788       3.582228      2.401488       4.956926      8.813469       5.182682  145.8909 58.15894 206.4739 60.64188 -60.58305      84.02322 
1 1 1 -3  9  17 f 468.1625 23.33766 42.79918       4.243087      42.48847       5.907217      43.13036       6.098621  464.0325 32.99484 467.3525 33.83033 -3.320007      47.25622 
1 1 1 -3  9  18 o 1074.999 16.35645 224.9444       6.828494      219.1134       9.441791      231.3389       9.887521  1059.724 22.94212 1088.785 23.38391 -29.06116      32.75894 
1 1 1 -3  9  19 o 523.9989 25.51982 53.60146       5.193210      57.37790       6.424450      46.48123       8.821474  540.6456 30.72500 482.5524 47.69703 58.09317       56.73652 
1 1 1 -3  9  20 o 224.6092 56.31834 10.41665       4.903488      9.445095       5.883132      12.62732       8.874355  215.7983 64.91351 250.6119 80.44336 -34.81361      103.3678 
1 1 1 -3  9  21 o 201.6624 59.20515 8.261695       4.940886      12.49103       6.842321      3.653440       7.142262  245.5904 68.92561 176.5964 69.99664 68.99402       98.23579 
1 1 1 -3  9  22 o 872.6492 22.90354 148.5309       7.761940      138.5202       12.61481      154.6300       9.846552  839.2667 38.70372 889.2977 28.51077 -50.03101      48.07122 
1 1 1 -3  9  23 o 775.8649 21.07081 117.4077       6.348855      118.4356       8.716103      116.2459       9.266419  777.7486 28.85726 770.0381 30.98644 7.710449       42.34266 
1 1 1 -3  9  24 o 247.1837 59.67493 12.81057       5.663419      14.13014       7.654036      11.21402       8.419082  258.2207 73.05060 235.9099 78.52488 22.31078       107.2499 
1 1 1 -3  9  25 o 680.5610 30.13528 90.94608       7.964717      88.25883       9.114536      99.62668       16.38158  668.1822 35.24935 698.0889 61.03869 -29.90668      70.48573 
1 1 1 -3  9  26 o 380.9964 52.73701 29.77116       7.593813      27.95796       8.638160      35.93926       15.93211  364.9087 63.24683 394.4893 102.9140 -29.58060      120.7951 
1 1 1 -3  9  27 o 241.2079 68.21014 12.57345       6.674700      19.62415       8.382654      0.3591007      11.03318  299.0618 72.84945 186.1186 81.14865 112.9432       109.0511 
1 1 1 -3  9  28 o 406.0980 55.75286 34.68549       8.560749      34.68549       8.560749      0.000000       0.000000  406.0980 55.75286 ?        ?        0.000000       55.75286 
1 1 1 -3  9  29 o 139.4021 62.93715 -2.160421      7.242446      -11.08319      12.10879      2.809607       9.037124  153.4767 73.18461 177.0768 75.26342 -23.60005      104.9789 
1 1 1 -3  9  30 o 295.3611 59.35343 19.43426       6.571892      20.55495       9.209258      18.27131       9.381245  290.1093 79.41887 271.8333 82.01665 18.27603       114.1669 
1 1 1 -3  9  31 o 279.7481 61.82488 18.14387       6.537934      17.14950       9.297738      19.11643       9.195185  256.3797 82.34467 271.6330 81.02924 -15.25333      115.5265 
1 1 1 -3  9  32 o 185.7144 68.42771 8.125655       6.501733      10.58392       9.608345      6.049294       8.830503  204.9325 81.19963 178.8700 75.12290 26.06247       110.6202 
1 1 1 -3  9  33 o 133.8240 61.22881 -0.9295654     7.142635      11.62801       13.61355      -5.699467      8.390217  205.1036 89.76321 127.3690 60.78619 77.73452       108.4085 
1 1 1 -3  10 1  o 413.7900 15.81264 33.29242       2.541045      29.89919       3.505476      37.04960       3.688680  391.1521 23.18003 436.2509 21.77242 -45.09882      31.80176 
1 1 1 -3  10 2  o 706.1229 13.38826 96.91450       3.671407      97.29358       5.150655      96.52295       5.234670  707.1658 18.75484 704.3314 19.13746 2.834351       26.79527 
1 1 1 -3  10 3  o 2407.260 19.27157 1127.624       18.01641      1112.152       20.40000      1182.466       38.40818  2389.928 21.97948 2456.374 40.26256 -66.44556      45.87125 
1 1 1 -3  10 4  o 1733.364 15.55631 584.2594       10.47187      576.8714       14.52933      592.2460       15.10645  1721.185 21.73652 1743.840 22.30631 -22.65503      31.14558 
1 1 1 -3  10 5  o 922.7388 12.89574 165.5070       4.621182      166.4400       6.510468      164.5595       6.560495  924.8576 18.12631 919.5921 18.37018 5.265503       25.80749 
1 1 1 -3  10 6  o 293.9190 20.34369 16.90233       2.307842      16.19831       3.261814      17.60804       3.265752  286.4365 29.75694 298.9641 28.47178 -12.52765      41.18394 
1 1 1 -3  10 7  o 786.2530 13.42842 120.2038       4.100295      122.4738       5.845035      118.0043       5.753435  793.1007 18.97714 778.4888 19.03035 14.61188       26.87538 
1 1 1 -3  10 8  o 359.2939 22.17703 25.26780       3.079307      24.20291       3.900858      27.02861       5.016063  350.6211 28.90564 369.4601 35.39280 -18.83902      45.69668 
1 1 1 -3  10 9  o 437.2232 20.18352 37.27068       3.427111      37.53074       4.295797      36.81541       5.683946  437.5078 25.39230 431.6115 34.18987 5.896301       42.58775 
1 1 1 -3  10 10 o 761.0331 14.63683 112.7339       4.325920      117.8432       6.285087      108.1346       5.963151  777.1276 20.82528 744.4620 20.62554 32.66559       29.31050 
1 1 1 -3  10 11 o 174.3075 42.93402 6.270789       2.887241      13.25171       4.202748      0.3142875E-01  3.973260  254.7475 44.07654 115.9894 49.61602 138.7581       66.36634 
1 1 1 -3  10 12 o 438.5830 24.12593 37.75534       4.093462      40.48902       7.306425      36.50472       4.941885  449.3809 42.36612 430.0306 29.77460 19.35022       51.78238 
1 1 1 -3  10 13 o 111.2969 49.81996 -1.699888      4.430660      0.000000       0.000000      -1.699888      4.430660  ?        ?        111.2969 49.81996 0.000000       49.81996 
1 1 1 -3  10 14 o 485.2798 23.62225 46.06253       4.451859      43.78260       7.319169      47.40134       5.608655  468.1489 40.66165 490.4101 29.58761 -22.26120      50.28714 
1 1 1 -3  10 15 o 680.5020 20.27503 90.36330       5.358200      88.13529       9.072474      91.55672       6.639943  667.9169 35.09948 684.1099 24.99255 -16.19299      43.08829 
1 1 1 -3  10 16 o 420.8758 25.37562 34.75518       4.128221      35.48415       5.720247      33.96283       5.963734  423.3100 35.11290 413.4972 37.54726 9.812775       51.40732 
1 1 1 -3  10 17 o 559.8385 21.87147 61.13284       4.755199      69.68637       6.694140      52.42045       6.756021  596.7275 28.88622 515.7136 33.92226 81.01392       44.55484 
1 1 1 -3  10 18 o 237.7883 47.04006 11.55903       4.190120      13.73090       5.784927      9.162062       6.077329  257.2211 59.14655 213.2712 66.33130 43.94987       88.87157 
1 1 1 -3  10 19 o 760.7627 21.94030 112.7999       6.482159      118.0239       7.975807      102.6355       11.12543  777.5324 26.41363 721.5490 39.85750 55.98340       47.81527 
1 1 1 -3  10 20 o 463.5288 36.54112 42.39100       6.524547      38.38189       8.796678      47.29356       9.727600  437.0591 52.90368 485.9125 52.37679 -48.85342      74.44547 
1 1 1 -3  10 21 o 1226.544 17.60408 292.8412       8.385415      287.3747       11.39837      299.2898       12.37988  1213.721 24.18220 1238.245 25.74434 -24.52417      35.32067 
1 1 1 -3  10 22 o 792.1122 28.87849 122.7688       8.883603      122.7688       8.883603      0.000000       0.000000  792.1122 28.87849 ?        ?        0.000000       28.87849 
1 1 1 -3  10 23 o 426.0024 34.88685 35.92127       5.721061      33.72726       7.757474      38.53755       8.471154  408.6246 49.92222 436.8476 50.88620 -28.22299      71.28558 
1 1 1 -3  10 24 o 343.6940 43.36626 23.78546       5.659467      26.41125       7.533980      20.38480       8.573863  358.5050 55.93935 308.8814 72.68649 49.62366       91.71989 
1 1 1 -3  10 25 o 591.1948 39.11507 69.48727       8.929796      69.48727       8.929796      0.000000       0.000000  591.1948 39.11507 ?        ?        0.000000       39.11507 
1 1 1 -3  10 26 f 181.8401 67.46162 5.676705       6.340147      13.28169       7.762140      -9.567670      10.98973  248.6993 74.50690 153.6007 72.18226 95.09860       103.7379 
1 1 1 -3  10 27 o 236.2609 65.29520 12.09170       6.190583      13.54122       8.424760      10.39047       9.126954  248.5748 78.22737 226.9155 81.43689 21.65923       112.9225 
1 1 1 -3  10 28 o 205.9599 73.34088 8.674784       7.388727      15.58445       11.91639      4.359100       9.417616  261.2725 93.12857 189.2996 78.38712 71.97285       121.7270 
1 1 1 -3  10 29 o 213.1475 73.63195 10.00595       7.409553      7.837589       11.69901      11.45835       9.574715  213.7821 87.82753 227.2703 83.14423 -13.48825      120.9406 
1 1 1 -3  10 30 o 246.8434 66.05489 14.20038       6.456797      6.770294       8.796169      22.88148       9.507885  191.6454 77.09987 304.2010 79.57145 -112.5556      110.7971 
1 1 1 -3  10 31 o 135.5517 60.32521 -0.1419560     6.395664      4.135514       8.780246      -4.976896      9.334881  172.7194 73.81660 141.4765 66.49793 31.24283       99.35223 
1 1 1 -3  10 32 o 214.3620 69.15108 11.75890       6.551549      -6.597468      9.294690      29.88483       9.236166  133.3803 63.74472 342.9002 71.66612 -209.5199      95.91362 
1 1 1 -3  11 1  o 245.1313 24.11960 11.82272       2.266401      7.414436       3.159091      16.49795       3.253336  190.5371 43.63220 289.2327 29.37112 -98.69556      52.59688 
1 1 1 -3  11 2  o 682.5532 13.92619 90.57637       3.691449      90.49890       5.155591      90.65786       5.287917  681.8539 19.46970 682.4105 19.95313 -0.5565796     27.87824 
1 1 1 -3  11 3  o 1176.338 13.60291 269.0296       6.214293      264.6169       7.116144      283.2041       12.75401  1166.409 15.70962 1204.681 27.26132 -38.27161      31.46382 
1 1 1 -3  11 4  o 1272.485 14.01877 314.8504       6.927721      314.8515       8.028133      314.8473       13.70950  1272.185 16.24936 1269.906 27.79853 2.278564       32.19938 
1 1 1 -3  11 5  o 952.2081 13.18145 176.2928       4.874420      174.8365       6.814585      177.8185       6.975163  947.6595 18.51651 955.6696 18.79397 -8.010010      26.38322 
1 1 1 -3  11 6  o 1371.764 14.26664 366.0072       7.600267      369.2744       10.77341      362.7701       10.72357  1376.719 20.15023 1364.520 20.23631 12.19824       28.55766 
1 1 1 -3  11 7  o 789.5117 19.11093 121.4452       5.859605      121.4452       5.859605      0.000000       0.000000  789.5117 19.11093 ?        ?        0.000000       19.11093 
1 1 1 -3  11 8  o 746.5889 16.07341 108.5230       4.660340      103.7586       5.688893      118.2442       8.126019  729.4702 20.08132 777.4407 26.91427 -47.97046      33.58031 
1 1 1 -3  11 9  o 513.5310 16.85817 51.37552       3.362056      53.22488       4.795292      49.58754       4.715055  521.8636 23.66083 503.6548 24.10604 18.20886       33.77775 
1 1 1 -3  11 10 o 1062.729 14.17711 219.8588       5.851110      214.6298       8.195190      225.2958       8.356608  1048.669 20.12299 1074.436 20.02726 -25.76672      28.39060 
1 1 1 -3  11 11 o 264.9648 31.06358 13.98869       3.135793      10.73329       4.473889      17.13242       4.396486  226.7930 51.91639 291.4341 39.89246 -64.64114      65.47305 
1 1 1 -3  11 12 o 648.9900 19.19783 82.19057       4.838583      67.61988       8.127059      90.19128       6.022230  583.9925 36.00989 679.1498 22.83304 -95.15729      42.63871 
1 1 1 -3  11 13 o 981.1203 17.54795 187.6626       6.686160      177.9436       11.27917      192.9281       8.302092  951.5416 30.52259 993.7939 21.51113 -42.25226      37.34109 
1 1 1 -3  11 14 o 213.0571 50.40999 9.431904       4.105902      0.3265223      6.698152      14.91280       5.196750  150.6676 64.43468 268.6925 51.67877 -118.0248      82.59857 
1 1 1 -3  11 15 o 566.8820 20.97980 62.69600       4.618723      59.57749       6.438251      66.00271       6.629677  550.3999 30.23635 579.5613 29.55357 -29.16138      42.28062 
1 1 1 -3  11 16 o 385.2728 27.95859 29.18676       4.154741      32.51710       5.843977      25.78314       5.907926  404.8288 37.60093 358.7484 43.27916 46.08035       57.33162 
1 1 1 -3  11 17 o 585.7122 21.57734 66.88046       4.908064      69.75054       6.989686      64.08887       6.893419  596.2477 30.28526 571.2917 31.18849 24.95605       43.47320 
1 1 1 -3  11 18 o 555.1713 23.21214 60.10075       5.004608      67.53284       7.020705      52.42282       7.135871  586.7477 30.91983 515.7951 35.84660 70.95264       47.33936 
1 1 1 -3  11 19 o 1210.380 23.95971 285.6805       11.26241      270.6481       15.06860      304.7059       16.95217  1175.880 32.99757 1247.050 35.00367 -71.17004      48.10506 
1 1 1 -3  11 20 o 567.7219 27.32423 62.93990       6.024370      67.42371       7.357856      53.82073       10.49312  586.0422 32.45576 518.4856 52.85122 67.55658       62.02119 
1 1 1 -3  11 21 o 351.0705 51.52352 24.95266       6.815685      24.95266       6.815685      0.000000       0.000000  351.0705 51.52352 ?        ?        0.000000       51.52352 
1 1 1 -3  11 22 o 649.5525 23.93069 82.39111       6.036671      77.78773       8.120614      88.07708       9.025130  628.6168 33.38371 668.6017 34.87914 -39.98492      48.28070 
1 1 1 -3  11 23 o 701.0978 24.56037 96.08549       6.687157      98.41071       8.951296      93.14885       10.05956  707.7450 32.56725 686.1578 37.89779 21.58716       49.96867 
1 1 1 -3  11 24 o 387.4352 55.88808 30.78901       8.165842      30.78901       8.165842      0.000000       0.000000  387.4352 55.88808 ?        ?        0.000000       55.88808 
1 1 1 -3  11 25 o 351.1069 55.19772 25.45248       7.278049      37.31930       8.329546      -12.84939      14.96457  428.1200 51.10916 177.8941 83.79482 250.2259       98.15151 
1 1 1 -3  11 26 o 417.7339 39.98281 35.06614       6.407126      32.05698       8.525947      38.97029       9.711454  392.2308 57.69622 432.2893 59.41821 -40.05844      82.82136 
1 1 1 -3  11 27 o 217.3233 67.97612 10.15024       6.372285      8.862519       8.408273      11.88781       9.767177  212.6794 77.89874 237.2645 84.34057 -24.58507      114.8109 
1 1 1 -3  11 28 o 157.4505 66.90533 1.659968       7.138239      7.124570       11.81459      -1.481693      8.958166  213.8547 88.10581 158.1881 70.82284 55.66660       113.0421 
1 1 1 -3  11 29 o 119.7704 55.52475 -3.863324      6.153882      -9.424038      8.338193      2.789159       9.120078  124.3314 59.67351 175.2271 75.06876 -50.89563      95.89706 
1 1 1 -3  11 30 o 493.5460 35.36441 49.86317       6.733390      46.59455       9.251810      53.54435       9.818323  463.3026 52.33780 497.6682 51.54812 -34.36557      73.46056 
1 1 1 -3  11 31 o 224.6891 66.69252 12.41441       6.240709      3.517388       8.795165      21.43605       8.856545  168.1574 72.88881 286.1335 77.69803 -117.9762      106.5353 
1 1 1 -3  11 32 o 125.9332 57.28247 -1.033108      6.136145      -7.883996      8.883396      5.218373       8.485884  126.1814 60.82406 170.4466 72.69986 -44.26521      94.78838 
1 1 1 -3  12 1  o 636.8861 14.17599 78.88470       3.506251      76.33067       4.819323      81.75686       5.110669  626.0295 19.82272 647.8502 20.31306 -21.82062      28.38239 
1 1 1 -3  12 2  o 280.7703 23.73919 15.48370       2.564225      13.84679       3.502761      17.37393       3.764045  263.5109 35.10128 296.0099 33.32263 -32.49905      48.39935 
1 1 1 -3  12 3  o 218.4674 28.46801 9.483693       2.357918      10.11921       2.770648      7.814430       4.490336  225.0202 32.65935 195.6979 56.15278 29.32236       64.95974 
1 1 1 -3  12 4  o 328.8195 20.80645 21.15754       2.643252      21.95397       3.113199      19.10059       5.003152  334.5420 24.12415 308.3482 42.94652 26.19382       49.25828 
1 1 1 -3  12 5  o 223.3590 58.98241 10.36237       5.192020      0.000000       0.000000      10.36237       5.192020  ?        ?        223.3590 58.98241 0.000000       58.98241 
1 1 1 -3  12 6  o 1113.242 13.73441 241.1069       5.937824      244.6245       8.416523      237.6211       8.378310  1120.278 19.34546 1104.083 19.54011 16.19507       27.49659 
1 1 1 -3  12 7  o 1375.885 16.67089 368.7181       8.907765      361.5025       10.72137      384.8010       16.00651  1361.355 20.27921 1401.042 29.41831 -39.68640      35.73070 
1 1 1 -3  12 8  o 612.3339 17.19404 73.06533       4.088785      69.78893       4.978371      79.85622       7.167243  597.8614 21.44168 638.0991 28.92251 -40.23767      36.00357 
1 1 1 -3  12 9  o 541.1232 16.42112 57.05347       3.450857      53.20576       4.830080      61.06530       4.932016  521.5674 23.84602 558.9495 22.72082 -37.38208      32.93734 
1 1 1 -3  12 10 o 935.3792 14.48454 170.3631       5.261632      163.5431       7.342709      177.5612       7.543497  915.1581 20.66009 953.6479 20.36839 -38.48987      29.01225 
1 1 1 -3  12 11 o 294.9933 32.39526 17.32769       3.650157      21.74046       6.782083      15.52822       4.330920  323.9261 55.93455 276.8004 41.57359 47.12570       69.69244 
1 1 1 -3  12 12 o 485.7349 27.45913 46.39503       5.158596      0.000000       0.000000      46.39503       5.158596  ?        ?        485.7349 27.45913 0.000000       27.45913 
1 1 1 -3  12 13 o 171.3365 51.46624 5.951460       3.700064      12.46650       6.228480      2.398412       4.599645  243.1179 64.79428 142.1199 56.22257 100.9980       85.78622 
1 1 1 -3  12 14 o 853.1937 18.82739 141.8845       6.238294      127.9296       10.32002      149.9198       7.830986  807.0219 32.92814 876.2037 23.01354 -69.18188      40.17319 
1 1 1 -3  12 15 o 855.9157 17.07032 142.6477       5.674148      137.9938       7.979439      147.4081       8.070246  840.6158 24.44257 868.9224 23.91541 -28.30664      34.19628 
1 1 1 -3  12 16 o 604.7235 20.97545 71.27776       4.926020      72.57415       6.933813      69.95667       6.999542  609.1036 29.31251 597.1231 30.28317 11.98047       42.14610 
1 1 1 -3  12 17 o 1588.455 19.87185 491.4676       12.25861      494.5580       21.14272      489.9026       15.04574  1588.594 34.27047 1584.665 24.44827 3.928955       42.09730 
1 1 1 -3  12 18 o 96.76116 45.54771 -4.711806      4.407939      -8.664840      6.093491      -0.3725925     6.384199  106.1429 50.96210 144.8046 62.43321 -38.66171      80.59182 
1 1 1 -3  12 19 o 683.1400 24.09018 91.00670       6.391131      92.58567       7.861613      87.92937       10.97515  688.3214 29.40982 667.1760 42.58078 21.14539       51.74998 
1 1 1 -3  12 20 o 215.3785 61.09990 9.525209       5.346877      6.168638       6.574185      16.08406       9.189839  190.1618 68.99754 277.3144 80.55295 -87.15253      106.0634 
1 1 1 -3  12 21 o 383.1487 36.79143 29.11847       5.407154      23.72433       6.986482      37.17577       8.538698  340.9534 54.60668 429.2138 52.30785 -88.26041      75.61746 
1 1 1 -3  12 22 o 475.4987 33.95602 44.65406       6.229146      49.16211       7.671879      35.93214       10.67121  497.4548 40.05118 415.3342 68.55066 82.12061       79.39326 
1 1 1 -3  12 23 o 314.7683 52.19999 20.31802       6.157433      36.70057       7.564285      -11.85736      10.60081  427.1644 46.34114 145.3538 69.07489 281.8105       83.17957 
1 1 1 -3  12 24 o 324.7187 56.96711 21.86289       6.921897      22.04917       7.925930      21.26421       14.20922  323.2057 65.39117 311.0564 101.9413 12.14935       121.1117 
1 1 1 -3  12 25 o 110.0446 51.72256 -5.526343      5.646773      0.6420931      7.480483      -13.69727      8.609495  159.1470 68.07819 120.2564 58.42199 38.89061       89.70936 
1 1 1 -3  12 26 o 627.1467 37.64765 78.61623       9.126832      78.61623       9.126832      0.000000       0.000000  627.1467 37.64765 ?        ?        0.000000       37.64765 
1 1 1 -3  12 27 o 182.9216 71.23421 5.469765       7.284695      -9.816658      11.95137      14.50636       9.188978  157.4004 74.36771 253.1038 81.92142 -95.70343      110.6421 
1 1 1 -3  12 28 o 203.0485 72.73084 8.653241       7.276496      24.19493       12.17857      0.2484890E-01  9.074283  310.2224 93.41401 164.2998 72.54680 145.9226       118.2760 
1 1 1 -3  12 29 o 163.6852 65.04095 4.356167       6.180943      -2.612387      8.522421      12.08912       8.977685  146.7515 67.04391 226.6680 80.82952 -79.91652      105.0157 
1 1 1 -3  12 30 o 198.0835 66.02892 9.155548       5.951983      3.243916       8.282911      15.46727       8.558608  166.7828 71.49819 245.5049 79.01984 -78.72202      106.5651 
1 1 1 -3  12 31 o 189.3499 66.33425 8.621619       6.023717      6.470189       8.601439      10.69233       8.438542  180.1133 74.77530 204.8723 77.45347 -24.75893      107.6586 
1 1 1 -3  12 32 o 226.7043 66.00519 13.19876       6.163826      14.75871       8.973626      11.80534       8.481140  225.6089 80.77300 206.9904 77.78079 18.61852       112.1344 
1 1 1 -3  13 1  o 509.9969 16.23159 50.63253       3.214819      52.78870       4.453430      48.28633       4.645534  520.1891 22.04476 497.2912 24.05453 22.89789       32.62808 
1 1 1 -3  13 2  o 422.5169 18.86578 34.78590       3.095614      31.68139       4.188042      38.52481       4.596072  401.6012 27.00973 443.0596 26.83799 -41.45844      38.07629 
1 1 1 -3  13 3  o 293.3877 27.14328 16.97959       3.057612      17.22235       3.873813      16.57842       4.979792  294.0868 34.57863 285.6400 46.49054 8.446747       57.94007 
1 1 1 -3  13 4  o 260.3785 26.85547 13.40307       2.676615      16.31365       3.157062      5.963202       5.047490  287.2060 28.68874 177.9368 60.80144 109.2692       67.22989 
1 1 1 -3  13 5  o 774.5848 14.36928 116.7732       4.322471      114.2051       4.958112      124.9068       8.823783  765.7131 16.67333 798.4092 28.45780 -32.69611      32.98251 
1 1 1 -3  13 6  o 150.1868 45.00786 4.539507       2.832145      8.777657       3.566676      -2.693147      4.659339  206.2040 45.73640 109.4665 49.83996 96.73745       67.64495 
1 1 1 -3  13 7  o 308.3516 26.07779 18.74775       3.093530      17.85293       3.784662      20.54914       5.369870  299.4394 33.09885 318.5368 44.63414 -19.09741      55.56744 
1 1 1 -3  13 8  o 954.5124 14.13500 177.3675       5.239689      167.5316       7.113204      189.0355       7.747433  926.5361 19.76855 984.0784 20.27217 -57.54230      28.31530 
1 1 1 -3  13 9  o 687.9389 15.41243 92.17961       4.117645      91.16620       5.774232      93.22817       5.873497  683.1036 21.76605 690.7604 21.89482 -7.656799      30.87303 
1 1 1 -3  13 10 o 673.3287 18.22469 88.40838       4.765575      84.57560       8.208972      90.35672       5.852810  655.6249 32.24076 680.0193 22.16232 -24.39441      39.12333 
1 1 1 -3  13 11 o 845.2976 21.36379 139.5216       7.013196      0.000000       0.000000      139.5216       7.013196  ?        ?        845.2976 21.36379 0.000000       21.36379 
1 1 1 -3  13 12 o 544.7398 21.18548 57.91435       4.481831      51.82304       7.573661      61.19698       5.559824  510.9611 38.44902 559.3129 25.59636 -48.35181      46.18983 
1 1 1 -3  13 13 o 1260.377 17.86554 309.4790       8.744691      302.1368       14.93562      313.3088       10.78689  1241.239 30.98416 1267.097 21.92090 -25.85779      37.95450 
1 1 1 -3  13 14 o 658.6583 20.81992 84.58108       5.325585      92.55028       9.328578      80.72803       6.486491  685.5669 35.15612 642.7587 25.98567 42.80823       43.71736 
1 1 1 -3  13 15 o 551.7423 21.63806 59.34666       4.636419      61.09728       6.730408      57.76561       6.396129  557.7802 31.19568 542.4484 30.48562 15.33173       43.61816 
1 1 1 -3  13 16 o 1002.351 19.56489 195.6749       7.615972      188.7878       12.66522      199.5758       9.531867  981.8018 33.21704 1011.482 24.26565 -29.68011      41.13628 
1 1 1 -3  13 17 o 387.9644 31.58824 29.62968       4.718002      23.27955       6.479479      36.79607       6.883345  339.5790 50.68457 430.6638 41.67725 -91.08484      65.61951 
1 1 1 -3  13 18 o 508.7359 29.34737 50.73341       5.773537      50.70552       7.022997      50.79155       10.14045  507.4212 35.87016 503.8588 52.59808 3.562378       63.66495 
1 1 1 -3  13 19 o 618.8685 26.44937 74.76981       6.356845      76.73149       7.819576      70.94704       10.91590  625.2968 32.31137 597.5294 47.43052 27.76733       57.39058 
1 1 1 -3  13 20 o 477.8668 30.10621 44.86765       5.558595      46.75854       7.269598      42.20583       8.625161  486.0127 38.83989 458.9123 49.16109 27.10040       62.65261 
1 1 1 -3  13 21 o 1288.830 20.57501 323.9164       10.29826      329.7762       12.52190      311.6694       18.10266  1299.185 24.81826 1258.271 37.04590 40.91357       44.59086 
1 1 1 -3  13 22 o 305.2455 48.50938 18.98382       5.558076      24.06325       7.443491      12.58262       8.356026  341.4102 58.22886 246.4577 77.94829 94.95251       97.29612 
1 1 1 -3  13 23 o 296.4014 61.90847 18.43951       6.896330      21.32313       7.686309      6.534713       15.61745  318.4516 64.36456 243.7674 100.9429 74.68417       119.7174 
1 1 1 -3  13 24 o 237.4823 64.30669 11.96215       6.076782      24.57669       8.023000      -5.013055      9.306973  342.0865 62.70179 152.9138 69.93716 189.1727       93.92934 
1 1 1 -3  13 25 o 394.7203 41.53641 31.42603       6.271625      29.08506       8.289190      34.56034       9.591478  372.5626 59.27671 404.9573 63.03953 -32.39471      86.53156 
1 1 1 -3  13 26 o 597.8094 29.00890 70.59678       6.734757      74.32622       9.197245      66.28513       9.889117  608.0209 39.15859 570.9509 44.96344 37.07001       59.62471 
1 1 1 -3  13 27 o 456.7965 45.14873 42.95948       7.904500      33.44007       12.42447      49.43252       10.24535  374.8495 87.02110 483.5160 55.57197 -108.6665      103.2517 
1 1 1 -3  13 28 o 176.4918 75.45643 2.894231       9.180731      0.000000       0.000000      2.894231       9.180731  ?        ?        176.4918 75.45643 0.000000       75.45643 
1 1 1 -3  13 29 o 283.2545 59.96398 18.20238       6.390692      20.99032       9.032971      15.40847       9.042645  290.5179 78.29265 247.5362 81.33253 42.98175       112.8925 
1 1 1 -3  13 30 o 293.5386 57.00418 19.73136       6.264047      16.14667       8.998190      23.10207       8.725501  245.8521 81.14944 301.8911 74.80546 -56.03891      110.3680 
1 1 1 -3  13 31 o 358.4131 47.18968 28.40583       6.408695      28.50925       9.082309      28.30327       9.044336  333.3997 72.23366 332.2305 72.16387 1.169220       102.1045 
1 1 1 -3  14 1  o 506.5931 18.55194 50.02711       3.649863      49.35126       4.597359      51.17928       6.002641  502.5630 23.55537 509.8387 30.45590 -7.275696      38.50217 
1 1 1 -3  14 2  o 322.9661 25.72029 20.53419       3.199234      23.82656       4.089705      15.34241       5.135657  347.1162 30.65310 273.1806 50.26011 73.93555       58.87012 
1 1 1 -3  14 3  o 248.2181 33.81476 12.33781       3.174798      10.93273       3.974664      14.81435       5.276809  230.5987 45.99567 267.6057 52.65018 -37.00694      69.91169 
1 1 1 -3  14 4  o 613.3211 18.51149 73.34377       4.409173      70.86021       5.485984      77.87509       7.410214  602.0976 23.46171 629.8137 30.29637 -27.71613      38.31869 
1 1 1 -3  14 5  o 488.2614 21.72827 46.56140       4.120079      47.86289       5.161187      44.27502       6.840748  493.5380 27.03058 471.9786 37.63383 21.55933       46.33527 
1 1 1 -3  14 6  o 380.8791 25.07861 28.51171       3.688776      28.51171       3.688776      0.000000       0.000000  380.8791 25.07861 ?        ?        0.000000       25.07861 
1 1 1 -3  14 7  o 414.2868 19.42569 33.48638       3.125400      30.84065       4.381736      36.22654       4.459250  395.4623 28.72689 429.1529 26.89186 -33.69055      39.34979 
1 1 1 -3  14 8  o 310.4932 36.40947 19.27646       4.306957      19.27646       4.306957      0.000000       0.000000  310.4932 36.40947 ?        ?        0.000000       36.40947 
1 1 1 -3  14 9  o 195.4385 46.10410 7.902856       3.442630      6.711545       6.276805      8.415409       4.117136  190.9527 67.64007 201.1546 52.23811 -10.20197      85.46344 
1 1 1 -3  14 10 o 571.3330 24.89010 63.84035       5.522604      0.000000       0.000000      63.84035       5.522604  ?        ?        571.3330 24.89010 0.000000       24.89010 
1 1 1 -3  14 11 o 109.3087 46.66973 0.2319978E-01  3.503390      -4.541892      6.427758      1.952479       4.178615  124.5772 57.39644 133.9441 53.39761 -9.366882      78.39424 
1 1 1 -3  14 12 o 801.1771 18.41592 125.0567       5.729938      120.4000       9.608272      127.6269       7.138144  783.5869 31.57404 808.6622 22.72952 -25.07538      38.90438 
1 1 1 -3  14 13 f 933.2411 18.09127 169.6148       6.556784      172.9437       11.57529      168.0420       7.956311  939.4946 31.72559 928.2385 22.07111 11.25616       38.64773 
1 1 1 -3  14 14 o 353.2322 33.86060 24.67536       4.588050      28.48040       7.804598      22.66598       5.671547  374.5552 55.31938 336.1243 44.54580 38.43091       71.02508 
1 1 1 -3  14 15 o 1201.944 16.27431 281.0907       7.596522      283.1453       10.89442      279.1464       10.59792  1205.053 23.27930 1196.614 22.80546 8.439941       32.58857 
1 1 1 -3  14 16 o 610.7983 21.33066 72.67891       5.059762      75.14985       7.108610      70.14156       7.203500  620.1729 29.51508 598.1528 31.11755 22.02008       42.88871 
1 1 1 -3  14 17 o 552.5530 24.05020 59.52898       5.160843      60.00933       7.264853      59.03963       7.332689  552.6280 34.01581 548.0101 34.63271 4.617920       48.54380 
1 1 1 -3  14 18 o 366.2596 39.59505 26.64954       5.542308      21.99912       6.770226      36.09791       9.650183  328.7551 54.96847 421.4334 60.71498 -92.67831      81.90141 
1 1 1 -3  14 19 o 575.2859 28.43554 64.70346       6.352918      62.31353       7.782143      69.47803       10.99951  562.3411 35.82106 590.4874 48.39120 -28.14624      60.20678 
1 1 1 -3  14 20 o 756.5370 24.34165 111.7727       7.151681      106.6909       8.647058      122.7743       12.72301  738.0144 30.17002 787.5104 41.75029 -49.49603      51.51035 
1 1 1 -3  14 21 o 314.3466 45.82928 19.99933       5.430179      17.09784       7.247954      23.71173       8.198451  284.6721 66.72316 336.8346 65.02898 -52.16251      93.17053 
1 1 1 -3  14 22 o 304.0698 57.81590 19.19885       6.577764      20.73937       7.501167      14.07185       13.68442  314.4736 63.60622 270.9340 99.35645 43.53961       117.9723 
1 1 1 -3  14 23 o 332.8219 57.50167 22.97933       7.163472      22.97280       8.022066      23.00504       15.91478  330.1324 64.88419 321.9221 107.9733 8.210266       125.9690 
1 1 1 -3  14 24 o 406.3524 38.55012 33.05777       6.010732      26.76395       7.882486      41.80192       9.291049  358.0661 58.72171 451.2930 54.09023 -93.22693      79.83729 
1 1 1 -3  14 25 o 180.7747 66.82523 5.832059       6.210005      13.61535       8.156319      -4.902609      9.578708  249.1126 76.73965 153.8023 70.56614 95.31038       104.2524 
1 1 1 -3  14 26 o 299.8897 67.95394 19.93954       7.731041      17.11630       13.12260      21.44035       9.567748  271.8811 97.64119 304.9663 79.84566 -33.08517      126.1314 
1 1 1 -3  14 27 o 207.9815 67.62184 9.510068       6.256967      4.578303       8.438161      15.53376       9.325624  181.9432 74.65022 256.2561 82.48519 -74.31294      111.2495 
1 1 1 -3  14 28 o 184.4509 66.62865 7.117273       6.120654      6.981227       8.346107      7.275576       9.002990  192.0912 75.81548 196.4802 78.36288 -4.388977      109.0354 
1 1 1 -3  14 29 o 298.7177 56.82997 20.13912       6.351852      14.17789       9.024848      25.99072       8.941483  235.3272 81.26431 326.8694 72.35061 -91.54221      108.8049 
1 1 1 -3  14 30 o 263.4400 61.81674 16.62785       6.215518      19.29329       9.111205      14.30767       8.500662  265.4048 80.99615 230.7476 78.90436 34.65717       113.0764 
1 1 1 -3  14 31 o 218.1082 66.30918 12.17605       6.114997      8.260750       8.616998      16.14805       8.679160  186.3129 75.82334 237.9239 79.73636 -51.61101      110.0321 
1 1 1 -3  15 1  o 576.5723 16.47157 64.76042       3.688219      64.62328       5.086949      64.91240       5.355246  575.1155 22.77584 576.2162 23.93128 -1.100708      33.03703 
1 1 1 -3  15 2  o 115.9993 45.93159 1.518096       3.072540      3.421171       3.962455      -1.351618      4.865817  144.9001 53.41495 119.5746 52.94460 25.32552       75.20830 
1 1 1 -3  15 3  o 180.9611 45.23293 6.766418       3.170135      6.090874       3.961397      7.969530       5.286579  173.7622 53.47287 198.0599 61.90921 -24.29770      81.80524 
1 1 1 -3  15 4  o 215.9265 62.68217 9.710716       5.566141      0.000000       0.000000      9.710716       5.566141  ?        ?        215.9265 62.68217 0.000000       62.68217 
1 1 1 -3  15 5  o 670.0693 23.53766 87.77162       6.125069      87.77162       6.125069      0.000000       0.000000  670.0693 23.53766 ?        ?        0.000000       23.53766 
1 1 1 -3  15 6  o 529.9714 21.89018 54.85316       4.505363      53.64380       5.546618      57.19849       7.724200  522.5443 27.42822 537.0432 37.26595 -14.49884      46.27158 
1 1 1 -3  15 7  o 450.0277 27.90811 39.83379       4.853449      37.16299       6.665556      42.84780       7.080884  431.6283 40.22821 463.8705 39.68847 -32.24222      56.51092 
1 1 1 -3  15 8  o 349.9725 27.56121 24.13281       3.715621      21.62236       6.530602      25.33445       4.518197  324.5471 53.69131 357.5578 32.90731 -33.01065      62.97339 
1 1 1 -3  15 9  o 527.3806 25.36925 54.37769       5.195889      0.000000       0.000000      54.37769       5.195889  ?        ?        527.3806 25.36925 0.000000       25.36925 
1 1 1 -3  15 10 o 584.6807 20.60379 66.66161       4.678363      79.66013       8.774228      61.49829       5.530024  635.4999 35.69667 560.9669 25.38410 74.53302       43.80188 
1 1 1 -3  15 11 o 1060.230 17.52969 218.8917       7.217755      225.5999       12.70644      215.6960       8.770038  1073.281 30.48473 1051.717 21.47210 21.56445       37.28766 
1 1 1 -3  15 12 o 1156.982 17.75379 260.6288       7.977108      267.1996       14.13777      257.5598       9.662077  1168.206 31.16258 1149.397 21.64574 18.80933       37.94265 
1 1 1 -3  15 13 o 1424.350 18.58517 395.0275       10.28043      387.1979       17.48634      399.1632       12.70876  1406.364 32.01645 1430.775 22.87199 -24.41077      39.34693 
1 1 1 -3  15 14 o 773.7416 17.80696 116.5229       5.350740      119.1565       7.744235      114.1172       7.401570  781.4702 25.51750 764.8526 24.91829 16.61755       35.66600 
1 1 1 -3  15 15 o 174.1638 54.09804 5.992562       4.043874      2.776400       5.738708      9.164702       5.699297  157.9215 62.69614 212.8810 63.85867 -54.95956      89.49154 
1 1 1 -3  15 16 o 661.3857 20.75515 85.19495       5.330999      79.89461       7.628217      90.25482       7.453174  639.3389 30.72302 679.8758 28.22824 -40.53687      41.72214 
1 1 1 -3  15 17 o 1062.647 17.78907 219.7791       7.341252      230.6424       10.51010      209.4293       10.25867  1087.384 24.88834 1036.056 25.49645 51.32764       35.63002 
1 1 1 -3  15 18 o 760.0218 23.81522 112.6878       7.029244      125.4211       8.743109      89.41308       11.82056  801.0807 28.10358 671.3752 45.60660 129.7055       53.57027 
1 1 1 -3  15 19 o 559.9639 29.23946 61.53735       6.336479      61.53950       7.764589      61.53306       10.96376  558.4600 35.99295 553.8531 51.56516 4.606873       62.88448 
1 1 1 -3  15 20 o 375.5742 38.96900 28.10584       5.601121      26.11262       7.563636      30.52621       8.334752  356.9233 56.44379 386.2036 57.30951 -29.28036      80.43806 
1 1 1 -3  15 21 o 459.6842 34.48946 41.80316       6.112187      47.26079       8.328176      35.43153       8.998571  486.0350 44.62013 416.1508 57.19123 69.88416       72.53822 
1 1 1 -3  15 22 o 267.6798 66.43772 15.21580       6.874093      14.38421       7.730262      18.35844       15.02756  259.7375 73.39029 296.4296 104.6963 -36.69211      127.8572 
1 1 1 -3  15 23 o 236.7143 74.37127 11.79225       7.618194      11.79225       7.618194      0.000000       0.000000  236.7143 74.37127 ?        ?        0.000000       74.37127 
1 1 1 -3  15 24 o 706.8760 25.94981 98.15685       7.123696      99.92234       9.533075      95.92439       10.71989  710.0400 34.57182 692.2437 40.04631 17.79639       52.90480 
1 1 1 -3  15 25 o 123.1384 58.48955 -8.035027      7.582958      -14.76337      13.02092      -4.581992      9.327984  154.8420 74.38440 151.6504 69.60009 3.191544       101.8686 
1 1 1 -3  15 26 o 152.7353 67.15285 -0.2233897     7.696910      -16.40461      12.70131      9.167358       9.675933  147.0106 71.31342 215.7892 82.61187 -68.77859      109.1344 
1 1 1 -3  15 27 o 145.7411 62.52989 1.131492       6.344789      2.626528       8.559453      -0.6918502     9.452667  170.8896 72.95468 162.7104 72.80625 8.179230       103.0686 
1 1 1 -3  15 28 o 309.2237 54.45279 21.10470       6.300291      11.85217       8.475388      32.53231       9.419052  222.0961 78.60640 374.6797 67.20097 -152.5836      103.4163 
1 1 1 -3  15 29 o 644.1095 39.27707 86.75440       9.777920      86.75440       9.777920      0.000000       0.000000  644.1095 39.27707 ?        ?        0.000000       39.27707 
1 1 1 -3  15 30 o 389.4068 61.86114 36.12852       9.042272      0.000000       0.000000      36.12852       9.042272  ?        ?        389.4068 61.86114 0.000000       61.86114 
1 1 1 -3  16 1  o 511.3043 24.79896 51.11518       4.924259      51.11518       4.924259      0.000000       0.000000  511.3043 24.79896 ?        ?        0.000000       24.79896 
1 1 1 -3  16 2  o 347.3816 24.40546 23.70301       3.271571      24.12754       4.555099      23.25070       4.701788  348.6280 34.07983 341.7493 35.96628 6.878693       49.54804 
1 1 1 -3  16 3  o 478.2097 19.79876 44.60113       3.676922      42.72373       5.038682      46.73972       5.377772  466.2064 27.95895 487.5797 28.52498 -21.37326      39.94218 
1 1 1 -3  16 4  o 169.2311 48.81005 5.840642       3.384887      5.840642       3.384887      0.000000       0.000000  169.2311 48.81005 ?        ?        0.000000       48.81005 
1 1 1 -3  16 5  o 339.1480 38.21847 22.96430       4.945985      22.96430       4.945985      0.000000       0.000000  339.1480 38.21847 ?        ?        0.000000       38.21847 
1 1 1 -3  16 6  o 576.8837 21.43768 64.93494       4.802794      64.15292       6.026476      66.29621       7.951032  572.5722 27.10224 579.4205 35.50597 -6.848267      44.66772 
1 1 1 -3  16 7  o 503.6002 23.20559 49.51564       4.538439      46.09360       5.675660      55.58374       7.557887  484.0284 30.34726 530.1250 36.94171 -46.09659      47.80843 
1 1 1 -3  16 8  o 542.6705 25.22622 57.53381       5.316384      0.000000       0.000000      57.53381       5.316384  ?        ?        542.6705 25.22622 0.000000       25.22622 
1 1 1 -3  16 9  o 698.1306 23.10593 95.09978       6.264525      0.000000       0.000000      95.09978       6.264525  ?        ?        698.1306 23.10593 0.000000       23.10593 
1 1 1 -3  16 10 o 164.5542 51.86947 5.325446       3.702477      2.357276       6.560967      6.712341       4.484823  162.5794 66.16302 183.5190 56.96583 -20.93961      87.30780 
1 1 1 -3  16 11 o 770.7121 19.01130 115.6740       5.690259      121.0700       10.10611      113.1692       6.885418  786.1858 33.10020 761.7747 23.27425 24.41107       40.46374 
1 1 1 -3  16 12 o 366.9578 28.14519 26.45529       3.980394      22.59160       5.732652      30.05196       5.531015  335.6640 45.11935 389.6998 36.98988 -54.03580      58.34387 
1 1 1 -3  16 13 o 842.3691 16.85858 138.0637       5.515076      141.2446       8.005988      135.1911       7.608198  851.1046 24.22167 832.7646 23.52510 18.33990       33.76566 
1 1 1 -3  16 14 o 314.4514 34.86016 19.59089       4.185437      25.11757       6.174720      14.89322       5.692809  354.2803 45.96195 269.2553 56.25538 85.02496       72.64413 
1 1 1 -3  16 15 o 537.8070 23.15038 56.37068       4.835178      59.13306       7.002283      53.85318       6.684716  548.8153 33.00729 523.6461 33.04074 25.16919       46.70301 
1 1 1 -3  16 16 o 309.2362 46.87395 19.27000       5.452777      18.86448       6.667179      20.08921       9.476068  303.0511 58.77076 308.9316 78.74872 -5.880554      98.26171 
1 1 1 -3  16 17 o 509.9087 30.81623 51.06010       6.073718      53.24316       7.506467      46.92105       10.33599  519.3683 37.46779 482.3785 56.22942 36.98981       67.56910 
1 1 1 -3  16 18 o 1406.661 20.56479 385.7146       11.23419      395.3032       13.92418      367.8330       19.01491  1422.652 25.20246 1368.292 35.78390 54.36047       43.76815 
1 1 1 -3  16 19 o 624.8295 27.57745 76.39623       6.691810      78.65691       8.302911      72.20576       11.30430  631.8757 33.95990 600.6915 48.88181 31.18420       59.52063 
1 1 1 -3  16 20 f 546.1649 28.70362 58.60249       6.066843      54.51805       8.196244      63.55228       9.022817  523.6638 40.62058 565.3785 41.38115 -41.71472      57.98647 
1 1 1 -3  16 21 o 637.0352 31.20075 79.71542       7.718919      73.04968       8.791534      102.1418       16.12574  607.1880 37.46626 708.4758 59.15025 -101.2878      70.01766 
1 1 1 -3  16 22 o 452.2733 37.66801 40.74614       6.555931      41.15699       8.569271      40.16627       10.18050  450.3961 49.82618 440.2124 61.20562 10.18362       78.92260 
1 1 1 -3  16 23 f 155.2790 63.77146 2.215834       6.165370      -2.745598      8.126420      8.944828       9.463915  149.1159 67.05534 220.5877 82.30594 -71.47183      106.1635 
1 1 1 -3  16 24 o 572.1631 41.51952 66.06356       9.162896      66.06356       9.162896      0.000000       0.000000  572.1631 41.51952 ?        ?        0.000000       41.51952 
1 1 1 -3  16 25 o 127.9135 59.85020 -5.810157      7.416687      -1.184162      12.08830      -8.602777      9.392232  183.2328 82.13660 138.5577 65.60419 44.67509       105.1206 
1 1 1 -3  16 26 o 558.0626 32.27903 62.50727       6.965830      72.11942       9.707708      52.30517       10.00119  592.6954 42.45644 497.1453 52.60014 95.55005       67.59677 
1 1 1 -3  16 27 o 261.6426 60.75069 15.51819       6.054388      24.52231       8.310398      5.333643       8.838365  325.4515 67.94595 184.3177 76.09960 141.1338       102.0186 
1 1 1 -3  16 28 o 245.1687 64.23504 14.26955       6.189432      21.22180       8.704425      7.159323       8.802760  290.0442 76.26413 189.6414 76.83461 100.4028       108.2579 
1 1 1 -3  16 29 o 103.7931 49.93465 -6.638825      5.918529      -1.541753      8.419266      -11.61847      8.321713  143.8443 66.05640 114.2849 55.93690 29.55937       86.55857 
1 1 1 -3  17 1  o 556.3846 18.22947 60.30361       3.938920      61.98233       5.513484      58.55365       5.629270  563.2529 25.20546 547.2783 26.48597 15.97455       36.56257 
1 1 1 -3  17 2  o 1011.701 15.04989 199.1849       5.913075      199.3954       8.242047      198.9617       8.488080  1011.187 20.98822 1009.951 21.64120 1.236084       30.14709 
1 1 1 -3  17 3  o 244.5681 45.01866 12.19518       4.118276      9.817733       4.666229      20.57205       8.758934  217.5558 55.15369 311.6135 73.55919 -94.05769      91.93957 
1 1 1 -3  17 4  o 1261.703 21.68187 310.4878       10.62385      310.4878       10.62385      0.000000       0.000000  1261.703 21.68187 ?        ?        0.000000       21.68187 
1 1 1 -3  17 5  o 913.8364 15.29371 162.5067       5.427620      165.1438       6.358872      155.4290       10.41750  920.8724 17.78086 890.9597 30.10769 29.91272       34.96616 
1 1 1 -3  17 6  o 293.9718 30.54115 17.09754       3.435840      16.93378       3.974673      17.58169       6.834130  291.5285 35.86316 290.7267 62.39668 0.8018188      71.96883 
1 1 1 -3  17 7  f 1182.296 18.21001 272.1936       8.361119      277.8009       10.48598      262.4055       13.85434  1193.497 22.62350 1157.804 30.81221 35.69287       38.22584 
1 1 1 -3  17 8  o 869.5320 19.26928 147.2609       6.506975      140.7722       7.915367      160.7865       11.42801  849.4511 23.99411 906.0638 32.47758 -56.61267      40.37958 
1 1 1 -3  17 9  o 530.2765 22.44004 54.81520       4.621192      40.03527       7.663061      63.26198       5.793108  448.5057 44.58627 569.2662 26.20404 -120.7605      51.71641 
1 1 1 -3  17 10 o 1485.318 16.17184 429.2197       9.328393      445.9039       13.66866      414.6741       12.76258  1512.341 23.27278 1458.603 22.53062 53.73792       32.39215 
1 1 1 -3  17 11 o 1095.981 15.74739 233.6491       6.702546      237.5635       9.582231      229.8992       9.378708  1104.146 22.34663 1086.208 22.23319 17.93762       31.52280 
1 1 1 -3  17 12 o 540.5084 20.80943 56.89458       4.368080      60.97467       6.236948      52.96667       6.119521  558.0668 28.87668 519.7793 30.44877 38.28754       41.96415 
1 1 1 -3  17 13 o 1547.330 16.72429 465.7745       10.04983      455.0818       13.90029      477.4854       14.54696  1528.095 23.42317 1565.131 23.93281 -37.03625      33.48767 
1 1 1 -3  17 14 o 663.4228 29.37776 85.96833       7.568976      85.96833       7.568976      0.000000       0.000000  663.4228 29.37776 ?        ?        0.000000       29.37776 
1 1 1 -3  17 15 o 764.2187 22.29447 113.8182       6.616720      120.0136       8.139019      101.7431       11.36277  784.1204 26.72768 718.3464 40.89996 65.77393       48.85873 
1 1 1 -3  17 16 o 290.8337 43.23521 17.02109       4.734696      13.30287       6.734136      20.65598       6.658253  252.6379 67.39285 317.7501 56.00314 -65.11223      87.62504 
1 1 1 -3  17 17 o 571.2399 29.49180 64.03366       6.520241      60.18044       7.947850      71.96470       11.40258  551.9921 37.29442 600.2301 49.35391 -48.23804      61.86018 
1 1 1 -3  17 18 o 379.2200 42.85647 28.77925       6.200792      23.88342       7.634294      38.27089       10.62982  340.1001 59.99364 430.4593 65.66576 -90.35916      88.94509 
1 1 1 -3  17 19 o 343.4027 62.96271 24.53172       8.087384      0.000000       0.000000      24.53172       8.087384  ?        ?        343.4027 62.96271 0.000000       62.96271 
1 1 1 -3  17 20 o 216.7983 69.14505 9.560541       6.564620      11.34658       7.652961      4.586378       12.77155  234.6987 74.63625 219.9375 91.19631 14.76114       117.8446 
1 1 1 -3  17 21 o 481.6217 39.79265 46.27192       7.376150      44.80729       8.358592      51.42683       15.68121  471.7152 46.22118 486.0854 86.22659 -14.37015      97.83366 
1 1 1 -3  17 22 o 825.1891 23.54432 133.3694       7.545147      116.3508       9.914393      156.7908       11.63087  767.4639 33.26444 890.7454 33.62256 -123.2815      47.29693 
1 1 1 -3  17 23 o 291.0136 58.93728 18.05576       6.432507      13.90776       8.617743      23.27439       9.666134  251.3964 79.11872 322.3341 78.05002 -70.93776      111.1376 
1 1 1 -3  17 24 o 480.4657 43.61525 47.11160       8.049531      47.83295       13.74844      46.73534       9.929334  459.7859 79.89584 471.8194 55.23495 -12.03345      97.13005 
1 1 1 -3  17 25 o 455.2757 45.96856 42.94665       8.016317      34.98600       12.97763      47.85808       10.19354  378.8048 89.61746 473.5143 56.55123 -94.70947      105.9685 
1 1 1 -3  17 26 o 139.5312 60.38259 0.6544570      6.016367      4.806288       8.302818      -3.935705      8.730109  179.8471 73.94972 144.2814 66.62132 35.56570       99.53372 
1 1 1 -3  17 27 o 196.9087 65.84850 8.898067       5.918985      12.11077       8.815427      6.260718       7.987150  222.6123 80.01992 183.0225 73.52586 39.58975       108.6703 
1 1 1 -3  17 28 o 149.2308 60.97231 3.458839       5.599807      -5.070916      8.396232      10.29283       7.515422  132.8649 62.63978 204.5212 73.83833 -71.65630      96.82893 
1 1 1 -3  17 29 o 243.5695 62.64434 14.55959       5.959147      3.703090       8.838128      23.60935       8.069268  165.9351 72.48108 305.3886 69.58928 -139.4536      100.4797 
1 1 1 -3  18 1  o 392.5721 26.08209 30.21970       3.953770      23.36239       5.961348      35.60496       5.282881  341.0003 46.20543 425.2419 32.22902 -84.24164      56.33517 
1 1 1 -3  18 2  o 478.0629 34.25928 45.02070       6.318330      35.95488       8.315813      57.40186       9.718110  422.8362 51.71941 536.9831 47.07599 -114.1469      69.93602 
1 1 1 -3  18 3  o 281.1331 41.65932 15.88225       4.410678      19.18753       5.006611      4.424575       9.321539  309.2796 42.83339 198.4553 79.53470 110.8243       90.33530 
1 1 1 -3  18 4  o 398.3580 27.57585 31.14427       4.239851      33.42861       5.371371      27.36837       6.905819  411.6942 33.89684 368.7890 49.46468 42.90515       59.96458 
1 1 1 -3  18 5  o 660.2885 17.50028 84.85829       4.487525      86.43501       5.255686      80.61588       8.621027  666.1205 20.31649 640.4188 34.79364 25.70172       40.29090 
1 1 1 -3  18 6  o 586.2720 19.28293 66.92858       4.390359      69.76016       5.208116      59.97508       8.161458  598.2516 22.41655 551.4219 38.35011 46.82971       44.42108 
1 1 1 -3  18 7  o 300.0983 39.48632 17.98112       4.490179      16.19265       5.584806      21.25075       7.551210  281.5192 53.02790 321.0441 62.81485 -39.52487      82.20501 
1 1 1 -3  18 8  o 744.3763 23.75006 108.0227       6.865707      109.6762       9.529119      106.2377       9.900687  748.7060 32.77280 736.5552 34.61242 12.15076       47.66630 
1 1 1 -3  18 9  o 807.9260 18.73581 127.0513       5.878574      124.6642       6.966771      132.9526       10.95410  799.8872 22.42719 824.1815 34.22362 -24.29425      40.91742 
1 1 1 -3  18 10 o 859.3019 16.34123 143.6325       5.453290      134.3894       7.439442      154.3668       8.017156  830.4700 23.06685 890.0410 23.19436 -59.57098      32.71174 
1 1 1 -3  18 11 o 783.8257 17.27587 119.5308       5.258810      115.6272       7.320406      123.6936       7.559516  770.1688 24.47492 796.5851 24.43621 -26.41638      34.58540 
1 1 1 -3  18 12 o 832.0642 17.26035 134.6990       5.577433      126.3204       7.797217      143.4781       7.981370  804.9114 24.94385 857.9724 23.95390 -53.06104      34.58302 
1 1 1 -3  18 13 f 957.4113 20.16735 178.4890       7.498518      177.1841       9.062467      181.3219       13.35265  953.2743 24.47939 962.1039 35.73695 -8.829651      43.31709 
1 1 1 -3  18 14 o 609.1870 21.88635 72.31902       5.177879      78.54380       7.371009      66.25504       7.275184  633.8777 29.94288 580.9756 32.37331 52.90204       44.09770 
1 1 1 -3  18 15 o 543.9376 24.20579 57.73156       5.113242      53.31302       7.299066      61.98953       7.165224  519.8912 36.38084 561.5256 33.00241 -41.63440      49.11949 
1 1 1 -3  18 16 o 528.5568 30.68657 54.89721       6.271834      54.12631       7.709291      56.40607       10.78551  523.1211 38.21196 529.6817 53.14893 -6.560608      65.45963 
1 1 1 -3  18 17 o 832.5914 23.87879 135.3727       7.720976      131.5297       9.513915      142.7865       13.21431  819.3707 29.89860 850.7428 39.99615 -31.37207      49.93614 
1 1 1 -3  18 18 o 243.4226 63.45031 12.43501       6.059422      14.95730       7.845180      8.705301       9.539891  265.6847 73.53596 223.6064 82.79261 42.07825       110.7346 
1 1 1 -3  18 19 o 423.0859 35.55878 35.50189       5.788380      35.26747       7.953504      35.76588       8.440167  417.4685 50.05577 419.4482 52.99638 -1.979767      72.89854 
1 1 1 -3  18 20 o 150.1776 64.32550 0.2997079      6.694261      3.661857       8.012453      -7.472202      12.18206  181.3630 73.36603 170.7652 78.79677 10.59779       107.6638 
1 1 1 -3  18 21 o 134.9960 59.38320 -1.040913      6.025487      -5.529952      8.195776      4.239670       8.889029  139.5105 64.46467 189.9687 77.12521 -50.45825      100.5186 
1 1 1 -3  18 22 o 199.3202 67.85000 8.015237       6.285376      21.32108       8.503347      -8.010509      9.332067  311.5529 71.75950 141.6609 66.55356 169.8920       97.87135 
1 1 1 -3  18 23 o 271.4155 63.52765 16.11291       6.577709      22.11097       9.100834      9.552731       9.517735  312.7406 75.73724 220.4433 82.48299 92.29730       111.9802 
1 1 1 -3  18 24 o 260.0514 73.62941 15.51416       7.772478      20.34104       13.33306      13.02949       9.566011  286.1130 98.77605 240.0179 83.62080 46.09508       129.4185 
1 1 1 -3  18 25 o 562.8496 32.22224 63.72161       7.014037      64.31974       9.464327      62.99282       10.44701  557.2241 44.09547 546.8372 49.73706 10.38696       66.46943 
1 1 1 -3  18 26 o 287.0361 57.97026 18.50284       6.239514      11.16871       8.767483      26.02921       8.881637  217.8232 79.58128 331.2479 71.16338 -113.4247      106.7586 
1 1 1 -3  18 27 o 182.0427 63.63579 7.513354       5.542163      19.23338       8.418992      -1.449613      7.362439  273.9922 76.30012 137.9568 62.74937 136.0354       98.78862 
1 1 1 -3  18 28 o 320.6989 47.35695 22.68513       5.720613      34.90393       9.003848      14.41384       7.407985  383.1420 62.67978 234.7178 73.27205 148.4243       96.42379 
1 1 1 -3  19 1  o 523.4872 28.34977 53.66062       5.741981      50.90720       7.025863      59.19862       9.964145  508.5590 35.80227 545.9647 47.46692 -37.40573      59.45511 
1 1 1 -3  19 2  o 1071.693 22.09239 223.7693       9.194779      217.0328       11.76491      234.3417       14.73872  1054.214 28.73635 1094.029 34.68991 -39.81421      45.04628 
1 1 1 -3  19 3  o 287.9972 38.30587 16.54441       4.178044      10.31739       6.355246      21.28425       5.544648  225.4283 67.39074 325.8761 45.01384 -100.4478      81.04170 
1 1 1 -3  19 4  o 581.7700 24.85165 65.99632       5.614804      46.47077       10.11579      74.69033       6.750066  481.3237 55.11031 618.5446 28.10018 -137.2208      61.86086 
1 1 1 -3  19 5  o 1565.819 16.49271 476.9460       10.02909      465.2770       11.32645      519.3087       21.58094  1546.114 18.86358 1629.046 34.11215 -82.93152      38.98042 
1 1 1 -3  19 6  o 419.3185 47.47113 35.06757       7.594213      0.000000       0.000000      35.06757       7.594213  ?        ?        419.3185 47.47113 0.000000       47.47113 
1 1 1 -3  19 7  f 775.7242 17.62613 117.0790       5.309974      121.6337       6.218089      104.8119       10.20471  790.4164 20.25690 731.6673 35.91360 58.74915       41.23262 
1 1 1 -3  19 8  o 657.3710 19.23682 84.10772       4.911021      84.02957       5.675887      84.34046       9.795535  656.8060 22.25198 654.8413 38.68981 1.964661       44.63241 
1 1 1 -3  19 9  o 608.8724 20.08028 72.17022       4.748146      74.83501       5.568294      65.06971       9.089402  619.7532 23.13531 574.4155 41.01530 45.33765       47.09032 
1 1 1 -3  19 10 o 1105.326 18.43874 237.7530       7.914978      235.4452       9.501237      242.9864       14.30757  1099.402 22.25337 1114.741 33.04942 -15.33972      39.84315 
1 1 1 -3  19 11 o 671.1384 18.92375 87.67137       4.932276      95.98394       6.989568      79.42637       6.961102  701.5355 25.65504 637.8864 28.10002 63.64911       38.04987 
1 1 1 -3  19 12 f 411.4075 32.98603 33.32748       5.225918      35.18424       6.427533      29.70621       8.976290  421.5064 39.73449 381.2277 62.81797 40.27872       74.32986 
1 1 1 -3  19 13 o 201.3320 53.37712 8.330582       4.241185      18.86643       6.242602      -0.7015093     5.779963  303.7755 54.93799 135.7764 58.97070 167.9991       80.59607 
1 1 1 -3  19 14 o 642.2200 25.56782 80.53683       6.376840      81.29616       7.845224      79.05827       10.94737  644.3361 31.35197 631.1161 44.95942 13.22003       54.81146 
1 1 1 -3  19 15 o 758.6107 24.04570 112.3498       7.084094      113.9323       8.713223      109.2638       12.16729  762.9209 29.40840 742.7963 42.35444 20.12457       51.56310 
1 1 1 -3  19 16 o 755.7747 24.99181 111.6066       7.335302      118.7916       9.171413      98.85072       12.22009  778.5798 30.33229 705.0869 44.86086 73.49286       54.15297 
1 1 1 -3  19 17 o 376.0091 44.06905 28.37496       6.313124      32.74818       7.872486      20.49552       10.56717  402.0255 51.61526 308.0637 85.37325 93.96182       99.76336 
1 1 1 -3  19 18 o 327.7954 46.13453 21.75972       5.710454      28.51418       8.274269      15.61657       7.890963  371.7019 59.31393 270.6584 73.27544 101.0436       94.27318 
1 1 1 -3  19 19 o 258.4692 67.47286 14.22984       6.845405      16.81935       8.436720      9.240123       11.71124  279.2555 75.83569 235.5263 90.70934 43.72925       118.2338 
1 1 1 -3  19 20 o 334.3007 48.06288 22.86471       6.060438      27.71084       8.407114      17.62202       8.744335  363.1788 61.82206 283.6864 77.27548 79.49243       98.96194 
1 1 1 -3  19 21 o 314.8917 51.46463 20.61841       6.076129      18.70640       8.374119      22.74420       8.829874  290.9290 73.95728 321.9072 72.38777 -30.97821      103.4875 
1 1 1 -3  19 22 o 721.3962 25.54948 102.4747       7.157871      110.0415       9.835315      93.95381       10.43697  743.5560 34.06015 683.1672 39.50730 60.38879       52.16245 
1 1 1 -3  19 23 o 246.2058 71.68322 13.72295       7.269908      34.39046       13.05354      4.430116       8.753026  377.4539 90.26804 184.4594 75.89677 192.9945       117.9349 
1 1 1 -3  19 24 o 134.6291 59.48256 -0.5678468     6.109632      -0.9250693     8.222782      -0.1275767     9.128700  152.5366 68.10426 163.0616 72.34330 -10.52504      99.35665 
1 1 1 -3  19 25 o 125.5885 56.83966 -1.775989      5.949104      -1.136394      8.109209      -2.521408      8.754393  148.4777 66.85596 148.3289 67.83615 0.1487885      95.24422 
1 1 1 -3  19 26 o 412.5374 40.89865 35.75528       6.466052      33.43259       9.437339      37.81039       8.877109  376.5005 66.99966 410.2617 57.27853 -33.76123      88.14639 
1 1 1 -3  19 27 o 277.2898 56.22095 17.75487       5.847048      17.90627       8.390967      17.61197       8.152154  259.4951 77.40390 258.5913 76.08607 0.9038696      108.5378 
1 1 1 -3  20 1  o 286.9680 40.67920 16.45965       4.406577      15.73843       4.962929      19.14622       9.578690  279.0903 47.49044 302.8275 80.18378 -23.73718      93.19218 
1 1 1 -3  20 2  o 759.0584 19.37471 112.1313       5.711344      116.3509       9.135937      109.4243       7.317513  771.9293 30.47527 749.2629 25.14787 22.66638       39.51149 
1 1 1 -3  20 3  o 446.7381 27.19315 39.06778       4.695357      41.05620       7.257528      37.63638       6.157676  455.6447 41.46802 436.9950 36.62144 18.64969       55.32383 
1 1 1 -3  20 4  o 987.9141 18.92946 189.9223       7.262488      184.9254       11.56308      193.1776       9.332988  973.1375 30.59648 995.6718 24.13663 -22.53424      38.97077 
1 1 1 -3  20 5  o 277.6231 67.07253 15.96781       7.150592      0.000000       0.000000      15.96781       7.150592  ?        ?        277.6231 67.07253 0.000000       67.07253 
1 1 1 -3  20 6  o 119.1066 50.73103 0.3716181E-01  4.121690      -2.702208      5.081592      5.304989       7.046773  116.2813 52.58840 187.8467 70.83588 -71.56535      88.22279 
1 1 1 -3  20 7  o 139.9923 53.65474 2.656938       4.084411      7.025509       4.979996      -6.320490      7.138964  189.5051 60.20131 127.3752 59.30528 62.12987       84.50630 
1 1 1 -3  20 8  o 1395.030 16.94731 378.5761       9.181466      371.3962       10.53245      401.3018       18.73827  1381.309 19.63409 1432.463 33.68356 -51.15405      38.98820 
1 1 1 -3  20 9  f 511.0341 25.37458 50.92529       5.035896      56.17043       6.085718      39.53258       8.969057  535.5319 29.37376 444.1429 53.04885 91.38892       60.63826 
1 1 1 -3  20 10 o 632.2333 22.79363 77.89771       5.596530      80.23667       6.762459      72.81368       9.970020  641.1689 27.15840 607.1027 42.55593 34.06628       50.48352 
1 1 1 -3  20 11 f 242.8970 51.31417 12.10721       4.688800      14.23527       5.733005      7.808106       8.148537  262.5665 57.78972 212.1815 76.84229 50.38503       96.14774 
1 1 1 -3  20 12 o 584.1157 25.75114 66.61242       5.841486      69.78826       7.117504      60.05886       10.22439  596.3999 30.83541 548.8638 48.46509 47.53613       57.44291 
1 1 1 -3  20 13 o 773.0235 22.93128 116.5750       6.884130      114.4023       8.416846      120.9656       11.96487  764.8504 28.33642 782.9308 39.47818 -18.08038      48.59505 
1 1 1 -3  20 14 o 417.5437 37.89401 34.58444       6.077773      31.13231       7.439442      41.51259       10.53915  392.8831 49.88248 450.5267 61.86951 -57.64359      79.47388 
1 1 1 -3  20 15 o 1074.448 21.47276 225.2041       8.959862      217.1800       10.81378      242.7762       16.00260  1053.884 26.42144 1110.505 37.10582 -56.62048      45.55145 
1 1 1 -3  20 16 o 458.8246 37.32460 41.74645       6.593092      42.75275       8.290144      40.01459       10.87564  461.6364 46.89267 439.8030 65.68821 21.83334       80.70851 
1 1 1 -3  20 17 o 499.2960 30.41900 49.10434       5.870228      55.85943       8.484309      42.90089       8.130502  529.5097 41.59333 462.3007 45.89258 67.20905       61.93653 
1 1 1 -3  20 18 o 270.3704 61.88865 15.44844       6.357959      13.44174       7.824809      19.34760       10.90732  251.3300 74.69670 297.0341 88.17049 -45.70410      115.5579 
1 1 1 -3  20 19 o 174.0899 68.96680 4.025808       6.930259      -3.704819      8.349563      21.14646       12.42558  147.8232 67.07745 306.1559 94.78491 -158.3326      116.1188 
1 1 1 -3  20 20 o 320.9875 49.77291 21.32300       6.003638      5.372519       8.331494      38.55140       8.658814  191.2042 75.65894 432.1304 52.68676 -240.9262      92.19636 
1 1 1 -3  20 21 o 520.6305 47.84482 55.60040       9.565455      0.000000       0.000000      55.60040       9.565455  ?        ?        520.6305 47.84482 0.000000       47.84482 
1 1 1 -3  20 22 f 578.8563 36.46910 67.47947       8.156384      61.53282       14.98891      69.98111       9.721781  523.0947 76.00822 585.4545 43.06094 -62.35974      87.35843 
1 1 1 -3  20 23 o 441.7187 38.37651 39.80281       6.517810      46.74411       9.205505      32.82498       9.229692  470.4956 51.20758 385.0216 63.97186 85.47397       81.94275 
1 1 1 -3  20 24 o 145.6756 61.19243 2.033280       5.860837      -1.943698      8.002662      6.633892       8.607275  144.6988 65.66338 190.5929 76.41157 -45.89407      100.7492 
1 1 1 -3  20 25 o 480.9297 35.12561 47.48601       6.515072      55.83024       9.318126      39.50562       9.112714  510.5594 47.54179 420.3029 57.32366 90.25644       74.47298 
1 1 1 -3  20 26 o 150.2871 61.61675 3.502947       5.743630      0.8699228      8.146868      6.104982       8.098785  152.4395 67.94476 178.1077 73.11171 -25.66820      99.80888 
1 1 1 -3  20 27 o 346.9873 46.80605 26.52806       6.146358      22.76440       9.076981      29.71501       8.352652  289.6692 78.65939 351.1229 63.59591 -61.45374      101.1521 
1 1 1 -3  21 1  o 1161.533 19.09830 262.5320       8.614983      262.3312       10.15814      263.0467       16.25908  1160.606 22.53725 1159.514 36.10704 1.092651       42.56344 
1 1 1 -3  21 2  o 334.1490 32.52962 22.01852       4.167787      22.56859       5.587941      21.32887       6.256908  336.2892 43.82866 325.1594 51.24582 11.12985       67.43208 
1 1 1 -3  21 3  o 139.6759 54.35061 2.428114       4.238190      3.101551       6.263070      1.859239       5.756352  165.6433 65.58125 151.9501 61.92072 13.69312       90.19466 
1 1 1 -3  21 4  o 384.4657 36.87228 29.19784       5.437829      26.85093       10.04266      30.17137       6.468078  359.7293 74.34396 389.6180 43.48926 -29.88870      86.12979 
1 1 1 -3  21 5  o 336.6520 62.23472 23.20410       7.836874      0.000000       0.000000      23.20410       7.836874  ?        ?        336.6520 62.23472 0.000000       62.23472 
1 1 1 -3  21 6  o 293.0566 40.18953 17.15312       4.453488      20.34136       5.401913      10.38801       7.868816  318.5985 44.90477 230.9203 75.87007 87.67825       88.16295 
1 1 1 -3  21 7  o 388.5712 37.90318 29.87343       5.646883      29.91224       7.801483      29.83072       8.184043  385.3234 53.58472 384.0158 56.57195 1.307648       77.92117 
1 1 1 -3  21 8  o 202.0347 55.03716 8.360801       4.435470      0.5754502      5.304510      26.45584       8.086973  137.9497 58.09539 360.0857 59.93676 -222.1360      83.47150 
1 1 1 -3  21 9  o 628.5158 23.02040 77.01524       5.618975      88.24887       7.005476      56.75234       9.408672  672.3112 26.83115 534.5167 45.76647 137.7946       53.05167 
1 1 1 -3  21 10 o 1744.204 20.27448 592.7073       13.73330      591.7884       16.59059      594.7077       24.47751  1741.507 24.53062 1740.814 36.20653 0.6928711      43.73402 
1 1 1 -3  21 11 o 430.4048 33.03663 36.51778       5.479923      33.03711       6.578991      44.40419       9.903014  407.2698 42.20857 469.0118 55.44201 -61.74197      69.68056 
1 1 1 -3  21 12 f 927.8455 20.80826 167.8314       7.497897      175.8100       9.224491      152.2964       12.87175  948.8032 25.03446 879.9005 37.66831 68.90271       45.22860 
1 1 1 -3  21 13 o 570.7390 28.43720 63.74660       6.303074      63.69279       7.758692      63.85105       10.80929  568.2464 35.33294 564.6683 49.80205 3.578125       61.06276 
1 1 1 -3  21 14 o 318.5262 49.35826 20.62410       5.908132      12.14229       7.269118      37.13272       10.14128  241.5925 72.03947 424.6321 63.44204 -183.0396      95.99260 
1 1 1 -3  21 15 o 225.7298 64.50980 10.61643       5.937747      9.572210       7.402598      12.50040       9.943187  220.0339 73.63980 250.1246 85.33794 -30.09068      112.7182 
1 1 1 -3  21 16 o 268.0438 53.67852 14.89916       5.392868      26.90142       7.987053      4.842628       7.311038  360.6567 59.07050 183.9181 71.43502 176.7386       92.69459 
1 1 1 -3  21 17 o 377.3510 41.02204 28.58666       5.914768      24.89205       8.285753      32.42560       8.446040  343.7406 64.43622 396.7664 56.40162 -53.02579      85.63392 
1 1 1 -3  21 18 o 266.6318 64.45718 15.24600       6.600686      16.18956       7.913320      13.08819       11.96692  272.5807 73.20477 255.1846 93.01365 17.39610       118.3659 
1 1 1 -3  21 19 o 217.0790 76.81015 9.454813       8.091950      0.000000       0.000000      9.454813       8.091950  ?        ?        217.0790 76.81015 0.000000       76.81015 
1 1 1 -3  21 20 o 403.5629 41.08275 33.07578       6.348921      28.83194       8.931032      37.41150       9.027201  364.6411 65.47412 421.6431 56.55439 -57.00198      86.51739 
1 1 1 -3  21 21 o 264.0209 69.76647 15.73208       7.261017      16.67961       12.90478      15.29314       8.783265  266.6267 96.68025 257.3898 79.69159 9.236938       125.2909 
1 1 1 -3  21 22 o 111.8385 53.95892 -9.273970      7.028512      -13.51075      12.60113      -7.360634      8.468122  150.6852 72.58678 132.0191 62.44423 18.66608       95.75031 
1 1 1 -3  21 23 o 135.1402 58.93871 0.2807807      5.823952      -1.631896      8.092956      2.335249       8.387568  146.8907 66.40459 166.7069 71.71992 -19.81624      97.74107 
1 1 1 -3  21 24 o 436.2146 37.97702 39.41208       6.369336      35.99858       8.785880      43.19329       9.247002  400.8003 58.14261 442.4058 55.00869 -41.60550      80.04073 
1 1 1 -3  21 25 o 131.4237 57.97295 0.2604430      5.780590      4.387409       8.145845      -3.926117      8.204448  169.6028 71.73915 135.1485 63.14235 34.45432       95.56915 
1 1 1 -3  21 26 o 117.5585 54.30627 -2.464588      5.810411      -7.510536      8.123783      2.820218       8.313837  122.2228 58.72511 160.3499 70.16302 -38.12709      91.49583 
1 1 1 -3  22 1  f 497.7308 26.06812 48.44693       5.021334      64.80552       7.980465      37.72640       6.460460  574.2067 35.96906 437.0538 38.45425 137.1528       52.65456 
1 1 1 -3  22 2  o 538.5982 22.35068 56.51368       4.675022      55.93994       6.331963      57.20124       6.931612  534.2249 30.64832 539.7967 33.22699 -5.571838      45.20345 
1 1 1 -3  22 3  o 198.2809 72.80575 6.488621       7.351272      10.55142       9.214069      -0.6265340     12.19357  237.3645 82.10361 198.2804 85.88447 39.08408       118.8156 
1 1 1 -3  22 4  o 723.1279 24.18660 101.9505       6.792316      102.0214       12.17738      101.9185       8.183633  718.7827 43.83377 722.3499 29.17229 -3.567200      52.65380 
1 1 1 -3  22 5  o 370.4501 35.97476 27.14159       5.110276      27.94334       6.581205      25.92411       8.109969  373.7526 46.33474 356.0737 60.83242 17.67883       76.46889 
1 1 1 -3  22 6  o 1100.731 16.85245 235.7683       7.203976      230.2428       8.250672      253.4956       14.77820  1087.358 19.53840 1137.811 33.44442 -50.45288      38.73342 
1 1 1 -3  22 7  o 414.8255 28.37899 33.77979       4.544374      35.51032       5.327729      29.15853       8.706263  424.6578 32.55324 377.5034 61.50362 47.15439       69.58742 
1 1 1 -3  22 8  o 685.2990 20.66798 91.51335       5.500550      88.24067       6.369646      101.1116       10.90834  672.4706 24.39012 716.0029 39.38115 -43.53235      46.32227 
1 1 1 -3  22 9  o 504.2003 34.27251 50.08746       6.671001      52.40863       9.327520      47.65696       9.544668  512.5071 47.40077 487.4259 51.18689 25.08127       69.76338 
1 1 1 -3  22 10 o 1026.753 19.74443 205.4286       7.872967      206.4977       9.566998      203.1855       13.85736  1028.568 23.95051 1017.279 35.07620 11.28870       42.47313 
1 1 1 -3  22 11 o 388.1777 36.82522 29.88862       5.484978      34.78711       6.663961      19.59979       9.657937  417.8930 41.61545 303.1080 80.63738 114.7850       90.74268 
1 1 1 -3  22 12 o 1276.532 20.16924 317.6877       9.998835      316.2410       12.01375      320.9485       18.03698  1272.472 24.31099 1277.338 36.36052 -4.866333      43.73913 
1 1 1 -3  22 13 f 993.0535 18.71936 192.1904       7.219242      207.5089       10.51682      178.5400       9.927725  1030.043 26.29063 955.3201 26.75918 74.72339       37.51335 
1 1 1 -3  22 14 o 358.9938 38.16427 25.70827       5.239144      31.83937       7.667056      20.33760       7.175850  396.1753 51.01805 312.1818 61.37637 83.99353       79.81166 
1 1 1 -3  22 15 o 589.3646 26.43309 68.03890       6.050065      79.17804       8.976201      58.76577       8.189922  632.2238 36.71710 543.6281 39.05293 88.59576       53.60295 
1 1 1 -3  22 16 o 370.2102 40.25016 27.52658       5.693630      35.06766       8.288248      20.78794       7.834884  413.8627 52.76853 312.2084 66.64723 101.6543       85.00806 
1 1 1 -3  22 17 o 549.2314 34.55679 59.95131       7.333254      65.62410       9.074482      49.27341       12.44992  572.0486 41.12143 481.7678 68.46935 90.28082       79.86880 
1 1 1 -3  22 18 o 481.8935 33.58477 46.27146       6.245941      41.14395       8.702589      51.71850       8.969652  446.8576 51.06470 503.9833 46.34739 -57.12573      68.96146 
1 1 1 -3  22 19 o 165.3328 64.38089 4.201213       5.950158      12.30210       8.455834      -3.744286      8.374344  236.7387 78.69110 145.5892 66.49192 91.14952       103.0217 
1 1 1 -3  22 20 o 226.7187 63.67554 11.37250       5.837447      17.05555       8.473526      6.239168       8.053289  271.6225 76.86875 190.9337 74.74672 80.68880       107.2188 
1 1 1 -3  22 21 o 304.2966 63.13735 20.65192       7.216763      12.83361       13.02011      24.11909       8.670538  241.2708 94.86314 324.3763 70.81501 -83.10555      118.3798 
1 1 1 -3  22 22 o 242.9356 61.80148 13.44778       5.844589      23.78653       7.929687      1.151303       8.647937  322.5661 65.53613 163.0038 71.43553 159.5623       96.94338 
1 1 1 -3  22 23 o 170.7529 63.45408 5.976831       5.613873      10.64575       7.660001      0.5591887      8.251369  211.4934 74.74290 154.9918 68.77035 56.50165       101.5670 
1 1 1 -3  22 24 o 148.4473 61.12434 3.204357       5.682456      9.453115       8.001052      -3.155444      8.071830  199.6603 75.43438 136.9269 63.51829 62.73338       98.61500 
1 1 1 -3  22 25 o 277.9993 55.50377 17.84090       5.782469      17.99935       8.107051      17.67681       8.250119  260.9716 75.61638 257.3969 76.74549 3.574768       107.7391 
1 1 1 -3  23 1  o 438.7121 26.89129 37.71658       4.559515      40.89545       6.171774      33.89692       6.765275  455.4722 35.16379 412.8299 42.82029 42.64227       55.40821 
1 1 1 -3  23 2  o 158.4061 60.62025 3.525990       5.208823      -0.1111974     9.281179      5.198353       6.293405  175.2207 75.41299 180.7432 67.18121 -5.522522      100.9972 
1 1 1 -3  23 3  o 266.0671 56.76045 14.60058       5.686132      9.523070       10.19852      16.89092       6.849551  234.3123 85.79637 285.1697 63.48140 -50.85745      106.7282 
1 1 1 -3  23 4  f 156.9071 56.76986 4.129809       4.445939      10.58009       6.061425      -3.381376      6.540933  226.8020 65.28832 131.5455 59.56202 95.25647       88.37533 
1 1 1 -3  23 5  f 146.9265 62.04250 0.6375268      6.076081      0.6375268      6.076081      0.000000       0.000000  146.9265 62.04250 ?        ?        0.000000       62.04250 
1 1 1 -3  23 6  o 239.8650 47.50845 11.76664       4.269008      11.17831       5.001625      13.34528       8.193038  232.3347 56.07379 254.0840 76.64357 -21.74927      94.96582 
1 1 1 -3  23 7  o 552.8354 23.37943 59.63063       5.019469      61.54197       5.862275      54.37982       9.716521  561.1918 26.89843 521.7277 48.51121 39.46405       55.46948 
1 1 1 -3  23 8  o 523.7237 24.76946 53.55630       5.037868      52.42759       5.842864      56.82689       9.945959  516.8097 29.23149 533.2466 48.55973 -16.43695      56.67916 
1 1 1 -3  23 9  o 252.8904 50.06010 13.12818       4.742456      13.50113       5.575564      12.15241       9.018687  254.9425 57.66411 246.1344 81.24178 8.808090       99.62618 
1 1 1 -3  23 10 o 525.8592 31.20648 54.39050       6.344456      56.72839       8.107859      50.69798       10.18958  535.1155 39.28960 501.5419 53.12302 33.57361       66.07365 
1 1 1 -3  23 11 o 376.1692 42.74153 28.33139       6.133121      32.35528       8.017351      22.65459       9.522700  399.2805 53.01482 325.8424 76.55260 73.43805       93.11752 
1 1 1 -3  23 12 o 461.6347 31.46101 42.02047       5.606636      43.99882       6.605517      36.92246       10.60367  471.2381 36.37582 421.2885 67.05876 49.94965       76.28944 
1 1 1 -3  23 13 o 582.0673 29.50381 66.64494       6.647487      67.52460       8.074868      64.79520       11.70939  584.1555 35.76644 565.4899 53.97430 18.66559       64.74924 
1 1 1 -3  23 14 o 208.1700 60.51481 9.038749       5.184644      10.31608       7.332119      7.761364       7.332268  224.3584 73.21393 204.1480 73.02129 20.21040       103.4040 
1 1 1 -3  23 15 o 108.4261 50.48103 -4.339564      5.171886      -8.005606      7.562384      -1.118253      7.088861  124.3550 58.87606 146.1714 64.35217 -21.81641      87.22151 
1 1 1 -3  23 16 o 352.0942 49.75712 25.54241       6.614107      29.69579       8.300578      18.31885       10.94670  376.1512 58.74251 285.0331 89.08449 91.11807       106.7086 
1 1 1 -3  23 17 f 887.1295 21.91901 154.2911       7.551548      183.3176       11.25303      130.5103       10.18558  962.9213 30.09197 811.3630 32.32531 151.5583       44.16393 
1 1 1 -3  23 18 o 390.9497 39.22061 30.99595       5.874463      28.30958       8.349377      33.62940       8.266728  362.6668 61.47731 399.7673 54.68102 -37.10049      82.27682 
1 1 1 -3  23 19 o 184.5087 63.24091 7.024215       5.460808      -1.096285      7.684532      15.30829       7.761541  148.5223 66.10920 258.3582 73.72691 -109.8359      99.02567 
1 1 1 -3  23 20 o 346.2074 55.66446 25.92019       7.230543      46.74149       13.25492      17.09972       8.627183  446.2156 79.40003 267.8105 78.12166 178.4052       111.3883 
1 1 1 -3  23 21 o 208.4383 63.35102 9.891519       5.582156      -1.058052      7.471381      23.72684       8.398407  143.7608 64.49893 318.6167 69.80335 -174.8559      95.04010 
1 1 1 -3  23 22 o 200.4108 63.04935 9.293557       5.473197      7.464050       7.472136      11.41145       8.039508  188.3079 72.47493 217.0928 76.58812 -28.78487      105.4436 
1 1 1 -3  23 23 o 221.7419 62.38702 11.72215       5.598477      11.93985       7.928324      11.50564       7.906606  217.4828 76.10697 214.2881 75.91438 3.194672       107.4954 
1 1 1 -3  23 24 o 211.0398 62.32075 10.78751       5.460474      13.56334       7.780516      8.093267       7.665325  227.2217 75.48130 187.6542 73.07310 39.56757       105.0576 
1 1 1 -3  24 1  o 588.7234 49.09801 69.10664       11.12304      69.10664       11.12304      0.000000       0.000000  588.7234 49.09801 ?        ?        0.000000       49.09801 
1 1 1 -3  24 2  o 338.4268 45.02295 22.99706       5.770504      22.04245       10.29379      23.43452       6.968371  321.8176 82.09933 339.1358 54.77593 -17.31818      98.69500 
1 1 1 -3  24 3  f 79.99695 39.65203 -10.85137      4.646812      -11.35552      5.657905      -9.806526      8.145115  92.61787 45.49368 126.9702 60.39964 -34.35233      75.61608 
1 1 1 -3  24 4  o 180.5456 57.44899 6.423101       4.533625      12.57335       6.091075      -1.216188      6.788505  245.6051 63.42017 144.4994 63.30964 101.1056       89.61153 
1 1 1 -3  24 5  o 89.40403 43.52604 -8.503965      4.847745      2.023442       6.177600      -25.37744      7.820982  156.5053 64.00359 91.55123 46.22216 64.95406       78.94902 
1 1 1 -3  24 6  o 751.9036 23.17263 110.3222       6.766524      110.3222       6.766524      0.000000       0.000000  751.9036 23.17263 ?        ?        0.000000       23.17263 
1 1 1 -3  24 7  o 1109.691 25.72175 240.6169       11.08487      240.6169       11.08487      0.000000       0.000000  1109.691 25.72175 ?        ?        0.000000       25.72175 
1 1 1 -3  24 8  o 657.3101 22.10717 84.30237       5.643279      79.07931       6.502182      100.2476       11.36087  635.9810 26.32613 711.3840 41.30028 -75.40302      48.97732 
1 1 1 -3  24 9  o 373.1034 35.41100 27.62063       5.069446      29.36954       5.921738      22.82269       9.808289  383.6524 40.34978 326.4372 78.36202 57.21518       88.14030 
1 1 1 -3  24 10 o 585.0120 25.22370 66.92615       5.730620      68.29698       6.688788      63.14306       11.11163  590.2706 29.17886 559.8069 51.69455 30.46368       59.36103 
1 1 1 -3  24 11 o 834.5464 20.64438 135.9362       6.690837      139.1423       7.763540      126.6795       13.19171  843.6431 23.69589 797.8665 42.72898 45.77667       48.85960 
1 1 1 -3  24 12 o 511.0560 35.64045 51.81472       7.029302      45.11683       8.985533      62.37851       11.28456  471.9000 49.78169 554.1697 53.08364 -82.26974      72.77424 
1 1 1 -3  24 13 o 1007.104 22.37064 198.4210       8.749445      204.0024       10.66468      186.9299       15.30237  1019.466 26.93686 969.2449 40.65343 50.22125       48.76777 
1 1 1 -3  24 14 o 535.1110 33.31791 56.84481       6.889535      59.70639       8.497550      51.35523       11.76956  545.7067 40.38325 495.0858 62.61397 50.62088       74.50716 
1 1 1 -3  24 15 o 845.4232 24.99313 140.4246       8.205834      141.0486       9.939589      139.0890       14.54166  844.9921 30.28920 829.3047 45.32308 15.68732       54.51254 
1 1 1 -3  24 16 o 264.2720 65.77401 15.34264       6.723710      12.93221       8.330744      19.84688       11.38801  241.9700 77.96909 291.0288 90.84678 -49.05884      119.7177 
1 1 1 -3  24 17 o 205.4067 63.59775 9.118646       5.593876      10.82790       7.943819      7.437399       7.878457  223.4205 76.27683 198.6749 74.90421 24.74562       106.9055 
1 1 1 -3  24 18 o 504.6698 30.86795 50.92693       6.020745      50.79725       8.565560      51.05357       8.464576  496.1587 44.94138 497.8653 44.23989 -1.706604      63.06264 
1 1 1 -3  24 19 o 537.7954 50.81815 61.15975       10.48784      61.15975       10.48784      0.000000       0.000000  537.7954 50.81815 ?        ?        0.000000       50.81815 
1 1 1 -3  24 20 o 313.9843 48.65488 21.16136       5.740891      20.10895       8.057796      22.24628       8.181307  290.3925 71.84422 307.2517 70.11226 -16.85922      100.3859 
1 1 1 -3  24 21 o 268.0883 56.29886 16.24218       5.674907      6.314873       7.915840      26.73946       8.139912  182.2735 73.20679 339.5069 64.08601 -157.2334      97.29466 
1 1 1 -3  24 22 o 148.7159 59.99001 3.568602       5.340842      3.183099       7.673044      3.930908       7.438593  161.1855 68.94949 163.8288 68.88457 -2.643265      97.46341 
1 1 1 -3  25 1  o 777.7476 31.21506 118.5120       9.428244      0.000000       0.000000      118.5120       9.428244  ?        ?        777.7476 31.21506 0.000000       31.21506 
1 1 1 -3  25 2  o 331.2795 40.52110 21.94335       5.104516      20.42351       6.326022      24.77960       8.641798  316.1108 53.43493 344.7919 66.95221 -28.68109      85.66148 
1 1 1 -3  25 3  o 1524.787 17.92334 452.8408       10.61344      463.8368       14.94088      441.6399       15.07942  1540.977 24.96619 1503.341 25.82851 37.63599       35.92245 
1 1 1 -3  25 4  o 198.1800 58.41422 8.026806       4.801310      4.726008       6.503109      11.98213       7.118731  177.9262 67.81880 240.2037 71.21427 -62.27742      98.34055 
1 1 1 -3  25 5  o 897.3068 21.63349 157.0830       7.538682      149.8583       9.249093      171.3824       13.01211  875.2306 27.21126 933.4149 35.89592 -58.18433      45.04409 
1 1 1 -3  25 6  o 669.2850 21.89100 87.41799       5.689899      83.09936       6.582176      100.1864       11.31789  651.8735 26.00029 710.8700 41.17282 -58.99646      48.69514 
1 1 1 -3  25 7  o 630.5404 22.49227 77.63265       5.507750      77.17171       6.414446      78.92621       10.74544  628.0250 26.29991 629.3234 44.24799 -1.298340      51.47397 
1 1 1 -3  25 8  o 353.9795 42.40794 25.17494       5.713737      25.17494       5.713737      0.000000       0.000000  353.9795 42.40794 ?        ?        0.000000       42.40794 
1 1 1 -3  25 9  o 415.4963 31.94064 34.14794       5.114465      38.23530       5.926758      22.22691       10.12168  439.0003 35.05594 319.2531 81.39112 119.7472       88.61960 
1 1 1 -3  25 10 o 353.0334 38.70304 24.97619       5.219269      29.98923       6.136211      11.86106       9.925132  386.3490 41.55023 243.2460 85.15165 143.1030       94.74821 
1 1 1 -3  25 11 o 157.6930 59.75035 3.883204       5.028976      5.206143       5.792695      -0.1650777     10.13319  174.4249 64.52837 178.2805 77.74884 -3.855515      101.0386 
1 1 1 -3  25 12 o 352.4200 40.35331 25.06756       5.423362      28.88940       6.312232      14.29132       10.59937  377.3883 43.88883 258.3690 88.10901 119.0193       98.43488 
1 1 1 -3  25 13 o 234.6135 60.26711 11.82152       5.520179      12.78232       6.504566      9.348073       10.43640  242.5904 66.88390 225.5243 85.92545 17.06609       108.8882 
1 1 1 -3  25 14 o 342.7564 72.56107 26.00968       9.357723      26.00968       9.357723      0.000000       0.000000  342.7564 72.56107 ?        ?        0.000000       72.56107 
1 1 1 -3  25 15 o 158.2085 67.88836 1.054870       7.480648      1.054870       7.480648      0.000000       0.000000  158.2085 67.88836 ?        ?        0.000000       67.88836 
1 1 1 -3  25 16 o 147.7700 60.34849 2.452296       5.482736      -3.128247      7.756635      8.024569       7.750886  140.8672 64.20219 201.3334 74.61081 -60.46611      98.43117 
1 1 1 -3  25 17 f 561.0479 27.73569 62.50133       6.043199      56.81255       8.385416      68.64887       8.716969  526.4896 41.34410 580.7261 38.87600 -54.23651      56.75102 
1 1 1 -3  25 18 o 178.7563 66.16814 6.371516       6.092547      11.04859       10.00347      3.613640       7.681584  222.3453 84.26499 169.3548 70.51580 52.99049       109.8775 
1 1 1 -3  25 19 o 174.6029 64.62466 6.224649       5.811354      6.094316       8.869552      6.322687       7.692540  187.1239 76.62724 183.2785 72.64374 3.845383       105.5881 
1 1 1 -3  25 20 o 170.1739 60.52013 6.218276       5.029725      2.025159       6.582764      12.10017       7.796480  149.1291 63.82959 221.3154 75.56611 -72.18639      98.91640 
1 1 1 -3  25 21 o 161.1186 61.73637 5.159608       5.406649      1.312160       7.614066      9.072608       7.678655  151.4451 66.68327 196.5228 73.97783 -45.07767      99.59608 
1 1 1 -3  26 1  o 452.4842 29.34124 40.29759       5.128161      40.53426       6.643996      39.94880       8.065606  451.7211 38.23194 445.7856 47.31212 5.935516       60.82860 
1 1 1 -3  26 2  o 526.8573 38.98854 55.10304       7.920692      0.000000       0.000000      55.10304       7.920692  ?        ?        526.8573 38.98854 0.000000       38.98854 
1 1 1 -3  26 3  o 615.9739 23.36197 74.13880       5.588559      69.22511       7.489529      80.31169       8.394495  592.5781 32.67098 638.0103 34.00231 -45.43219      47.15453 
1 1 1 -3  26 4  o 319.3373 40.78150 20.49951       4.942065      19.65939       6.570211      21.59423       7.499987  307.8649 57.05398 321.2549 62.36381 -13.38998      84.52456 
1 1 1 -3  26 5  o 315.8990 42.78964 20.15250       5.114363      25.41506       6.966561      14.00083       7.532103  352.3305 52.51906 256.3791 72.44430 95.95145       89.47865 
1 1 1 -3  26 6  o 249.4460 50.15999 12.88924       4.690732      10.06613       5.532903      20.10369       8.844862  219.0764 62.15535 305.0001 75.15854 -85.92372      97.52996 
1 1 1 -3  26 7  o 269.9638 47.39433 14.98113       4.787629      13.87984       5.557675      18.14986       9.427221  256.9207 57.17447 288.1496 80.91618 -31.22885      99.07748 
1 1 1 -3  26 8  o 502.1527 26.93308 49.62907       5.233148      51.77507       6.068022      43.40018       10.33803  511.9201 30.66346 457.6192 59.58388 54.30090       67.01109 
1 1 1 -3  26 9  o 579.6667 24.36545 65.86761       5.485054      76.69897       6.409369      36.22743       10.60265  624.9999 26.40629 412.3487 68.62140 212.6512       73.52679 
1 1 1 -3  26 10 o 434.7774 36.81092 37.81440       6.157069      37.81440       6.157069      0.000000       0.000000  434.7774 36.81092 ?        ?        0.000000       36.81092 
1 1 1 -3  26 11 o 202.9382 60.71943 8.717324       5.157625      10.02865       5.957176      4.792121       10.30662  216.6191 65.35684 199.9524 82.32446 16.66673       105.1134 
1 1 1 -3  26 12 o 366.1613 39.24476 27.13497       5.493652      26.00746       6.360693      30.44571       10.89951  355.2024 47.28535 367.8760 78.67320 -12.67355      91.78985 
1 1 1 -3  26 13 o 178.2404 67.36336 5.572691       6.381820      5.572691       6.381820      0.000000       0.000000  178.2404 67.36336 ?        ?        0.000000       67.36336 
1 1 1 -3  26 14 o 149.6431 63.55323 1.335195       6.434492      1.335195       6.434492      0.000000       0.000000  149.6431 63.55323 ?        ?        0.000000       63.55323 
1 1 1 -3  26 15 o 159.9720 63.57564 3.780887       5.906453      -3.790131      7.078476      21.13618       10.71713  130.8470 60.26529 294.0187 87.42648 -163.1717      106.1852 
1 1 1 -3  26 16 o 227.9159 74.51316 12.01511       7.593347      12.23986       10.73832      11.79035       10.73891  232.1633 87.46621 229.5814 87.23562 2.581970       123.5330 
1 1 1 -3  26 17 o 148.0184 62.12518 2.192462       6.032764      6.670685       9.304046      -1.056057      7.924314  193.5703 78.78379 147.5451 66.29504 46.02524       102.9656 
1 1 1 -3  26 18 o 140.8367 60.42438 1.354473       5.924470      1.283143       9.369867      1.401984       7.647122  166.0373 73.49591 154.8706 67.54050 11.16664       99.81667 
1 1 1 -3  26 19 o 265.9433 51.56252 15.72552       5.133164      11.82714       6.892567      20.58039       7.691796  219.8203 70.92964 291.5028 69.01367 -71.68250      98.96413 
1 1 1 -3  26 20 o 137.5998 56.32065 2.637877       4.788672      4.030807       6.543165      1.031278       7.027113  158.9877 65.54218 145.7015 64.10997 13.28615       91.68351 
1 1 1 -3  27 1  o 856.6141 19.85375 143.2775       6.604740      135.2710       8.698654      154.1771       10.14926  830.3950 26.97363 885.6423 29.50857 -55.24731      39.97915 
1 1 1 -3  27 2  o 300.0778 69.17469 19.34252       7.896211      0.000000       0.000000      19.34252       7.896211  ?        ?        300.0778 69.17469 0.000000       69.17469 
1 1 1 -3  27 3  o 851.0526 20.13014 141.4803       6.653211      144.7300       9.107297      137.7611       9.742956  858.6313 27.31208 836.7725 29.98164 21.85889       40.55673 
1 1 1 -3  27 4  o 410.6070 32.88198 33.47775       5.199400      42.08537       7.025010      23.05088       7.731829  458.4410 39.85460 330.2279 62.57993 128.2131       74.19324 
1 1 1 -3  27 5  o 388.1835 35.55451 30.07785       5.300391      32.52298       7.263202      27.29221       7.752466  399.5953 47.74938 362.0052 57.03122 37.59012       74.38120 
1 1 1 -3  27 6  o 354.6550 35.71386 25.17407       4.852007      29.24625       5.668921      14.01986       9.382239  381.5424 38.79846 254.7915 82.80357 126.7508       91.44262 
1 1 1 -3  27 7  o 381.8521 33.49328 29.07646       4.916672      29.88541       5.724356      26.80113       9.600314  385.4828 38.76338 350.2974 72.94044 35.18549       82.60089 
1 1 1 -3  27 8  o 296.6671 43.12198 18.00682       4.822699      21.84585       5.597416      6.946015       9.501012  326.4644 45.37628 207.0432 81.15054 119.4212       92.97535 
1 1 1 -3  27 9  o 446.3610 30.13780 39.55541       5.193671      38.84542       6.020176      41.62174       10.27031  440.4627 35.49555 443.4951 61.26630 -3.032349      70.80603 
1 1 1 -3  27 10 o 577.8389 25.37846 65.73145       5.695083      68.76833       6.657816      57.44915       10.99498  589.7840 29.06771 525.0311 54.72831 64.75287       61.96870 
1 1 1 -3  27 11 o 445.9967 32.26650 39.74800       5.550973      48.91257       6.496817      14.96677       10.68332  494.2000 34.05880 256.7143 88.42973 237.4857       94.76190 
1 1 1 -3  27 12 o 185.4196 66.17056 6.841249       6.017725      6.841249       6.017725      0.000000       0.000000  185.4196 66.17056 ?        ?        0.000000       66.17056 
1 1 1 -3  27 13 o 131.3459 59.14315 -1.872114      6.346492      -1.872114      6.346492      0.000000       0.000000  131.3459 59.14315 ?        ?        0.000000       59.14315 
1 1 1 -3  27 14 o 202.8730 62.57956 9.135065       5.421926      12.99325       6.279126      -2.172875      10.74977  238.8302 65.66015 166.8874 75.87521 71.94281       100.3409 
1 1 1 -3  27 15 o 98.08132 47.29305 -7.173341      5.380157      -5.229697      6.281449      -12.52616      10.42420  115.4487 54.35290 134.3126 65.02260 -18.86385      84.74772 
1 1 1 -3  27 16 o 327.1975 47.18122 22.90187       5.821970      17.23326       6.773428      38.93488       11.39142  272.0732 64.99614 402.4813 75.65672 -130.4081      99.74185 
1 1 1 -3  27 17 o 231.3380 73.30333 13.18104       7.387161      20.09841       9.813913      4.137984       11.22094  276.0133 84.02338 186.2272 81.49837 89.78610       117.0552 
1 1 1 -3  27 18 o 136.2127 57.87182 1.673217       5.339265      -4.157697      7.414905      7.952290       7.694582  128.2578 59.95779 190.0235 73.43027 -61.76578      94.79948 
1 1 1 -3  28 1  o 143.9507 57.51885 2.466558       4.859280      -5.293057      6.200580      14.81774       7.822875  117.4184 54.87005 259.7775 73.97804 -142.3591      92.10577 
1 1 1 -3  28 2  f 262.3007 49.87221 14.36338       4.894580      9.008784       6.327414      22.34134       7.723406  208.2769 68.01530 322.8581 63.86037 -114.5812      93.29646 
1 1 1 -3  28 3  o 483.5290 28.49443 46.23117       5.327048      49.25429       7.074259      42.27188       8.095827  496.1492 36.98034 455.5417 46.41021 40.60748       59.34183 
1 1 1 -3  28 4  o 661.9841 22.95505 85.94532       5.901382      82.89957       7.986976      89.60735       8.757814  647.2142 31.77653 672.1635 33.55003 -24.94928      46.20987 
1 1 1 -3  28 5  o 583.3853 25.50478 66.93520       5.778366      63.80579       7.818747      70.70148       8.577550  565.0690 35.81451 594.1992 37.36112 -29.13025      51.75454 
1 1 1 -3  28 6  o 142.9985 56.33786 2.746878       4.600870      1.952462       5.372910      4.930755       8.908399  144.6019 59.47627 190.8696 77.30755 -46.26775      97.53914 
1 1 1 -3  28 7  o 178.6199 58.24693 6.552123       4.641056      9.162314       5.386132      -0.9732134     9.145424  206.6136 62.10220 163.5782 72.49884 43.03543       95.46080 
1 1 1 -3  28 8  o 496.1234 27.72375 48.78481       5.320209      47.95821       6.219366      51.03971       10.27217  489.8783 32.88179 493.6937 54.48447 -3.815369      63.63780 
1 1 1 -3  28 9  o 455.8220 29.58946 41.37758       5.209605      41.59500       5.995255      40.70727       10.52676  455.1477 34.16710 432.8580 64.59856 22.28970       73.07780 
1 1 1 -3  28 10 o 305.1257 43.30930 19.29353       4.987980      16.90254       5.744863      26.61645       10.05386  280.1581 54.76470 338.5310 78.06758 -58.37299      95.36100 
1 1 1 -3  28 11 o 227.3724 58.04259 11.40902       5.142724      17.88045       5.970088      -7.206096      10.12543  287.0923 55.55489 147.2895 69.23862 139.8028       88.77122 
1 1 1 -3  28 12 o 247.1806 62.72356 13.80617       6.030970      13.80617       6.030970      0.000000       0.000000  247.1806 62.72356 ?        ?        0.000000       62.72356 
1 1 1 -3  28 13 o 133.1526 59.03505 -0.5745434     6.069283      -0.5745434     6.069283      0.000000       0.000000  133.1526 59.03505 ?        ?        0.000000       59.03505 
1 1 1 -3  28 14 f 173.0002 66.62260 5.708877       6.317023      5.708877       6.317023      0.000000       0.000000  173.0002 66.62260 ?        ?        0.000000       66.62260 
1 1 1 -3  28 15 o 139.9649 59.34232 1.729945       5.594834      0.2912630      6.520840      5.743954       10.89207  140.0596 61.68846 192.2496 82.19101 -52.19002      102.7659 
1 1 1 -3  28 16 o 205.3544 70.56400 10.06782       6.800587      16.98744       8.633373      -1.245385      11.03906  256.3695 78.94813 165.0551 75.73848 91.31435       109.4035 
1 1 1 -3  29 1  o 284.3908 45.80030 16.78512       4.886618      19.51406       6.686467      13.65670       7.159167  301.2331 59.26762 247.7648 70.84428 53.46832       92.36646 
1 1 1 -3  29 2  o 242.2381 51.58682 12.47337       4.704268      13.58003       6.208520      10.98147       7.208616  248.6566 63.93569 224.5553 72.54599 24.10132       96.69898 
1 1 1 -3  29 3  o 455.4237 28.96691 41.20891       5.096628      36.29939       6.659606      48.14931       7.918099  422.4491 41.11348 486.3963 42.34056 -63.94724      59.01730 
1 1 1 -3  29 4  o 353.4397 36.12250 25.24211       4.888486      20.14637       6.523459      31.76870       7.382732  306.6103 56.87949 390.5499 49.80985 -83.93961      75.60621 
1 1 1 -3  29 5  o 306.7287 41.36681 19.33471       4.801906      19.65107       6.506271      18.95620       7.116530  301.9917 57.57816 293.1525 64.28029 8.839172       86.29716 
1 1 1 -3  29 6  o 601.3088 22.75493 71.14996       5.313749      71.40402       6.179483      70.42899       10.40973  600.9767 26.47687 584.7811 46.21380 16.19562       53.26105 
1 1 1 -3  29 7  o 306.3966 41.35035 19.36764       4.794618      15.98494       5.569804      29.04643       9.421463  272.1220 54.60323 359.2608 70.04396 -87.13873      88.81255 
1 1 1 -3  29 8  o 389.0057 33.19268 30.51817       4.966497      31.49960       5.783641      27.76238       9.691598  392.8361 38.40184 346.8515 74.19325 45.98456       83.54244 
1 1 1 -3  29 9  o 311.6213 41.82322 20.16778       4.933679      23.08810       5.787881      12.40614       9.435856  331.4775 46.21859 232.0240 82.85289 99.45349       94.87234 
1 1 1 -3  29 10 o 238.1763 55.47800 12.54755       5.036075      15.01510       5.802223      5.010911       10.14027  259.2245 58.96562 190.7226 80.32201 68.50188       99.64220 
1 1 1 -3  29 11 o 406.7220 41.09459 34.33755       6.401947      34.33755       6.401947      0.000000       0.000000  406.7220 41.09459 ?        ?        0.000000       41.09459 
1 1 1 -3  29 12 o 188.5451 61.95990 7.946602       5.247855      6.727098       6.124879      11.31381       10.17750  179.8110 66.38620 220.3578 84.63934 -40.54674      107.5683 
1 1 1 -3  29 13 o 202.4020 61.80017 9.450466       5.303306      15.70455       6.218836      -7.223953      10.15436  260.0105 62.38508 143.0035 67.85501 117.0070       92.17484 
1 1 1 -3  29 14 o 353.1759 42.46889 26.40056       5.708138      26.07933       6.647505      27.30234       11.13789  344.8524 51.18974 318.6856 87.38055 26.16687       101.2707 
1 1 1 -3  30 1  o 108.4808 51.52519 -6.201801      5.883469      -6.201801      5.883469      0.000000       0.000000  108.4808 51.52519 ?        ?        0.000000       51.52519 
1 1 1 -3  30 2  o 638.1409 22.72684 80.24002       5.632271      78.09090       7.637197      82.80258       8.339532  624.5939 31.58796 641.9728 33.56668 -17.37891      46.09253 
1 1 1 -3  30 3  f 501.1121 26.67888 49.90586       5.173251      50.81653       6.897304      48.73471       7.821752  501.2111 35.66762 487.2167 41.74145 13.99438       54.90472 
1 1 1 -3  30 4  o 166.6679 58.34013 5.587919       4.658877      10.23260       6.308634      0.1618957E-01  6.909594  213.6523 67.74561 145.4491 63.79509 68.20316       93.05526 
1 1 1 -3  30 5  o 461.8281 29.22802 42.67258       5.215093      41.74941       7.023893      43.80674       7.785238  450.7354 40.56061 459.4816 44.17346 -8.746124      59.97047 
1 1 1 -3  30 6  o 601.1451 22.98778 71.37672       5.366663      72.87211       6.253240      67.19609       10.45562  605.6856 26.58458 565.8378 48.03450 39.84778       54.90039 
1 1 1 -3  30 7  o 97.31327 45.91344 -4.306848      4.526441      -3.755158      5.321598      -5.750313      8.607909  110.0476 51.22613 136.9904 64.21819 -26.94280      82.14677 
1 1 1 -3  30 8  o 201.2880 57.93515 9.084244       4.773280      11.51506       5.619639      2.787813       9.044389  224.3799 62.28539 172.7876 74.40501 51.59233       97.03388 
1 1 1 -3  30 9  o 169.1500 59.35828 5.996627       4.824352      7.366870       5.632199      2.221268       9.348851  184.0621 64.16136 171.1923 74.66787 12.86984       98.44781 
1 1 1 -3  30 10 f 133.6016 58.32799 0.3849703      5.717058      0.3849703      5.717058      0.000000       0.000000  133.6016 58.32799 ?        ?        0.000000       58.32799 
1 1 1 -3  30 11 o 491.5389 30.06282 48.83601       5.711143      49.99062       6.664488      45.64399       11.08105  493.9511 34.96800 443.7037 66.34402 50.24738       74.99527 
1 1 1 -3  31 1  o 86.86237 42.16907 -6.871808      4.464473      -10.38833      5.969525      -2.408556      6.725257  96.11369 47.11327 131.3161 59.82296 -35.20236      76.14753 
1 1 1 -3  31 2  o 173.6332 57.91665 6.444834       4.579037      6.032968       6.229569      6.928906       6.753600  176.2041 66.56429 185.1629 69.44182 -8.958817      96.19236 
1 1 1 -3  31 3  o 96.37277 45.73460 -4.800526      4.615820      -12.61962      6.157535      5.229431       6.973939  92.84700 45.95386 174.0377 69.10854 -81.19066      82.99245 
1 1 1 -3  31 4  o 283.1965 45.96801 17.09006       4.882243      15.25838       6.464450      19.52202       7.448771  256.7840 64.81763 289.4476 67.50526 -32.66367      93.58571 
1 1 1 -3  31 5  o 244.2808 53.23240 13.19833       4.907327      15.84456       6.675735      10.08724       7.238375  260.6223 65.91323 209.2726 72.74895 51.34970       98.16804 
1 1 1 -3  31 6  o 95.86688 45.05833 -3.745899      4.285187      -4.169704      4.985839      -2.547847      8.382875  103.4736 48.62361 144.6311 66.23158 -41.15750      82.16372 
1 1 1 -3  31 7  o 303.0679 50.87592 20.02579       5.775788      13.76403       7.237632      31.00640       9.584324  238.3929 72.06460 361.9217 70.72544 -123.5288      100.9722 
1 1 1 -2  0  1  o 1003.231 21.97529 196.3678       8.552500      196.3678       8.552500      196.3678       8.552500  1003.231 21.97529 1003.231 21.97529 -0.000000      0.000000 
1 1 1 -2  0  2  o 1442.269 26.34530 406.1678       14.74520      406.1678       14.74520      406.1678       14.74520  1442.269 26.34530 1442.269 26.34530 -0.000000      0.000000 
1 1 1 -2  0  3  o 496.1852 14.53271 47.98985       2.794954      47.98985       2.794954      47.98985       2.794954  496.1852 14.53271 496.1852 14.53271 -0.000000      0.000000 
1 1 1 -2  0  4  o 73.54137 37.65216 1.548248       1.362350      1.548248       1.362350      1.548248       1.362350  73.54137 37.65216 73.54137 37.65216 -0.000000      0.000000 
1 1 1 -2  0  5  o 497.1236 15.80339 48.18470       3.044020      48.18470       3.044020      48.18470       3.044020  497.1236 15.80339 497.1236 15.80339 -0.000000      0.000000 
1 1 1 -2  0  6  o 511.7491 16.37134 51.05636       3.246096      51.05636       3.246096      51.05636       3.246096  511.7491 16.37134 511.7491 16.37134 -0.000000      0.000000 
1 1 1 -2  0  7  o 310.8988 21.92687 19.07235       2.617175      19.07235       2.617175      19.07235       2.617175  310.8988 21.92687 310.8988 21.92687 -0.000000      0.000000 
1 1 1 -2  0  8  o 844.7768 17.07195 138.8418       5.595679      138.8418       5.595679      138.8418       5.595679  844.7768 17.07195 844.7768 17.07195 -0.000000      0.000000 
1 1 1 -2  0  9  o 462.7790 19.72648 41.84886       3.530635      41.84886       3.530635      41.84886       3.530635  462.7790 19.72648 462.7790 19.72648 0.000000       0.000000 
1 1 1 -2  0  10 o 304.3743 27.62097 18.46080       3.203114      18.46080       3.203114      18.46080       3.203114  304.3743 27.62097 304.3743 27.62097 -0.000000      0.000000 
1 1 1 -2  0  11 o 1060.023 18.90735 218.5972       7.777896      218.5972       7.777896      218.5972       7.777896  1060.023 18.90735 1060.023 18.90735 -0.000000      0.000000 
1 1 1 -2  0  12 o 591.3806 21.11709 68.25906       4.835833      68.25906       4.835833      68.25906       4.835833  591.3806 21.11709 591.3806 21.11709 -0.000000      0.000000 
1 1 1 -2  0  13 o 403.2668 27.45642 32.09779       4.254200      32.09779       4.254200      32.09779       4.254200  403.2668 27.45642 403.2668 27.45642 -0.000000      0.000000 
1 1 1 -2  0  14 o 853.6479 28.48482 142.4785       9.419397      142.4785       9.419397      142.4785       9.419397  853.6479 28.48482 853.6479 28.48482 -0.000000      0.000000 
1 1 1 -2  0  15 o 72.44743 48.95961 -1.859201      4.035000      -1.859201      4.035000      -1.859201      4.035000  72.44743 48.95961 72.44743 48.95961 -0.000000      0.000000 
1 1 1 -2  0  16 o 567.2701 25.10197 63.10292       5.505363      63.10292       5.505363      63.10292       5.505363  567.2701 25.10197 567.2701 25.10197 -0.000000      0.000000 
1 1 1 -2  0  17 o 81.07256 53.78252 -1.078347      4.482175      -1.078347      4.482175      -1.078347      4.482175  81.07256 53.78252 81.07256 53.78252 -0.000000      0.000000 
1 1 1 -2  0  18 o 602.4763 38.57186 72.00585       8.939998      72.00585       8.939998      72.00585       8.939998  602.4763 38.57186 602.4763 38.57186 0.000000       0.000000 
1 1 1 -2  0  19 o 1205.857 22.55490 283.4619       10.55412      283.4619       10.55412      283.4619       10.55412  1205.857 22.55490 1205.857 22.55490 0.000000       0.000000 
1 1 1 -2  0  20 f 132.0576 72.53449 4.867806       5.361181      4.867806       5.361181      4.867806       5.361181  132.0576 72.53449 132.0576 72.53449 0.000000       0.000000 
1 1 1 -2  0  21 o 393.8990 40.53161 31.27573       6.049819      31.27573       6.049819      31.27573       6.049819  393.8990 40.53161 393.8990 40.53161 0.000000       0.000000 
1 1 1 -2  0  22 o 572.2698 32.10740 64.43825       7.084291      64.43825       7.084291      64.43825       7.084291  572.2698 32.10740 572.2698 32.10740 0.000000       0.000000 
1 1 1 -2  0  23 o 538.2000 34.86344 57.20173       7.216754      57.20173       7.216754      57.20173       7.216754  538.2000 34.86344 538.2000 34.86344 0.000000       0.000000 
1 1 1 -2  0  24 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  0  25 o 1183.898 25.85435 273.4515       11.87430      273.4515       11.87430      273.4515       11.87430  1183.898 25.85435 1183.898 25.85435 0.000000       0.000000 
1 1 1 -2  0  26 o 393.1172 54.03507 32.11521       7.806226      32.11521       7.806226      32.11521       7.806226  393.1172 54.03507 393.1172 54.03507 -0.000000      0.000000 
1 1 1 -2  0  27 o 134.6487 81.82698 3.662809       7.983725      3.662809       7.983725      3.662809       7.983725  134.6487 81.82698 134.6487 81.82698 -0.000000      0.000000 
1 1 1 -2  0  28 o 146.7640 86.06203 5.481445       8.251449      5.481445       8.251449      5.481445       8.251449  146.7640 86.06203 146.7640 86.06203 -0.000000      0.000000 
1 1 1 -2  0  29 o 543.2399 44.35364 59.47880       9.213758      59.47880       9.213758      59.47880       9.213758  543.2399 44.35364 543.2399 44.35364 0.000000       0.000000 
1 1 1 -2  0  30 o 158.0288 99.00405 5.023067       12.56642      5.023067       12.56642      5.023067       12.56642  158.0288 99.00405 158.0288 99.00405 0.000000       0.000000 
1 1 1 -2  0  31 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  0  32 f 124.7489 80.35809 2.015743       8.982760      2.015743       8.982760      2.015743       8.982760  124.7489 80.35809 124.7489 80.35809 -0.000000      0.000000 
1 1 1 -2  0  33 o 167.0825 104.2996 9.476143       13.82231      9.476143       13.82231      9.476143       13.82231  167.0825 104.2996 167.0825 104.2996 -0.000000      0.000000 
1 1 1 -2  0  34 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  1  1  f 229.5954 12.17041 10.28520       1.081292      14.14717       1.947466      8.564024       1.300104  268.6267 18.78605 209.0215 16.14124 59.60519       24.76803 
1 1 1 -2  1  2  o 969.8727 12.70649 183.0409       4.785950      184.8101       8.333370      182.1702       5.846243  972.4753 22.06552 967.0502 15.56682 5.425049       27.00394 
1 1 1 -2  1  3  o 279.2519 11.41057 15.16596       1.237461      12.10325       1.713151      18.50739       1.789407  248.5500 17.86740 308.3123 14.94480 -59.76231      23.29358 
1 1 1 -2  1  4  o 596.9866 10.61178 69.28424       2.460258      70.10677       3.507811      68.48789       3.451533  600.1658 15.05002 593.2021 14.98240 6.963684       21.23618 
1 1 1 -2  1  5  o 181.1204 17.80339 6.448489       1.236088      6.286828       1.694397      6.632400       1.807240  177.6992 25.26427 182.4341 26.26542 -4.734909      36.44387 
1 1 1 -2  1  6  f 681.7135 11.21232 90.32061       2.968421      92.03282       4.225991      88.65305       4.170520  687.8430 15.82018 675.0882 15.90749 12.75476       22.43494 
1 1 1 -2  1  7  o 218.7651 19.09439 9.382965       1.605968      9.662083       2.268860      9.102702       2.273511  220.9824 26.99909 214.2394 27.99507 6.742966       38.89312 
1 1 1 -2  1  8  o 391.3736 14.20178 29.77257       2.158551      31.76252       3.109736      27.92231       2.998600  404.0497 19.81804 378.2610 20.48904 25.78876       28.50536 
1 1 1 -2  1  9  o 1521.461 14.45223 449.9346       8.539328      443.5924       11.86221      456.7567       12.30269  1509.984 20.22857 1532.160 20.67608 -22.17542      28.92569 
1 1 1 -2  1  10 o 585.6857 13.68125 66.66873       3.111849      66.80578       4.407012      66.53246       4.394652  586.0203 19.36438 584.8211 19.34967 1.199158       27.37497 
1 1 1 -2  1  11 o 1009.543 13.20669 198.0877       5.177821      201.8304       7.373302      194.4463       7.272821  1018.560 18.64007 999.7441 18.73208 18.81549       26.42619 
1 1 1 -2  1  12 o 502.9502 16.03699 49.19721       3.132390      50.41843       4.454338      48.00246       4.405799  508.7588 22.54463 496.3982 22.85423 12.36066       32.10259 
1 1 1 -2  1  13 o 618.3674 17.44875 74.41621       4.190240      74.95309       5.141974      73.35486       7.229671  620.2482 21.34698 612.5448 30.39154 7.703430       37.13945 
1 1 1 -2  1  14 o 606.1063 22.09164 71.65397       5.200017      69.37122       7.345238      73.94756       7.362662  594.0913 31.95388 613.6424 30.99557 -19.55109      44.51715 
1 1 1 -2  1  15 o 719.3256 17.95754 100.8425       5.016494      104.1686       8.762934      99.22119       6.118217  728.4594 30.97535 712.8475 22.10040 15.61194       38.05128 
1 1 1 -2  1  16 o 307.3864 27.40032 18.67094       3.236611      14.01281       4.536168      23.50177       4.619487  261.3659 46.38920 343.4108 35.13259 -82.04486      58.19155 
1 1 1 -2  1  17 o 103.4957 46.01373 -1.211958      3.712020      9.113929       6.606245      -5.976368      4.487408  212.0293 69.51028 92.22545 44.13472 119.8038       82.33804 
1 1 1 -2  1  18 o 429.4211 33.42777 36.53378       5.530739      37.65545       7.827378      35.41540       7.815927  431.7494 47.46643 418.0143 49.08003 13.73508       68.27819 
1 1 1 -2  1  19 o 309.5521 36.69507 19.14194       4.325443      19.97388       5.263378      17.41127       7.591476  314.3565 44.34541 286.3906 69.05909 27.96594       82.07115 
1 1 1 -2  1  20 o 646.1288 19.70399 81.36976       4.944261      83.29657       7.115098      79.57051       6.875536  652.4781 28.07934 637.7723 27.75958 14.70581       39.48473 
1 1 1 -2  1  21 o 1311.642 16.57172 334.8392       8.441328      329.3328       11.74142      340.7301       12.14446  1299.350 23.26840 1321.539 23.66302 -22.18921      33.18669 
1 1 1 -2  1  22 o 1958.151 18.56291 746.4745       14.11628      757.2800       20.24632      736.2525       19.69208  1969.644 26.46856 1942.244 26.10718 27.40015       37.17754 
1 1 1 -2  1  23 o 1243.500 17.30954 300.9128       8.359095      294.1763       11.60250      308.1833       12.05348  1228.193 24.32525 1257.010 24.69140 -28.81738      34.66097 
1 1 1 -2  1  24 o 651.2162 22.73209 82.68893       5.749003      91.18146       8.232463      74.60518       8.031885  682.6194 31.05440 616.1497 33.69395 66.46979       45.82203 
1 1 1 -2  1  25 o 484.1212 29.41822 46.04979       5.504719      46.34088       7.567574      45.72270       8.021981  483.0860 40.71662 479.0641 43.59515 4.021851       59.65216 
1 1 1 -2  1  26 o 319.7600 44.52304 20.64257       5.378859      16.45867       7.549792      24.95541       7.665231  278.5793 69.89910 347.7434 58.85952 -69.16409      91.38013 
1 1 1 -2  1  27 o 289.3039 52.60285 17.25783       5.692347      5.943441       7.942916      29.20481       8.161939  195.6631 74.86274 376.6320 57.63516 -180.9689      94.47879 
1 1 1 -2  1  28 o 636.0285 27.56137 79.37630       6.807778      80.93314       9.580729      77.78858       9.675270  637.8624 38.86152 624.8288 40.08403 13.03357       55.82962 
1 1 1 -2  1  29 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  1  30 o 495.5748 41.44339 49.81061       7.902919      57.17562       9.834148      36.38194       13.27904  527.0969 48.58870 393.9068 88.91344 133.1901       101.3235 
1 1 1 -2  1  31 o 102.1466 50.34167 -13.68753      7.119965      -27.49833      12.48703      -7.034403      8.666884  126.2820 62.98697 135.3213 63.75013 -9.039291      89.61828 
1 1 1 -2  1  32 o 106.6445 52.22773 -11.99628      7.286119      -25.92237      12.71101      -5.181318      8.891952  128.0267 63.80805 140.8521 65.78279 -12.82549      91.64520 
1 1 1 -2  1  33 o 303.1088 65.59456 21.78716       7.497228      18.88235       12.14820      23.57411       9.528180  257.1614 93.71837 301.8593 79.99343 -44.69785      123.2156 
1 1 1 -2  1  34 o 318.0822 76.74820 26.63901       9.371672      26.35358       13.08265      26.93984       13.43131  284.7978 97.87132 285.9886 99.11619 -1.190857      139.2940 
1 1 1 -2  2  1  o 586.3163 13.86226 66.91277       3.156415      0.000000       0.000000      66.91277       3.156415  ?        ?        586.3163 13.86226 0.000000       13.86226 
1 1 1 -2  2  2  o 204.9119 12.40096 8.198268       0.9822008     8.468594       1.387366      7.926633       1.390723  207.7405 17.35554 200.8501 18.02130 6.890396       25.01963 
1 1 1 -2  2  3  o 375.1087 10.74917 27.35741       1.565886      23.48591       2.179672      31.48662       2.251046  347.2714 16.16196 402.2152 14.41112 -54.94379      21.65386 
1 1 1 -2  2  4  o 354.9336 16.48420 24.52630       2.272181      24.52630       2.272181      0.000000       0.000000  354.9336 16.48420 ?        ?        0.000000       16.48420 
1 1 1 -2  2  5  o 1008.758 11.67979 197.8139       4.575621      200.4426       6.528124      195.2753       6.415166  1014.867 16.56347 1001.710 16.49065 13.15686       23.37285 
1 1 1 -2  2  6  o 489.4667 11.78007 46.56296       2.239231      47.35689       3.196921      45.79831       3.137419  493.3957 16.68432 485.2104 16.65001 8.185242       23.57094 
1 1 1 -2  2  7  o 525.5015 17.58956 53.71370       3.589690      0.000000       0.000000      53.71370       3.589690  ?        ?        525.5015 17.58956 0.000000       17.58956 
1 1 1 -2  2  8  o 491.5108 13.16868 46.94970       2.513642      44.50332       3.479635      49.61959       3.635112  478.3263 18.73188 505.0828 18.53221 -26.75644      26.35007 
1 1 1 -2  2  9  o 478.7900 14.10738 44.55500       2.623128      46.12476       3.741638      43.03778       3.678493  486.9300 19.78642 470.3380 20.13872 16.59201       28.23244 
1 1 1 -2  2  10 o 326.2221 19.02926 20.77150       2.400348      22.01274       3.431638      19.58244       3.358746  335.0710 26.59009 315.7761 27.66765 19.29495       38.37358 
1 1 1 -2  2  11 o 583.7295 14.38392 66.23944       3.260746      65.26257       4.622386      67.20708       4.600475  579.0652 20.55468 587.6547 20.15823 -8.589478      28.78974 
1 1 1 -2  2  12 o 551.3701 15.36744 59.12016       3.290581      62.59650       4.750066      55.91257       4.562753  566.9370 21.57431 535.7884 21.92833 31.14856       30.76203 
1 1 1 -2  2  13 o 838.7589 16.14303 136.8772       5.258359      140.9116       6.556521      129.6040       8.803281  850.6005 19.84814 814.5857 27.82786 36.01483       34.18097 
1 1 1 -2  2  14 o 495.7083 20.86783 47.91158       4.017273      45.20984       6.999239      49.23885       4.905788  477.8042 38.03506 501.4218 25.27415 -23.61752      45.66671 
1 1 1 -2  2  15 f 517.9236 20.53261 52.34246       4.129883      56.22848       7.307576      50.51883       5.005994  533.0966 35.50013 508.1691 25.36612 24.92755       43.63141 
1 1 1 -2  2  16 o 843.2068 15.38729 138.4943       5.038765      138.8572       7.084904      138.1228       7.167594  843.0176 21.64060 840.7098 21.95327 2.307800       30.82632 
1 1 1 -2  2  17 o 348.5443 29.88204 24.04547       4.005682      26.47978       6.920710      22.81914       4.912102  359.7850 50.95591 337.4482 38.15300 22.33676       63.65654 
1 1 1 -2  2  18 o 288.3778 38.71454 16.73327       4.226249      16.88904       5.249763      16.44641       7.124184  286.9223 48.86499 277.9681 66.82052 8.954163       82.78146 
1 1 1 -2  2  19 o 512.1321 25.41961 51.29731       5.055673      54.66494       6.205151      44.64747       8.719585  527.0027 30.44848 471.1103 48.34417 55.89246       57.13378 
1 1 1 -2  2  20 o 975.5034 16.50944 185.2595       6.254449      183.8442       8.829614      186.6848       8.860721  970.4986 23.42711 977.9888 23.32959 -7.490173      33.06206 
1 1 1 -2  2  21 o 135.9203 53.55721 2.155884       4.158486      -1.148656      5.815080      5.614603       5.949189  133.5994 58.56298 181.3444 65.66074 -47.74493      87.98270 
1 1 1 -2  2  22 o 1154.354 16.98533 259.3042       7.614495      258.7319       10.80812      259.8681       10.72935  1151.816 24.16236 1154.389 23.93279 -2.573364      34.00880 
1 1 1 -2  2  23 o 272.6059 45.22875 15.01823       4.620425      20.17479       6.598049      10.05635       6.472301  314.3023 56.11420 223.0948 68.29952 91.20749       88.39473 
1 1 1 -2  2  24 o 915.9330 19.21064 163.3893       6.833349      152.7394       9.340992      175.6501       10.02260  884.2545 27.20118 948.2535 27.21623 -63.99902      38.47892 
1 1 1 -2  2  25 o 753.1101 21.74569 110.6339       6.360036      116.9194       9.107116      104.6500       8.885862  772.5490 30.35476 730.6842 31.31424 41.86475       43.61185 
1 1 1 -2  2  26 o 227.6269 60.84811 10.83145       5.482457      4.408913       7.708706      17.40499       7.798809  184.5650 72.85723 286.2834 70.59133 -101.7183      101.4461 
1 1 1 -2  2  27 o 722.9471 34.32965 102.9217       9.638376      0.000000       0.000000      102.9217       9.638376  ?        ?        722.9471 34.32965 0.000000       34.32965 
1 1 1 -2  2  28 o 539.1897 30.99031 57.39113       6.461975      63.78833       9.263170      51.32681       9.018949  564.5657 42.56207 504.5948 46.54885 59.97092       63.07397 
1 1 1 -2  2  29 o 404.8494 47.93459 33.51509       7.390181      34.84821       9.078984      30.89732       12.72234  407.8539 59.03701 367.1013 89.94486 40.75253       107.5892 
1 1 1 -2  2  30 o 161.2393 68.56596 1.553690       7.507088      -8.629863      9.122120      22.92295       13.21420  136.5270 64.64593 307.0857 98.11874 -170.5587      117.5006 
1 1 1 -2  2  31 o 181.0881 71.31219 5.497178       7.368594      11.47224       12.76999      2.514703       9.022102  235.5844 93.52645 175.0398 74.81779 60.54460       119.7702 
1 1 1 -2  2  32 o 341.9185 72.70855 27.60179       9.357541      0.000000       0.000000      27.60179       9.357541  ?        ?        341.9185 72.70855 0.000000       72.70855 
1 1 1 -2  2  33 o 227.9962 74.83059 13.06461       7.655419      4.082539       12.90551      17.94107       9.509100  190.9472 85.28222 259.0385 83.28342 -68.09126      119.2023 
1 1 1 -2  2  34 o 308.4953 60.96762 22.66088       7.045289      17.59450       9.872276      27.91904       10.05739  246.6965 85.00523 320.5110 80.81768 -73.81444      117.2919 
1 1 1 -2  3  1  o 1056.893 11.38283 217.2191       4.672068      217.7938       6.610191      216.6454       6.604415  1057.514 16.09533 1054.717 16.12391 2.797119       22.78246 
1 1 1 -2  3  2  o 201.6797 12.82955 7.943756       0.9996278     7.635942       1.382877      8.280616       1.446653  197.1200 18.27221 205.3317 18.33467 -8.211700      25.88501 
1 1 1 -2  3  3  o 242.0534 12.86855 11.42730       1.205330      11.18761       1.701625      11.66867       1.707580  238.9259 18.48263 244.0792 18.14422 -5.153305      25.90020 
1 1 1 -2  3  4  o 446.4607 11.11412 38.74490       1.927021      39.03460       2.720765      38.45331       2.729696  447.8992 15.64166 444.5418 15.81152 3.357391       22.24108 
1 1 1 -2  3  5  o 765.7167 11.16623 113.9525       3.320493      117.2964       4.757923      110.7775       4.636215  776.5237 15.77737 754.6332 15.81975 21.89050       22.34256 
1 1 1 -2  3  6  o 719.3673 11.51530 100.5632       3.217022      98.56149       4.541784      102.5787       4.557370  711.8838 16.42818 726.2653 16.15813 -14.38147      23.04279 
1 1 1 -2  3  7  o 646.2736 12.07180 81.16306       3.029816      83.62125       4.328922      78.80259       4.242013  655.7444 16.99876 636.5615 17.15946 19.18292       24.15378 
1 1 1 -2  3  8  o 1904.652 16.24290 705.3057       12.01455      703.5870       16.94386      707.0436       17.03881  1901.137 22.94938 1905.786 23.02169 -4.649048      32.50649 
1 1 1 -2  3  9  o 1392.714 13.97786 376.9840       7.560153      378.5909       10.70550      375.3855       10.67789  1395.036 19.76031 1389.113 19.79338 5.922363       27.96869 
1 1 1 -2  3  10 o 1434.427 14.31246 399.9471       7.972980      408.9202       11.53511      391.7388       11.03266  1449.645 20.48953 1418.931 20.02123 30.71362       28.64735 
1 1 1 -2  3  11 o 997.2870 13.34583 193.3206       5.168846      194.9785       7.387464      191.7307       7.234636  1001.034 19.00285 992.6865 18.76621 8.347046       26.70729 
1 1 1 -2  3  12 o 1074.709 13.83200 224.5581       5.773034      221.2811       8.030545      228.0628       8.304974  1066.189 19.39470 1082.353 19.75793 -16.16406      27.68628 
1 1 1 -2  3  13 f 522.8539 19.19579 53.23891       3.897753      50.92175       4.782507      57.82276       6.726550  510.9188 24.10326 542.5562 32.06662 -31.63733      40.11527 
1 1 1 -2  3  14 f 588.3392 16.44071 67.39433       3.756439      65.54391       5.309626      69.24863       5.315192  579.3806 23.59783 595.6148 22.97870 -16.23425      32.93749 
1 1 1 -2  3  15 o 339.5460 27.91929 22.74474       3.648938      19.89267       6.197671      24.25789       4.514290  310.8780 53.25012 349.5250 33.67365 -38.64694      63.00389 
1 1 1 -2  3  16 o 549.5412 20.77170 58.98085       4.433027      53.75687       7.407963      61.89516       5.533073  520.1801 36.91016 562.1625 25.34408 -41.98242      44.77369 
1 1 1 -2  3  17 o 206.1717 49.81515 8.858337       3.944051      3.801889       6.949521      11.26075       4.790226  173.4960 68.95778 231.8473 54.17698 -58.35124      87.69447 
1 1 1 -2  3  18 o 215.0112 44.31606 9.516433       3.577379      10.19501       5.009371      8.810178       5.110501  220.5425 57.79058 206.0545 60.13254 14.48808       83.40068 
1 1 1 -2  3  19 o 917.6884 18.88838 164.1623       6.731595      160.9500       8.202719      170.7877       11.78036  907.7563 23.26808 932.4805 32.53050 -24.72424      39.99546 
1 1 1 -2  3  20 o 1114.909 16.29587 241.9624       7.055778      234.9993       9.805552      249.4390       10.16067  1097.408 23.00785 1130.589 23.14142 -33.18066      32.63260 
1 1 1 -2  3  21 o 179.9103 54.13362 6.504757       4.090976      6.216324       5.766425      6.797041       5.804792  185.3441 64.90374 190.6888 65.20307 -5.344757      91.99965 
1 1 1 -2  3  22 o 516.3633 23.96255 51.99242       4.805254      45.47942       6.628407      59.20689       6.976238  480.4079 35.78461 549.0491 32.86877 -68.64120      48.58904 
1 1 1 -2  3  23 o 585.1843 23.42831 66.76291       5.324290      77.56378       7.758264      57.14736       7.320186  628.8812 31.87051 538.9338 35.16784 89.94739       47.46058 
1 1 1 -2  3  24 o 302.5262 43.58244 18.40190       4.972631      13.48183       6.963944      23.52018       7.102836  254.2507 68.83831 339.5885 55.79650 -85.33774      88.61130 
1 1 1 -2  3  25 o 522.3447 28.08574 53.53902       5.676405      54.48945       7.894070      52.52142       8.168247  524.4567 39.03776 514.2501 41.24742 10.20660       56.79169 
1 1 1 -2  3  26 o 359.4239 41.02544 25.86102       5.623884      30.13545       7.859684      21.37652       8.050494  384.3939 54.15102 318.5738 67.18541 65.82007       86.29144 
1 1 1 -2  3  27 o 304.5140 51.01976 19.02585       5.820127      18.87739       8.242270      19.17350       8.219581  296.9965 72.16981 299.4772 71.63660 -2.480774      101.6872 
1 1 1 -2  3  28 o 472.9926 34.96532 44.42582       6.377212      53.22094       8.996853      35.54460       9.040786  514.1590 45.52806 414.7413 57.69329 99.41769       73.49368 
1 1 1 -2  3  29 o 697.3597 37.97914 97.15755       10.24684      90.43026       14.10609      104.6732       14.90974  662.3939 55.34250 713.7537 54.19367 -51.35980      77.45803 
1 1 1 -2  3  30 o 236.8472 66.33219 12.38314       6.344057      0.8903382      8.668714      25.63693       9.309190  167.3121 72.44267 338.1851 73.01868 -170.8730      102.8575 
1 1 1 -2  3  31 o 280.1521 70.75622 18.04184       7.700177      22.92820       13.33119      15.59540       9.432844  298.0201 98.79346 256.0299 83.01521 41.99020       129.0414 
1 1 1 -2  3  32 o 214.3318 81.03081 10.33146       9.236125      0.000000       0.000000      10.33146       9.236125  ?        ?        214.3318 81.03081 0.000000       81.03081 
1 1 1 -2  3  33 o 149.3832 66.02807 0.8484796      7.535715      11.92206       13.52531      -4.136467      9.074720  221.1341 92.92786 142.0158 66.36964 79.11833       114.1951 
1 1 1 -2  3  34 o 151.9275 67.03149 1.833372       7.732192      -1.347342      9.810125      7.050258       12.56371  152.3991 70.45820 192.6113 85.18951 -40.21217      110.5514 
1 1 1 -2  4  1  o 733.7437 11.97225 104.6794       3.411522      103.0603       4.163540      107.9873       5.951190  727.8002 14.73067 744.2848 20.58907 -16.48462      25.31605 
1 1 1 -2  4  2  o 70.58894 28.71183 0.3763577      1.234735      0.3763577      1.234735      0.000000       0.000000  70.58894 28.71183 ?        ?        0.000000       28.71183 
1 1 1 -2  4  3  o 1055.522 11.62939 216.5766       4.767076      213.2148       6.639767      220.1530       6.848401  1046.736 16.33382 1063.595 16.58001 -16.85950      23.27424 
1 1 1 -2  4  4  o 310.8846 12.85372 18.78936       1.551873      17.78444       2.179229      19.82330       2.210462  301.6822 18.69259 318.6426 17.93582 -16.96042      25.90572 
1 1 1 -2  4  5  o 391.8578 12.45531 29.84472       1.895444      29.37267       2.651494      30.33805       2.710608  388.5639 17.57115 394.8932 17.67499 -6.329254      24.92289 
1 1 1 -2  4  6  o 792.1204 11.64166 121.9254       3.581244      119.5777       5.014903      124.3686       5.115896  784.1736 16.46730 799.7282 16.47219 -15.55463      23.29173 
1 1 1 -2  4  7  o 491.7073 12.95030 46.98565       2.472944      44.60299       3.458086      49.47945       3.537821  478.8708 18.59471 504.3934 18.06086 -25.52261      25.92215 
1 1 1 -2  4  8  o 781.5543 12.42105 118.6944       3.770036      118.0820       5.338946      119.3034       5.324356  779.2493 17.64214 783.2780 17.50343 -4.028748      24.85186 
1 1 1 -2  4  9  o 867.1341 12.66185 146.1183       4.263944      144.5397       5.966533      147.7659       6.095799  862.1124 17.82092 871.6668 18.00745 -9.554443      25.33483 
1 1 1 -2  4  10 o 1063.963 13.28074 220.0154       5.487527      220.0064       7.744951      220.0244       7.776215  1063.452 18.75309 1063.487 18.82816 -0.3552246E-01 26.57401 
1 1 1 -2  4  11 o 231.6800 27.13270 10.60963       2.395002      10.49860       3.383110      10.72117       3.390992  228.2664 39.59904 230.7971 39.23730 -2.530716      55.74630 
1 1 1 -2  4  12 o 766.9949 16.00590 114.4352       4.767609      110.9152       5.783024      121.9035       8.423537  754.7563 19.72969 790.2582 27.44717 -35.50183      33.80248 
1 1 1 -2  4  13 o 187.6293 39.46078 7.179968       2.784208      7.875196       3.928878      6.478628       3.946108  195.6580 51.13652 179.0798 53.00498 16.57819       73.65102 
1 1 1 -2  4  14 o 757.7860 15.00538 111.7684       4.415925      114.7757       6.344751      108.9431       6.149926  766.9929 21.30077 747.2687 21.19167 19.72418       30.04679 
1 1 1 -2  4  15 o 566.6163 19.89873 62.64901       4.378671      64.55663       7.733272      61.74885       5.312247  571.2184 35.02960 561.8457 24.34631 9.372681       42.65930 
1 1 1 -2  4  16 o 205.6383 47.81875 8.788324       3.746591      0.2185472      7.232437      11.93151       4.380109  154.9687 66.63238 240.0446 48.65164 -85.07585      82.50367 
1 1 1 -2  4  17 f 334.5105 27.52288 22.09145       3.543736      16.89944       4.961920      27.49672       5.062800  287.7064 45.95562 371.5774 35.51697 -83.87100      58.08075 
1 1 1 -2  4  18 o 304.8231 30.60079 18.42452       3.573604      11.54527       5.012420      25.53595       5.096304  234.9324 55.77232 357.8008 37.22116 -122.8683      67.05196 
1 1 1 -2  4  19 o 94.73159 44.64414 -4.567814      4.257323      -1.131772      5.187098      -11.65997      7.452198  125.3387 55.11702 113.6098 54.99463 11.72887       77.86074 
1 1 1 -2  4  20 o 214.8443 54.80538 9.551826       4.587369      3.424211       5.684288      20.99652       7.768414  161.5893 62.92528 317.4905 65.18781 -155.9012      90.60377 
1 1 1 -2  4  21 o 1608.516 17.26503 503.5893       10.78501      496.5770       14.98678      511.1217       15.53248  1595.463 24.18764 1618.496 24.71162 -23.03284      34.57899 
1 1 1 -2  4  22 o 818.7513 18.61222 130.4959       5.918043      131.4174       8.431967      129.6012       8.308160  820.5831 26.45930 814.9255 26.25179 5.657593       37.27266 
1 1 1 -2  4  23 o 310.3412 40.99008 19.25010       4.819325      26.93443       6.707379      11.04926       6.929139  366.2742 48.33469 233.0051 70.52912 133.2691       85.50204 
1 1 1 -2  4  24 o 388.7561 34.77604 29.87698       5.194862      25.04502       7.072477      35.53827       7.655387  351.1686 53.55434 421.2342 47.63375 -70.06555      71.67316 
1 1 1 -2  4  25 o 562.6520 26.77551 61.91157       5.850669      61.89713       8.108405      61.92725       8.450377  559.4700 37.53657 559.1636 39.16150 0.3064575      54.24589 
1 1 1 -2  4  26 o 611.7323 26.55192 73.23533       6.307907      73.54156       8.718887      72.89899       9.137268  609.7094 36.99720 606.4072 39.00626 3.302185       53.76134 
1 1 1 -2  4  27 o 316.1373 50.31807 20.45599       5.970654      10.88762       8.287567      30.78137       8.609171  232.3610 77.91658 385.9807 59.33335 -153.6196      97.93590 
1 1 1 -2  4  28 o 543.9084 44.64956 59.48489       9.348077      54.43657       12.40611      66.11629       14.21888  511.1436 63.89351 562.4899 66.36950 -51.34625      92.12650 
1 1 1 -2  4  29 o 528.1772 38.57046 55.94544       7.856863      52.00906       9.346772      65.42558       14.50510  504.6541 48.28060 553.2500 69.01114 -48.59595      84.22324 
1 1 1 -2  4  30 o 269.8229 63.21134 16.00179       6.507679      28.65516       9.003402      2.159106       9.417021  361.4741 66.58949 178.5021 76.37132 182.9720       101.3249 
1 1 1 -2  4  31 o 182.2981 68.37453 6.365960       6.547925      7.508039       9.147545      5.165854       9.377048  201.4763 79.41902 189.6837 78.35530 11.79262       111.5658 
1 1 1 -2  4  32 o 195.1966 79.89143 6.901319       9.635030      0.000000       0.000000      6.901319       9.635030  ?        ?        195.1966 79.89143 0.000000       79.89143 
1 1 1 -2  4  33 o 314.6186 66.66317 23.75728       7.891963      30.49974       10.00848      12.67313       12.83247  347.5991 76.23928 222.5394 91.76964 125.0597       119.3067 
1 1 1 -2  4  34 o 135.2782 60.75038 -0.6146958E-01 6.644722      7.093513       9.789467      -6.174105      9.048341  185.0740 78.48370 132.6259 63.24795 52.44812       100.7968 
1 1 1 -2  5  1  o 876.6904 11.32122 149.3848       3.854494      147.3558       5.390547      151.5075       5.513693  870.3064 15.94897 882.4667 16.08853 -12.16034      22.65415 
1 1 1 -2  5  2  o 576.7891 10.65831 64.65229       2.387444      65.50583       3.382250      63.80467       3.370493  580.3531 15.00671 572.7588 15.15283 7.594360       21.32626 
1 1 1 -2  5  3  o 349.5155 16.73768 23.76444       2.271902      23.76444       2.271902      0.000000       0.000000  349.5155 16.73768 ?        ?        0.000000       16.73768 
1 1 1 -2  5  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  5  5  o 153.3277 25.19372 4.699656       1.448052      3.052466       2.073581      6.267564       2.023063  125.1319 38.71726 176.7307 30.58322 -51.59879      49.33923 
1 1 1 -2  5  6  o 879.9830 11.92729 150.4685       4.076094      157.7160       5.919865      143.9349       5.620699  900.6124 16.92567 860.3732 16.82192 40.23926       23.86326 
1 1 1 -2  5  7  o 819.0112 12.13056 130.3396       3.858322      131.0695       5.458249      129.6107       5.454736  821.0214 17.11871 816.4337 17.20382 4.587646       24.26976 
1 1 1 -2  5  8  o 1539.539 14.54607 460.6923       8.696902      463.2975       12.36737      458.1438       12.23230  1543.110 20.63728 1534.520 20.52614 8.590210       29.10704 
1 1 1 -2  5  9  f 535.2974 14.12133 55.69549       2.935612      55.26341       4.086273      56.15635       4.220127  532.9642 19.74246 537.2268 20.22739 -4.262634      28.26504 
1 1 1 -2  5  10 o 718.0225 13.57224 100.2119       3.784579      95.80945       5.326950      104.6988       5.377818  701.6873 19.54821 733.5697 18.87716 -31.88239      27.17498 
1 1 1 -2  5  11 o 815.8984 13.70313 129.4162       4.341939      134.6225       6.191261      124.3774       6.090828  831.6735 19.16895 799.3570 19.62039 32.31653       27.43006 
1 1 1 -2  5  12 o 960.2780 16.04929 179.4035       5.985230      185.8677       7.478022      167.8816       9.983732  976.9460 19.71007 927.1560 27.72759 49.78998       34.01920 
1 1 1 -2  5  13 o 218.0400 34.43184 9.552447       2.818792      10.42878       4.017266      8.702566       3.956184  225.3747 47.40111 205.3454 50.06226 20.02928       68.94270 
1 1 1 -2  5  14 o 742.1785 15.10439 107.2324       4.353510      111.9482       6.210948      102.6776       6.104031  757.3991 21.11568 725.2644 21.67167 32.13470       30.25778 
1 1 1 -2  5  15 o 361.6555 34.42793 26.00764       4.777060      0.000000       0.000000      26.00764       4.777060  ?        ?        361.6555 34.42793 0.000000       34.42793 
1 1 1 -2  5  16 o 558.7905 26.34257 61.20218       5.716566      0.000000       0.000000      61.20218       5.716566  ?        ?        558.7905 26.34257 0.000000       26.34257 
1 1 1 -2  5  17 o 394.2999 25.04368 30.55545       3.814997      30.49429       5.335636      30.61942       5.456846  391.5643 35.47282 392.1731 36.23890 -0.6088562     50.71074 
1 1 1 -2  5  18 o 1356.694 15.92393 358.4578       8.389965      356.5290       11.77612      360.4461       11.95633  1351.084 22.44357 1358.408 22.66418 -7.323486      31.89638 
1 1 1 -2  5  19 o 891.7233 19.23994 154.9758       6.662878      151.1797       8.002505      163.5538       12.02954  879.9529 23.41739 912.5191 33.94527 -32.56616      41.23900 
1 1 1 -2  5  20 o 148.2785 56.73983 3.087661       4.563076      8.517631       5.531307      -8.480235      8.073396  205.4621 63.17941 130.1998 61.39563 75.26227       88.09688 
1 1 1 -2  5  21 o 388.5858 30.31606 29.70333       4.538769      32.27479       6.389873      27.08479       6.448100  403.0004 41.41735 367.7327 46.16920 35.26764       62.02413 
1 1 1 -2  5  22 o 496.4223 25.56367 48.20329       4.911628      55.64662       7.034846      41.12409       6.860611  532.0109 34.23085 456.0719 39.11327 75.93906       51.97691 
1 1 1 -2  5  23 o 333.4571 38.59725 22.11525       4.905928      32.35917       6.874667      11.48477       7.003176  402.8366 44.69701 236.9166 70.72401 165.9201       83.66425 
1 1 1 -2  5  24 o 538.2678 26.78747 56.61472       5.599615      50.23677       7.661675      63.92797       8.204240  503.7145 39.48233 569.1251 37.32630 -65.41061      54.33329 
1 1 1 -2  5  25 o 421.9008 35.04358 35.22817       5.689816      37.42112       7.947453      32.92225       8.149585  431.4038 48.26388 402.7362 53.42445 28.66763       71.99704 
1 1 1 -2  5  26 o 884.7267 24.50921 153.0210       8.421056      138.9429       13.80646      161.3610       10.62660  836.3355 42.65000 906.9443 30.17072 -70.60876      52.24265 
1 1 1 -2  5  27 o 428.4233 38.79676 36.59690       6.384979      38.20398       8.840226      34.84423       9.231955  432.7899 53.75433 410.8152 59.60573 21.97479       80.26438 
1 1 1 -2  5  28 o 214.5371 72.01072 9.325724       7.078902      11.02426       8.258616      4.621636       13.74382  231.3719 77.77940 222.4216 93.58298 8.950272       121.6857 
1 1 1 -2  5  29 o 100.1725 48.80486 -10.27646      6.127264      -22.82911      8.297853      4.774767       9.086233  98.81445 49.58679 191.8327 77.94146 -93.01826      92.37814 
1 1 1 -2  5  30 o 123.2887 60.00595 -13.89453      9.195286      0.000000       0.000000      -13.89453      9.195286  ?        ?        123.2887 60.00595 0.000000       60.00595 
1 1 1 -2  5  31 o 311.7626 76.55477 22.97674       9.200984      53.67634       13.72091      -2.108565      12.40299  482.1052 75.78529 178.1559 81.19238 303.9493       111.0658 
1 1 1 -2  5  32 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  5  33 o 131.6414 60.26872 -1.938963      6.935666      -1.215557      10.05205      -2.596277      9.581861  157.2302 72.19411 149.6669 69.34925 7.563263       100.1065 
1 1 1 -2  5  34 o 166.5803 67.83673 5.493647       6.902953      5.272826       10.25200      5.676793       9.336589  177.9371 77.88451 176.5395 75.80151 1.397568       108.6824 
1 1 1 -2  6  1  o 491.2660 11.90070 46.90121       2.270478      48.88244       3.194238      44.87798       3.227908  501.3518 16.40577 480.3361 17.30406 21.01575       23.84491 
1 1 1 -2  6  2  o 113.0111 30.43427 2.576813       1.365512      3.643552       1.662574      0.3655752      2.393699  133.9320 32.33215 94.45252 39.34887 39.47952       50.92840 
1 1 1 -2  6  3  o 198.5512 18.27708 7.733323       1.393490      9.586591       1.986614      5.938298       1.955148  220.6249 23.55019 171.9393 30.39202 48.68556       38.44849 
1 1 1 -2  6  4  o 1104.260 12.29842 236.9579       5.274103      222.5812       7.040832      255.3383       7.961071  1069.871 16.94590 1145.801 17.89099 -75.92993      24.64246 
1 1 1 -2  6  5  o 1270.680 12.96058 313.7750       6.395711      308.9267       8.894799      318.9649       9.202868  1260.338 18.17277 1280.614 18.50449 -20.27576      25.93580 
1 1 1 -2  6  6  o 485.4860 12.98718 45.80263       2.448610      47.57285       3.483248      44.07327       3.442819  494.5956 18.13453 476.0365 18.62284 18.55908       25.99368 
1 1 1 -2  6  7  o 1999.229 16.76452 777.1227       13.01612      763.1699       17.91798      792.7120       18.93963  1979.997 23.30218 2017.764 24.16982 -37.76624      33.57338 
1 1 1 -2  6  8  o 363.8479 16.88449 25.74181       2.385809      25.58392       3.379550      25.89869       3.368565  361.6632 24.20138 363.9164 23.96919 -2.253174      34.06213 
1 1 1 -2  6  9  o 1165.068 13.41154 263.8267       6.068170      262.3018       8.504149      265.4084       8.661386  1161.150 18.85883 1167.978 19.09523 -6.827759      26.83809 
1 1 1 -2  6  10 o 1573.034 15.05854 481.1326       9.199178      483.7083       13.07974      478.6115       12.94058  1576.154 21.36843 1567.851 21.25303 8.302612       30.13804 
1 1 1 -2  6  11 o 360.8662 22.83484 25.47868       3.183663      24.55578       3.948967      27.19235       5.381072  353.4095 29.02899 370.4924 37.93403 -17.08292      47.76686 
1 1 1 -2  6  12 o 166.2649 51.24988 5.489099       3.637174      5.489099       3.637174      0.000000       0.000000  166.2649 51.24988 ?        ?        0.000000       51.24988 
1 1 1 -2  6  13 o 930.3644 14.34695 168.4276       5.183711      173.7272       7.475267      163.5186       7.194537  943.8816 20.39301 915.7601 20.22987 28.12146       28.72494 
1 1 1 -2  6  14 o 478.2060 18.77095 44.59341       3.486014      51.20121       4.920290      37.93335       4.939705  511.6113 24.76410 438.8073 29.15261 72.80399       38.25095 
1 1 1 -2  6  15 o 614.0128 24.36827 73.78484       5.810721      0.000000       0.000000      73.78484       5.810721  ?        ?        614.0128 24.36827 0.000000       24.36827 
1 1 1 -2  6  16 o 442.4590 25.71478 38.47710       4.399532      25.32911       7.148583      46.49349       5.581866  350.7062 54.23692 485.5720 29.74377 -134.8658      61.85738 
1 1 1 -2  6  17 o 998.8411 15.52921 194.3116       6.023846      195.0761       8.470942      193.5296       8.567894  999.3392 21.82684 995.2774 22.16675 4.061768       31.10909 
1 1 1 -2  6  18 o 558.8832 20.11963 60.92174       4.366857      66.67847       6.120672      54.95335       6.232174  583.6556 27.00315 528.4288 30.49825 55.22675       40.73467 
1 1 1 -2  6  19 o 237.7588 43.85179 11.51159       3.899862      8.717569       5.390226      14.58073       5.649372  206.7827 62.11966 265.3196 56.55645 -58.53694      84.00883 
1 1 1 -2  6  20 o 441.8353 29.31918 38.34226       5.002262      43.76177       6.193560      28.17472       8.483371  471.2672 34.07072 370.7934 61.03696 100.4739       69.90224 
1 1 1 -2  6  21 o 852.3975 18.08119 141.4289       5.985456      141.2940       8.403191      141.5677       8.527606  850.9816 25.42705 851.7484 25.78029 -0.7667236     36.20992 
1 1 1 -2  6  22 o 491.0106 26.17053 47.17682       4.972350      43.61563       6.891576      51.04374       7.181296  469.9972 38.08427 508.9904 36.57382 -38.99323      52.80204 
1 1 1 -2  6  23 o 801.2812 27.93493 125.4281       8.692818      125.4281       8.692818      0.000000       0.000000  801.2812 27.93493 ?        ?        0.000000       27.93493 
1 1 1 -2  6  24 o 540.1281 27.40079 57.18202       5.728796      66.16028       8.037858      47.91255       8.167172  579.2282 35.90946 490.7313 43.29880 88.49692       56.25189 
1 1 1 -2  6  25 o 842.3511 24.20131 138.6256       7.916990      126.4671       12.66803      146.4179       10.14143  799.0371 40.96155 864.2291 30.21638 -65.19202      50.90067 
1 1 1 -2  6  26 o 407.8297 37.78737 33.09143       5.916856      32.43850       8.049596      33.85883       8.726761  399.1117 53.26326 406.6356 56.81268 -7.523926      77.87590 
1 1 1 -2  6  27 o 267.9411 67.09190 15.30547       6.965726      14.49062       8.106297      17.60540       13.61889  260.1720 75.67870 288.4543 99.81526 -28.28223      125.2611 
1 1 1 -2  6  28 o 147.7121 64.95101 -0.9997650     7.202078      -2.132641      8.326086      2.366968       14.35338  153.7334 68.59252 216.4561 93.46915 -62.72267      115.9371 
1 1 1 -2  6  29 o 254.7915 83.74694 14.44218       9.587163      0.000000       0.000000      14.44218       9.587163  ?        ?        254.7915 83.74694 0.000000       83.74694 
1 1 1 -2  6  30 f 112.8089 54.36499 -9.406581      7.086796      -7.019789      8.618023      -14.39131      12.45436  135.5866 63.78218 149.3961 72.01556 -13.80948      96.19983 
1 1 1 -2  6  31 o 224.7439 74.84373 11.65041       7.647900      36.66002       12.82515      -2.150573      9.527169  384.5316 87.81049 157.5527 71.55368 226.9789       113.2723 
1 1 1 -2  6  32 o 348.7587 62.16372 27.77019       8.110860      45.10170       14.88545      20.45157       9.672935  407.3377 95.71880 281.1152 82.92696 126.2225       126.6451 
1 1 1 -2  6  33 o 159.2281 69.04562 2.745611       7.898368      -7.080882      14.64824      6.773676       9.378523  165.8628 79.47036 185.8399 77.69316 -19.97711      111.1385 
1 1 1 -2  6  34 o 116.3542 55.03140 -4.557683      6.575095      -1.814596      9.858941      -6.755121      8.824067  150.0557 69.80778 128.8129 61.70845 21.24275       93.17220 
1 1 1 -2  7  1  o 756.4755 16.37098 111.2626       4.809472      111.2626       4.809472      0.000000       0.000000  756.4755 16.37098 ?        ?        0.000000       16.37098 
1 1 1 -2  7  2  f 1400.975 13.54161 381.4496       7.367647      378.9343       8.485903      389.1515       14.84886  1396.145 15.65091 1413.209 27.05569 -17.06470      31.25638 
1 1 1 -2  7  3  o 422.6290 12.56640 34.70866       2.062520      33.69217       2.902900      35.74492       2.930990  416.2341 17.95835 428.7391 17.60327 -12.50504      25.14711 
1 1 1 -2  7  4  f 198.7523 20.48671 7.766547       1.558626      9.079540       2.153541      6.322223       2.258677  214.2874 26.43850 177.0201 34.09198 37.26729       43.14229 
1 1 1 -2  7  5  o 1564.208 14.36869 475.5494       8.728498      469.0994       12.12648      482.4837       12.57358  1552.865 20.10820 1574.796 20.55923 -21.93152      28.75798 
1 1 1 -2  7  6  f 855.4468 12.13191 142.1934       4.030420      139.8850       5.641997      144.5990       5.759572  848.1885 17.12823 862.3568 17.19789 -14.16833      24.27229 
1 1 1 -2  7  7  o 810.0794 12.56117 127.5217       3.951715      126.1296       5.570437      128.9320       5.606878  805.3361 17.81083 814.2388 17.73133 -8.902771      25.13216 
1 1 1 -2  7  8  o 624.2486 13.44413 75.74021       3.259253      79.07533       4.620672      72.43777       4.597972  637.5636 18.66180 610.1735 19.40372 27.39014       26.92150 
1 1 1 -2  7  9  o 773.4003 18.78785 116.3853       5.642992      0.000000       0.000000      116.3853       5.642992  ?        ?        773.4003 18.78785 0.000000       18.78785 
1 1 1 -2  7  10 o 521.4335 17.82957 52.90672       3.610505      51.29329       4.462551      55.96434       6.143284  513.1094 22.39470 534.4781 29.71398 -21.36865      37.20811 
1 1 1 -2  7  11 o 354.5757 24.17346 24.63559       3.308855      23.30259       4.051388      27.30601       5.734264  343.8347 30.66250 370.5305 40.50972 -26.69577      50.80577 
1 1 1 -2  7  12 o 247.2932 42.07441 12.39047       3.895998      0.000000       0.000000      12.39047       3.895998  ?        ?        247.2932 42.07441 0.000000       42.07441 
1 1 1 -2  7  13 o 169.8638 43.31916 5.936773       2.866566      6.434275       3.910996      5.359256       4.213790  177.8279 52.79936 166.9860 55.55210 10.84195       76.64077 
1 1 1 -2  7  14 o 663.2733 18.61283 85.80164       4.794384      78.04608       8.056326      90.05444       5.965793  628.7693 33.10937 678.7993 22.63074 -50.02991      40.10462 
1 1 1 -2  7  15 o 467.6741 29.00379 43.10839       5.241778      0.000000       0.000000      43.10839       5.241778  ?        ?        467.6741 29.00379 0.000000       29.00379 
1 1 1 -2  7  16 o 207.1743 48.87909 8.922619       3.869110      3.185291       6.396433      12.23308       4.858783  164.9191 65.95859 242.1870 53.12077 -77.26788      84.68974 
1 1 1 -2  7  17 o 735.5648 16.94660 105.4159       4.840959      100.1185       6.594490      111.6070       7.129010  715.6870 23.72630 755.5132 24.29737 -39.82629      33.96026 
1 1 1 -2  7  18 o 1061.984 15.89246 219.5606       6.554462      215.2133       9.095877      224.2563       9.453269  1050.106 22.30403 1071.841 22.71033 -21.73523      31.83126 
1 1 1 -2  7  19 o 474.9962 23.63712 44.02802       4.360262      44.33404       6.033793      43.69354       6.308028  474.4316 32.95271 470.5983 34.76163 3.833252       47.89835 
1 1 1 -2  7  20 o 575.6597 24.64498 64.65533       5.509628      68.12673       6.902855      58.56178       9.145571  589.4422 30.25697 543.4190 43.70555 46.02319       53.15693 
1 1 1 -2  7  21 o 726.2028 20.00959 102.6988       5.643183      110.8137       7.964208      94.51646       7.997227  753.4272 27.21907 695.4838 29.60904 57.94336       40.21907 
1 1 1 -2  7  22 o 1229.601 17.20846 294.2109       8.217394      292.0834       11.46215      296.4606       11.78696  1223.883 24.11562 1232.910 24.61740 -9.027466      34.46128 
1 1 1 -2  7  23 f 972.7512 21.79426 184.4485       8.233263      199.8665       14.30950      176.8184       10.06643  1009.091 36.51458 951.3896 27.24514 57.70105       45.55889 
1 1 1 -2  7  24 o 569.8025 25.91379 63.44918       5.734338      63.08908       7.839035      63.86367       8.410217  565.4370 35.88445 568.2774 38.33224 -2.840393      52.50766 
1 1 1 -2  7  25 f 745.1370 33.72208 109.1326       9.758399      0.000000       0.000000      109.1326       9.758399  ?        ?        745.1370 33.72208 0.000000       33.72208 
1 1 1 -2  7  26 o 411.6453 37.00782 33.68945       5.852997      35.87538       7.917346      31.05516       8.691483  421.2224 49.33385 387.9753 59.59040 33.24707       77.36178 
1 1 1 -2  7  27 f 664.1470 31.22690 86.78799       8.054175      81.55048       9.384240      101.4363       15.69388  640.7681 37.87951 704.8302 57.84477 -64.06207      69.14387 
1 1 1 -2  7  28 o 220.9348 69.76968 10.30245       6.696497      5.674838       8.267810      19.12784       11.41770  193.2321 75.71104 291.0437 90.98373 -97.81152      118.3647 
1 1 1 -2  7  29 f 161.3969 64.43105 3.478458       6.091591      -0.3322644     8.029017      8.647264       9.350908  156.8206 68.77614 214.5086 81.42822 -57.68803      106.5866 
1 1 1 -2  7  30 o 379.6680 53.10650 30.55139       7.616018      30.20916       12.66401      30.74530       9.532474  349.9229 91.97955 371.0221 68.68701 -21.09912      114.7961 
1 1 1 -2  7  31 o 591.3508 36.10393 71.11883       8.251676      87.91796       13.91024      61.99752       10.24991  637.3320 56.79581 541.5883 49.27183 95.74371       75.18961 
1 1 1 -2  7  32 o 129.1040 59.11826 -2.337470      6.677783      -11.45972      9.427236      6.849227       9.460477  126.2632 61.29248 190.9993 78.78308 -64.73619      99.81755 
1 1 1 -2  7  33 o 107.6717 52.90783 -11.99809      7.674822      -8.365497      14.63719      -13.37548      9.013183  162.1840 78.15256 116.4787 57.25578 45.70533       96.88161 
1 1 1 -2  8  1  o 979.1785 12.21491 186.2988       4.644940      187.4135       6.556134      185.1753       6.581817  981.7838 17.19507 975.8908 17.36667 5.893005       24.43914 
1 1 1 -2  8  2  o 680.8000 12.35160 90.06020       3.265659      89.92142       4.582376      90.20341       4.655163  680.0500 17.35090 681.1023 17.59927 -1.052307      24.71412 
1 1 1 -2  8  3  o 1240.446 13.14253 299.0132       6.331183      298.1168       7.323525      301.6648       12.59602  1238.421 15.22734 1244.520 26.06173 -6.099365      30.18420 
1 1 1 -2  8  4  f 973.6650 12.21841 184.2092       4.620109      177.4618       6.354591      191.7754       6.729125  955.3544 17.12754 993.1106 17.44749 -37.75616      24.44929 
1 1 1 -2  8  5  o 1373.726 13.64919 366.7543       7.281736      363.1719       10.16988      370.5229       10.43095  1366.425 19.16469 1380.148 19.46122 -13.72302      27.31344 
1 1 1 -2  8  6  o 1319.665 13.52316 338.4662       6.930587      336.3723       9.738296      340.6153       9.865606  1314.994 19.06915 1323.246 19.19797 -8.251953      27.05909 
1 1 1 -2  8  7  o 1296.510 13.60414 326.7203       6.849754      323.2104       9.588183      330.3786       9.788968  1288.906 19.15521 1303.096 19.34339 -14.18933      27.22295 
1 1 1 -2  8  8  o 814.8721 13.01065 129.0636       4.117338      128.8895       5.887963      129.2302       5.759745  813.9027 18.62793 815.0152 18.19741 -1.112488      26.04123 
1 1 1 -2  8  9  o 1376.323 14.29618 368.3139       7.641319      367.0037       10.77878      369.6377       10.83435  1372.958 20.21549 1377.870 20.24728 -4.912109      28.61151 
1 1 1 -2  8  10 o 515.5828 31.63412 52.19472       6.303451      0.000000       0.000000      52.19472       6.303451  ?        ?        515.5828 31.63412 0.000000       31.63412 
1 1 1 -2  8  11 o 401.1174 19.28968 31.34539       3.004862      29.14516       4.255497      33.53328       4.243562  384.9775 28.66885 413.4329 26.57075 -28.45532      39.08846 
1 1 1 -2  8  12 o 661.9741 15.68021 85.31232       4.031075      78.14755       5.518810      93.50677       5.902070  632.7020 22.46044 692.1725 21.95644 -59.47052      31.40950 
1 1 1 -2  8  13 f 92.53747 41.08279 -0.9795135     2.948825      -5.020472      4.159972      3.101702       4.180641  91.12337 43.29403 143.8666 54.48612 -52.74319      69.59246 
1 1 1 -2  8  14 o 795.7567 17.66646 123.4648       5.459562      114.2336       9.142027      128.5820       6.806611  762.2240 30.88388 811.2564 21.60453 -49.03241      37.69045 
1 1 1 -2  8  15 o 492.4539 22.92156 47.41614       4.383669      46.77170       7.367182      47.76937       5.454320  484.3179 39.51338 492.5312 28.63900 -8.213257      48.80061 
1 1 1 -2  8  16 o 1090.608 17.94164 231.8762       7.599041      245.1338       13.21625      225.3286       9.287856  1117.201 30.46134 1073.952 22.26910 43.24890       37.73335 
1 1 1 -2  8  17 o 207.8837 46.30194 8.911622       3.642217      4.157513       5.036870      14.12190       5.272984  161.2923 60.07182 261.1172 53.78908 -99.82489      80.63429 
1 1 1 -2  8  18 o 991.8117 16.24053 191.4865       6.255434      192.4545       8.746049      190.4727       8.950534  993.1432 22.67629 987.8768 23.33018 5.266418       32.53478 
1 1 1 -2  8  19 o 561.0856 21.82320 61.37256       4.755274      61.57134       6.562288      61.15277       6.900389  560.1731 30.27756 557.9257 31.98045 2.247375       44.03952 
1 1 1 -2  8  20 o 481.5201 28.74987 45.45869       5.351696      46.26638       6.476068      43.71922       9.503784  484.7588 34.62785 466.7158 53.39525 18.04294       63.64072 
1 1 1 -2  8  21 o 109.9470 50.39835 -3.345335      4.870492      3.478711       5.975357      -16.85407      8.407176  165.2819 64.47369 112.6896 55.37376 52.59227       84.98888 
1 1 1 -2  8  22 o 812.7183 22.79124 128.7522       7.193430      123.6733       11.94099      131.6452       9.012254  793.6437 38.74243 820.9474 28.26768 -27.30371      47.95871 
1 1 1 -2  8  23 o 325.9371 40.28315 21.21959       4.990475      17.75492       6.738985      25.42685       7.426143  292.5878 61.27145 353.1397 56.01891 -60.55194      83.01994 
1 1 1 -2  8  24 o 714.0467 22.68150 99.51131       6.289648      105.6291       8.653757      92.66075       9.157408  734.1894 30.35069 686.7717 34.33462 47.41772       45.82609 
1 1 1 -2  8  25 f 675.7225 24.23804 89.23558       6.360538      94.06265       8.772800      83.88609       9.235332  691.9479 32.64651 651.4805 36.65145 40.46741       49.08282 
1 1 1 -2  8  26 o 407.7060 45.40093 33.46236       7.066441      34.76451       8.230763      29.81164       13.78155  413.2856 52.46342 365.1370 95.93942 48.14865       109.3471 
1 1 1 -2  8  27 o 183.8232 68.10327 5.805934       6.456916      10.48867       7.779996      -4.558547      11.57454  226.4084 75.49158 174.0202 78.96920 52.38823       109.2479 
1 1 1 -2  8  28 o 618.7578 29.06842 75.49202       6.985059      88.84914       9.647907      60.77782       10.12617  666.9897 37.39736 546.1060 48.24242 120.8837       61.04010 
1 1 1 -2  8  29 o 271.3261 62.20081 16.08951       6.414145      19.09452       8.742095      12.58555       9.439996  289.3085 76.60126 239.4989 83.08918 49.80962       113.0113 
1 1 1 -2  8  30 o 530.1293 39.33181 57.25565       8.039817      58.95456       13.27453      56.27142       10.10376  515.2880 67.99551 517.5049 50.93362 -2.216980      84.95660 
1 1 1 -2  8  31 o 158.0627 65.06945 3.298316       6.437914      7.113342       8.741107      -1.224553      9.517538  193.7589 77.23450 159.2508 72.00044 34.50812       105.5899 
1 1 1 -2  8  32 o 163.1591 66.22810 4.489933       6.553248      15.37185       9.316742      -6.165810      9.219410  241.4167 82.60480 137.3782 65.03188 104.0385       105.1318 
1 1 1 -2  8  33 o 109.7844 53.50491 -9.762078      7.381004      -4.297514      14.74837      -11.58809      8.525478  169.9013 80.94797 115.7606 56.65037 54.14066       98.80202 
1 1 1 -2  9  1  o 93.36811 35.00214 1.259907       1.715532      1.215822       2.420604      1.304397       2.431691  104.0978 40.91119 105.2887 41.11345 -1.190872      58.00036 
1 1 1 -2  9  2  o 1610.295 14.90461 504.0217       9.320819      502.0697       13.06431      506.0454       13.30217  1606.380 20.94160 1612.682 21.23957 -6.301392      29.82734 
1 1 1 -2  9  3  o 493.2340 16.05699 47.29625       3.075709      47.76006       3.861732      46.49162       5.086396  495.4790 20.06914 487.7497 26.95715 7.729279       33.60741 
1 1 1 -2  9  4  o 1552.788 14.49760 468.6685       8.742514      479.5580       12.65663      458.7315       12.09037  1569.883 20.75978 1535.490 20.27517 34.39319       29.01812 
1 1 1 -2  9  5  o 830.6362 12.36831 134.0789       3.989784      128.3896       5.473640      140.5284       5.827812  812.5137 17.34673 850.0333 17.65394 -37.51965      24.75016 
1 1 1 -2  9  6  o 1367.385 13.82489 363.4410       7.341425      355.4745       10.10657      372.3405       10.68199  1351.652 19.25356 1383.252 19.88488 -31.60046      27.67865 
1 1 1 -2  9  7  o 1246.143 13.55780 301.8615       6.561228      293.4867       9.053830      311.1245       9.521804  1228.093 18.98337 1264.398 19.39132 -36.30542      27.13654 
1 1 1 -2  9  8  o 335.7146 19.25410 22.00976       2.499786      24.22017       3.632621      20.02147       3.445277  351.3312 26.82690 319.0609 28.09145 32.27029       38.84343 
1 1 1 -2  9  9  o 577.6174 16.75839 64.92174       3.759244      69.75639       4.829962      57.49261       5.987289  598.4010 20.78373 541.7445 28.55912 56.65649       35.32119 
1 1 1 -2  9  10 o 567.9691 18.07355 62.81821       3.986539      63.60135       4.994680      61.44363       6.617217  571.0492 22.52196 559.4260 30.57401 11.62323       37.97379 
1 1 1 -2  9  11 f 413.9335 19.27827 33.39789       3.099036      32.40033       4.413908      34.36772       4.352143  405.8743 28.17753 418.2952 26.93440 -12.42090      38.97993 
1 1 1 -2  9  12 o 596.0765 16.29530 69.20980       3.772180      66.33473       5.272713      72.22408       5.398860  582.6095 23.30390 607.9948 22.86516 -25.38531      32.64793 
1 1 1 -2  9  13 o 595.1030 19.49640 69.10499       4.505827      60.87963       7.486878      73.77607       5.641986  554.5303 34.94415 614.1790 23.65425 -59.64862      42.19735 
1 1 1 -2  9  14 o 394.0513 24.15003 30.49412       3.677887      32.08564       5.329005      29.04649       5.082391  401.9539 34.47185 382.2706 34.61023 19.68326       48.84850 
1 1 1 -2  9  15 o 685.4711 20.05022 91.69986       5.337480      94.12918       9.128939      90.43806       6.579197  691.2328 34.00697 679.8066 24.92066 11.42621       42.16057 
1 1 1 -2  9  16 o 1068.984 18.20158 222.7274       7.556280      219.4418       13.01580      224.3978       9.280312  1057.040 31.70672 1071.979 22.29196 -14.93860      38.75884 
1 1 1 -2  9  17 o 719.1453 17.78615 100.7384       4.967370      98.47356       6.987362      103.0527       7.063093  709.8688 25.34587 726.2409 25.04299 -16.37207      35.63095 
1 1 1 -2  9  18 o 545.9891 21.63769 58.12155       4.587993      56.09570       6.307824      60.39721       6.685434  534.4656 30.51664 554.5092 31.17153 -20.04364      43.62258 
1 1 1 -2  9  19 o 331.8741 33.35715 21.78386       4.241011      23.16056       5.951377      20.36346       6.045111  339.5523 46.34193 316.9279 50.83344 22.62433       68.78671 
1 1 1 -2  9  20 o 777.7487 26.53198 118.0456       8.013771      128.0523       11.33226      108.0356       11.33411  808.3276 36.09948 740.7703 39.54111 67.55731       53.54131 
1 1 1 -2  9  21 o 192.8623 61.18100 7.321532       5.144800      5.763338       6.185520      10.81923       9.267376  184.6843 66.93963 239.1724 82.36284 -54.48804      106.1346 
1 1 1 -2  9  22 o 626.3635 23.50036 76.51039       5.716483      75.62272       7.636354      77.64192       8.621684  620.8219 31.77967 628.2830 35.48041 -7.461121      47.63199 
1 1 1 -2  9  23 o 346.3076 38.69141 23.88677       5.114666      25.99656       6.712302      20.96585       7.897926  358.7544 49.49580 316.8528 66.31275 41.90161       82.74790 
1 1 1 -2  9  24 o 846.7788 21.26465 139.8851       6.992883      135.5687       9.375362      145.2977       10.49853  831.9383 29.01810 860.6328 31.41107 -28.69452      42.76337 
1 1 1 -2  9  25 o 649.4183 29.08870 82.67686       7.336296      86.79989       8.698095      72.51427       13.65584  663.4676 33.87082 596.5621 59.74649 66.90552       68.67951 
1 1 1 -2  9  26 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -2  9  27 o 386.0183 42.05089 30.04962       6.201946      38.63478       8.357148      19.52559       9.252836  434.9806 50.40626 297.6018 78.81194 137.3787       93.55273 
1 1 1 -2  9  28 o 112.6288 53.00943 -5.707288      5.966574      -9.317129      8.017461      -1.226401      8.932536  124.3083 59.35182 161.5903 71.63236 -37.28200      93.02599 
1 1 1 -2  9  29 o 315.6612 61.22016 21.67534       7.234048      34.06521       12.00170      14.60540       9.066033  382.3181 83.19711 252.4344 81.33680 129.8837       116.3505 
1 1 1 -2  9  30 o 445.4949 39.39087 40.62984       6.744774      39.39890       9.633183      41.81357       9.446655  424.8573 60.05870 440.5153 56.52286 -15.65802      82.47352 
1 1 1 -2  9  31 o 169.2802 66.12292 5.232942       6.291511      2.375154       8.792122      8.232020       9.006844  168.0637 72.86220 199.7662 78.78648 -31.70248      107.3136 
1 1 1 -2  9  32 o 357.2155 47.52058 27.76359       6.428771      28.60086       9.230337      26.97482       8.959042  340.3221 72.08207 330.4043 71.86695 9.917816       101.7874 
1 1 1 -2  9  33 o 335.3555 58.54560 26.39282       7.347368      25.79447       14.20942      26.61118       8.583990  273.1235 101.0600 324.6927 70.12601 -51.56918      123.0072 
1 1 1 -2  10 1  o 820.5526 12.61325 130.8449       4.019401      126.4921       5.554053      135.6313       5.824143  806.4749 17.73336 835.0845 17.95865 -28.60956      25.23857 
1 1 1 -2  10 2  o 1023.962 12.99743 203.7698       5.168556      205.7145       7.285793      201.7996       7.333324  1028.407 18.24248 1018.546 18.53926 9.861084       26.00947 
1 1 1 -2  10 3  o 711.8600 12.91137 98.48451       3.569397      100.5094       4.175866      92.99244       6.877320  719.0331 14.95442 690.8368 25.63396 28.19635       29.67718 
1 1 1 -2  10 4  o 762.8302 13.03039 113.0991       3.860230      115.9519       4.513380      105.3265       7.449933  772.2707 15.04888 735.1199 26.09553 37.15082       30.12384 
1 1 1 -2  10 5  o 960.8512 12.73160 179.4399       4.750805      176.0382       6.619348      183.0536       6.822566  951.2615 17.91791 970.0114 18.11102 -18.74982      25.47666 
1 1 1 -2  10 6  o 1369.011 14.01855 364.3755       7.453119      374.2339       10.77019      355.3160       10.32453  1386.520 20.00182 1351.075 19.67718 35.44482       28.05823 
1 1 1 -2  10 7  o 461.1976 15.54173 41.37078       2.783648      40.57150       3.930802      42.17485       3.942571  456.3283 22.18073 465.2831 21.81897 -8.954865      31.11354 
1 1 1 -2  10 8  o 616.5237 15.95373 73.95263       3.819796      77.00192       4.829839      68.86001       6.241715  628.7736 19.77928 593.8202 27.06581 34.95337       33.52279 
1 1 1 -2  10 9  o 556.2925 17.24462 60.25003       3.725502      61.69895       4.781193      58.01071       5.943912  562.4863 21.88751 543.9295 28.23566 18.55682       35.72556 
1 1 1 -2  10 10 o 884.9296 13.88528 152.3628       4.771901      147.9074       6.705923      156.9332       6.791873  870.9969 19.82503 897.2395 19.49186 -26.24255      27.80224 
1 1 1 -2  10 11 o 542.2979 17.12511 57.30110       3.606611      56.44376       5.140180      58.13248       5.061762  537.2430 24.63653 545.3338 23.90074 -8.090759      34.32497 
1 1 1 -2  10 12 o 166.9230 50.10319 5.654419       3.507634      5.371035       5.995492      5.801892       4.325068  178.0307 65.69074 171.9175 56.23727 6.113190       86.47488 
1 1 1 -2  10 13 o 422.2404 25.36023 35.03231       4.139266      32.17546       7.097727      36.50468       5.095474  398.9449 46.69530 429.8877 30.72365 -30.94284      55.89628 
1 1 1 -2  10 14 o 768.3246 16.04777 115.0010       4.788368      107.4682       6.650374      123.1102       6.900075  741.4448 23.09613 793.7328 22.38471 -52.28809      32.16375 
1 1 1 -2  10 15 o 511.7271 23.49666 51.17621       4.669524      56.37521       7.726523      48.18473       5.860942  533.1890 37.55420 494.5140 30.66963 38.67499       48.48653 
1 1 1 -2  10 16 o 468.4844 26.54733 43.06233       4.810110      53.46634       8.412521      38.00875       5.863076  518.3806 42.15289 438.3849 34.72240 79.99567       54.61237 
1 1 1 -2  10 17 o 118.4687 49.22307 0.7339711      3.731616      1.768224       5.309890      -0.2752763     5.245307  145.6581 59.42679 131.4229 56.62754 14.23517       82.08667 
1 1 1 -2  10 18 o 886.4875 17.22973 152.9628       5.931699      158.1882       8.396448      147.7567       8.380953  900.4858 24.00992 870.1533 24.80103 30.33252       34.51909 
1 1 1 -2  10 19 o 152.2280 58.37115 3.197730       4.835418      15.58422       8.198363      -3.409601      5.987783  273.2839 74.98318 124.7266 56.67653 148.5573       93.99312 
1 1 1 -2  10 20 o 137.4627 56.28190 1.396567       4.783934      2.840380       5.939392      -1.270277      8.072076  160.3549 63.74483 158.5351 69.25818 1.819855       94.12810 
1 1 1 -2  10 21 o 613.5399 25.63042 73.44577       6.106981      73.59688       7.473261      73.14204       10.59529  612.6285 31.51802 607.6039 45.22577 5.024536       55.12491 
1 1 1 -2  10 22 o 657.6009 23.44198 84.35803       5.986661      81.28647       8.173496      87.91308       8.793273  643.2821 32.82662 668.7880 33.96740 -25.50592      47.23739 
1 1 1 -2  10 23 o 146.6672 58.32088 2.413324       4.973002      4.624266       6.575723      -0.5407590     7.600921  177.7768 68.09283 156.2122 67.73544 21.56462       96.04543 
1 1 1 -2  10 24 o 777.4713 24.38374 118.1224       7.362286      122.0057       9.137691      110.9371       12.42965  788.9063 29.82518 747.3004 43.01033 41.60590       52.33956 
1 1 1 -2  10 25 f 530.5212 36.00095 55.72726       7.373379      60.08158       8.432207      41.58179       15.19811  549.8104 39.75930 434.5840 92.86840 115.2264       101.0215 
1 1 1 -2  10 26 f 545.3083 29.60177 58.59778       6.245361      67.69379       8.535191      48.11511       9.162708  583.5925 37.86410 487.6194 49.05105 95.97311       61.96527 
1 1 1 -2  10 27 o 438.1173 37.95288 38.44893       6.393690      45.93816       8.603946      29.21313       9.554688  475.3713 47.23075 368.3114 69.34390 107.0599       83.90066 
1 1 1 -2  10 28 o 663.0717 27.23173 86.72635       7.012351      99.88247       9.795449      72.89656       10.04311  706.7534 35.80539 599.3529 43.44259 107.4005       56.29640 
1 1 1 -2  10 29 o 319.0200 61.50836 22.27905       7.344200      25.32731       11.96599      20.43683       9.302392  320.6895 91.55334 295.1044 79.41929 25.58514       121.2000 
1 1 1 -2  10 30 o 142.6786 61.19320 1.098148       6.072379      -5.597006      8.238912      9.060369       8.984765  134.4525 62.96405 208.1423 79.62509 -73.68983      101.5117 
1 1 1 -2  10 31 o 154.3630 63.97747 3.176557       6.281518      9.057827       8.896965      -2.669001      8.869912  202.5067 78.76170 147.0080 67.61703 55.49867       103.8050 
1 1 1 -2  10 32 o 159.0306 64.35845 4.464459       6.168492      -1.646274      9.061112      9.742483       8.421133  148.6292 68.35503 200.4158 76.98792 -51.78667      102.9541 
1 1 1 -2  11 1  o 866.7825 12.98909 146.0295       4.372371      151.3916       6.227461      140.8163       6.140391  882.1419 18.17794 850.7369 18.58544 31.40503       25.99723 
1 1 1 -2  11 2  o 1240.305 13.72931 299.0455       6.613103      303.4344       9.378714      294.7057       9.326189  1248.692 19.34015 1230.577 19.51496 18.11560       27.47499 
1 1 1 -2  11 3  o 1432.341 16.58553 399.0444       9.225798      387.6087       10.98918      426.3498       16.98086  1411.121 20.05270 1477.829 29.58744 -66.70813      35.74252 
1 1 1 -2  11 4  o 449.5692 15.89314 39.30933       2.774817      39.40665       3.231753      39.03630       5.412919  449.9963 18.49274 445.8633 31.46284 4.132996       36.49509 
1 1 1 -2  11 5  o 310.7205 19.58618 18.87049       2.351361      19.21303       3.308803      18.52101       3.342100  312.5528 27.54105 306.7068 28.38045 5.845947       39.54693 
1 1 1 -2  11 6  o 582.9709 13.94697 66.08824       3.157582      68.21951       4.440825      63.90895       4.490581  591.9008 19.31909 572.8223 20.18620 19.07849       27.94119 
1 1 1 -2  11 7  o 883.6368 13.27250 151.8385       4.554644      157.0199       6.507967      146.8643       6.376522  897.9451 18.66241 868.3881 18.90784 29.55695       26.56674 
1 1 1 -2  11 8  o 546.7903 17.00837 58.21440       3.611698      59.87302       4.579498      55.48518       5.874393  554.0962 21.28162 531.7490 28.55091 22.34717       35.60986 
1 1 1 -2  11 9  o 1101.113 13.88686 235.9109       5.938324      239.1903       8.514133      232.8044       8.286606  1107.575 19.79426 1092.751 19.52664 14.82434       27.80471 
1 1 1 -2  11 10 o 418.9079 19.48973 34.22714       3.170679      33.69516       4.637861      34.69395       4.344533  413.5287 29.06379 420.0984 26.76898 -6.569733      39.51307 
1 1 1 -2  11 11 o 575.9655 16.65643 64.64111       3.725687      65.31674       5.312281      63.98711       5.226599  577.9410 23.66844 572.0523 23.52640 5.888733       33.37194 
1 1 1 -2  11 12 o 674.0581 18.53630 88.61657       4.852307      83.12916       8.317470      91.44772       5.974321  648.9130 33.11499 684.0283 22.48985 -35.11536      40.02994 
1 1 1 -2  11 13 o 642.5223 17.16627 80.46047       4.283434      79.20729       6.000736      81.76238       6.116298  636.3228 24.28281 646.4893 24.36124 -10.16644      34.39658 
1 1 1 -2  11 14 o 149.1290 50.59636 4.163812       3.495072      3.039250       4.972785      5.261634       4.913309  151.1223 58.85377 170.1205 59.88880 -18.99825      83.96687 
1 1 1 -2  11 15 o 230.3557 47.29782 10.91087       4.089552      6.704477       6.988263      13.10167       5.043309  195.7552 71.12040 251.5594 53.28133 -55.80417      88.86514 
1 1 1 -2  11 16 o 1183.815 18.38876 272.9710       8.454039      257.3516       14.02739      281.8806       10.59427  1146.003 31.51832 1202.002 22.69539 -55.99951      38.83922 
1 1 1 -2  11 17 o 370.8696 33.22491 27.16004       4.734619      16.91654       7.692626      33.40664       6.007207  284.0351 70.15279 410.6360 38.10347 -126.6009      79.83288 
1 1 1 -2  11 18 o 762.4156 18.78465 113.1674       5.561897      116.8886       7.898954      109.5081       7.832882  773.8788 26.28262 748.9531 26.93016 24.92572       37.62991 
1 1 1 -2  11 19 o 423.3618 28.74391 35.16172       4.697913      37.26367       6.370907      32.65655       6.955180  434.2555 38.16440 404.8718 44.99579 29.38367       59.00121 
1 1 1 -2  11 20 o 782.9999 22.10685 119.4574       6.722280      124.6093       8.247155      109.2583       11.60382  799.0966 26.57522 744.8253 40.26566 54.27130       48.24485 
1 1 1 -2  11 21 o 181.9356 62.78038 6.078176       5.385788      1.105687       6.427309      17.80122       9.868758  153.6738 64.28782 291.0193 83.16522 -137.3456      105.1160 
1 1 1 -2  11 22 o 927.2316 21.96004 167.6748       7.907684      168.8113       9.555628      165.2053       14.08556  929.4530 26.47304 915.9031 39.60012 13.54987       47.63393 
1 1 1 -2  11 23 o 159.4465 61.67773 3.490971       5.432982      4.676781       6.518480      0.7929721      9.832401  177.5139 67.84236 182.8281 78.12499 -5.314163      103.4703 
1 1 1 -2  11 24 o 457.2892 39.10642 41.57803       6.878119      42.94764       7.782634      36.69189       14.69977  463.4754 43.75639 407.8716 94.63210 55.60379       104.2586 
1 1 1 -2  11 25 o 863.8373 25.61383 146.0826       8.592794      140.7752       9.928289      161.9260       17.15357  846.6628 30.19507 898.4161 49.35336 -51.75330      57.85754 
1 1 1 -2  11 26 o 588.1845 28.06391 67.96919       6.410467      71.38089       8.660994      63.83576       9.533175  598.9693 37.42109 563.7443 43.88982 35.22498       57.67715 
1 1 1 -2  11 27 o 455.4214 35.82937 41.47935       6.285783      40.41796       8.225204      42.96949       9.745891  444.2671 48.45919 454.1694 56.47499 -9.902344      74.41585 
1 1 1 -2  11 28 o 292.9145 66.32938 18.96341       7.369947      24.32037       11.34758      15.05523       9.692397  319.7474 88.41724 256.7287 84.19669 63.01865       122.0930 
1 1 1 -2  11 29 o 297.7234 56.60814 19.26133       6.305934      17.26485       8.582975      21.60303       9.295451  270.6086 77.62983 302.2536 78.49162 -31.64499      110.3962 
1 1 1 -2  11 30 o 122.9913 56.57085 -3.030277      6.208731      5.937465       8.694072      -12.36357      8.869500  186.8677 76.11813 121.0613 58.92439 65.80639       96.26034 
1 1 1 -2  11 31 o 209.4005 67.56207 10.50133       6.253711      16.11425       8.926463      5.090931       8.763943  248.2970 80.77094 178.0154 74.80553 70.28152       110.0900 
1 1 1 -2  11 32 o 240.3888 65.96649 14.33877       6.344707      3.244646       9.260427      24.15405       8.710355  167.5258 73.65698 306.1502 74.06596 -138.6244      104.4563 
1 1 1 -2  12 1  o 831.4399 13.35373 134.3990       4.311828      128.7520       5.913211      140.8110       6.300931  813.3005 18.72166 850.4958 19.07676 -37.19531      26.72870 
1 1 1 -2  12 2  o 1124.960 13.64104 246.0627       5.959539      248.1768       8.377236      243.8965       8.479822  1129.067 19.10527 1119.226 19.50927 9.840576       27.30610 
1 1 1 -2  12 3  o 610.0380 14.86224 72.38049       3.521026      73.04000       4.899752      71.67623       5.063236  612.3502 20.60375 606.5225 21.49578 5.827759       29.77555 
1 1 1 -2  12 4  o 367.2826 18.84121 26.33520       2.678384      29.56035       3.152879      17.97337       5.076716  388.9435 20.95065 298.6680 45.18057 90.27542       49.80174 
1 1 1 -2  12 5  o 648.2729 14.35366 81.74638       3.613671      84.17361       4.207051      74.91630       7.057268  657.6458 16.47243 618.8912 29.36259 38.75464       33.66753 
1 1 1 -2  12 6  o 807.5238 13.42817 126.8347       4.211144      126.4324       5.899522      127.2526       6.013015  805.5856 18.85720 808.1511 19.15895 -2.565491      26.88232 
1 1 1 -2  12 7  o 503.4649 17.75830 49.37685       3.472151      49.98442       4.328108      48.27979       5.815888  506.1194 22.01999 495.4171 30.37515 10.70224       37.51706 
1 1 1 -2  12 8  o 483.8456 16.66623 45.59861       3.131642      44.88747       4.391332      46.33457       4.467265  479.3174 23.59094 486.9784 23.62131 -7.661041      33.38411 
1 1 1 -2  12 9  o 269.2249 25.53454 14.30864       2.637820      16.34373       3.834118      12.47970       3.634745  285.9308 35.27637 248.4434 38.95265 37.48749       52.55218 
1 1 1 -2  12 10 o 328.2936 23.48728 21.17853       2.974712      20.53723       4.318975      21.75732       4.103080  320.8803 35.23871 331.0520 32.32686 -10.17169      47.82042 
1 1 1 -2  12 11 o 470.0512 21.76268 43.16162       3.972698      41.83532       7.270707      43.72612       4.743374  457.4644 41.37296 471.8170 25.98745 -14.35251      48.85764 
1 1 1 -2  12 12 o 756.0286 15.84364 111.3318       4.651800      113.5880       6.773087      109.3172       6.400031  762.3738 22.87656 748.0787 22.02961 14.29504       31.75910 
1 1 1 -2  12 13 o 386.3664 24.19362 29.29506       3.611879      25.85896       5.100429      32.75156       5.115542  360.2844 36.97726 406.9272 32.64514 -46.64276      49.32568 
1 1 1 -2  12 14 o 774.4365 16.51180 116.7900       4.966016      112.5926       6.946892      121.1766       7.101681  759.2756 23.55934 787.7536 23.21362 -28.47797      33.07438 
1 1 1 -2  12 15 o 694.6898 21.02224 94.09236       5.671500      91.99624       9.576607      95.22466       7.038581  683.2479 36.22088 698.1102 25.96170 -14.86230      44.56414 
1 1 1 -2  12 16 o 582.7239 23.73413 66.24451       5.371111      69.36366       9.209486      64.63667       6.612081  592.3884 40.27052 574.0922 29.75920 18.29620       50.07319 
1 1 1 -2  12 17 o 769.0246 18.25679 115.1242       5.452462      115.6285       7.595388      114.5879       7.831943  769.8058 25.40626 766.1984 26.32087 3.607422       36.58232 
1 1 1 -2  12 18 o 156.3667 55.47506 4.232934       4.223651      1.159816       5.703701      7.964108       6.284778  146.4315 60.84954 203.9320 67.84364 -57.50050      91.13410 
1 1 1 -2  12 19 o 644.3237 21.49829 80.86943       5.379427      82.01099       7.297614      79.51092       7.960907  648.0148 28.99799 636.8214 32.29538 11.19348       43.40363 
1 1 1 -2  12 20 o 126.9523 55.12539 -0.6545750     5.048415      1.711114       6.120986      -5.687397      8.927880  154.3875 63.48927 149.1591 68.32185 5.228348       93.26715 
1 1 1 -2  12 21 o 478.7500 31.42194 45.06754       5.809686      45.99501       7.093325      43.17749       10.12595  482.2567 38.18647 461.7758 57.72576 20.48090       69.21322 
1 1 1 -2  12 22 o 107.2242 49.85669 -4.315361      5.018643      4.529972       6.799931      -14.89785      7.437745  178.8652 69.05444 105.7550 51.99001 73.11027       86.43771 
1 1 1 -2  12 23 o 454.5386 33.37489 40.80287       5.850207      48.98413       7.795338      30.25359       8.851896  496.3008 40.80617 382.8349 61.63004 113.4659       73.91485 
1 1 1 -2  12 24 o 425.1043 41.75001 36.12181       6.803623      32.65529       7.697095      48.50705       14.54895  401.3167 50.50551 476.5201 81.54998 -75.20337      95.92292 
1 1 1 -2  12 25 o 424.1790 36.07445 35.79140       5.886189      41.52549       7.851434      28.43264       8.894446  454.2179 45.10647 367.9188 64.60708 86.29910       78.79510 
1 1 1 -2  12 26 o 417.6083 39.26065 35.01207       6.292539      27.77065       8.323977      44.66877       9.612426  362.9495 61.23417 465.7346 54.15668 -102.7851      81.74699 
1 1 1 -2  12 27 o 170.0264 67.74492 3.978264       6.722386      -7.378351      10.73494      11.30477       8.622313  155.1797 72.40873 230.5857 79.44245 -75.40604      107.4901 
1 1 1 -2  12 28 o 165.5007 67.82509 3.281360       6.955631      13.73827       11.02512      -3.632629      8.964911  247.1252 89.40002 150.1586 68.66341 96.96664       112.7254 
1 1 1 -2  12 29 o 349.3431 49.02811 25.86127       6.468443      30.45701       8.923464      20.77257       9.389867  369.0491 64.61608 293.0007 80.18700 76.04840       102.9815 
1 1 1 -2  12 30 o 131.5109 59.15785 -1.214344      6.330972      1.702646       8.696718      -4.502978      9.234123  163.9829 71.75638 144.4755 67.32771 19.50742       98.39715 
1 1 1 -2  12 31 o 273.4614 61.88972 17.66508       6.419409      25.36003       9.292021      10.63916       8.878896  314.6110 76.73714 207.9822 79.25176 106.6288       110.3151 
1 1 1 -2  12 32 o 478.7586 35.99966 47.93574       6.644343      52.61010       9.626998      43.68367       9.181840  483.6128 52.07970 436.6544 55.39137 46.95837       76.02960 
1 1 1 -2  13 1  o 718.2354 13.92797 100.3391       3.884924      90.48834       5.221725      112.5517       5.814118  681.4860 19.73009 760.0446 19.69776 -78.55859      27.87971 
1 1 1 -2  13 2  o 353.1676 20.55459 24.39299       2.806955      29.08444       3.898745      19.34411       4.044534  384.9475 26.23567 312.2353 33.89941 72.71225       42.86584 
1 1 1 -2  13 3  o 740.5055 14.38365 106.6817       4.136426      106.4308       5.727527      106.9552       5.980233  738.9776 19.95758 740.6796 20.79025 -1.701965      28.81909 
1 1 1 -2  13 4  o 133.6518 42.08065 3.491133       2.437516      4.865898       2.841634      -0.3375720     4.742200  155.0419 44.72329 124.4397 53.73032 30.60217       69.90794 
1 1 1 -2  13 5  o 848.0288 14.04279 139.9284       4.624789      139.0308       5.323188      142.6915       9.339945  845.0166 16.22104 853.7319 28.17052 -8.715332      32.50692 
1 1 1 -2  13 6  f 673.6452 20.05376 88.50935       5.246324      88.50935       5.246324      0.000000       0.000000  673.6452 20.05376 ?        ?        0.000000       20.05376 
1 1 1 -2  13 7  o 482.1939 18.67633 45.33264       3.497368      46.09407       4.342171      43.92637       5.900996  485.7143 23.01962 471.6592 32.41254 14.05505       39.75520 
1 1 1 -2  13 8  o 205.9372 33.48041 8.553661       2.585670      7.812032       3.601113      9.342907       3.714921  194.1101 48.03200 212.6606 46.29498 -18.55052      66.71056 
1 1 1 -2  13 9  o 634.3246 15.34278 78.36112       3.779582      79.09752       5.349868      77.62733       5.340416  636.3716 21.64733 630.4013 21.81373 5.970337       30.73183 
1 1 1 -2  13 10 o 359.2925 25.00492 25.38068       3.467261      30.47372       6.382534      23.24841       4.129776  389.5305 42.90278 342.5400 31.39396 46.99048       53.16229 
1 1 1 -2  13 11 o 165.5500 49.99327 5.538230       3.484489      -14.72487      6.233030      14.74965       4.202517  91.69411 45.53094 269.9276 41.41198 -178.2334      61.54689 
1 1 1 -2  13 12 f 590.8981 17.41006 68.02950       3.995222      66.50956       5.765790      69.43329       5.541101  583.1360 25.46015 596.0650 23.93726 -12.92902      34.94584 
1 1 1 -2  13 13 o 728.0923 16.71974 103.2303       4.727634      105.8845       6.832440      100.7922       6.548373  736.3030 23.89413 718.4526 23.46969 17.85046       33.49262 
1 1 1 -2  13 14 f 1205.758 17.85009 283.1245       8.358503      284.5730       14.55835      282.4122       10.20876  1205.291 31.10229 1203.373 21.84462 1.917236       38.00710 
1 1 1 -2  13 15 o 349.7590 33.75097 24.19246       4.527478      24.38528       7.438128      24.07897       5.706340  345.4743 57.45766 346.9166 43.29764 -1.442261      71.94490 
1 1 1 -2  13 16 o 649.0231 22.65240 82.10915       5.709557      86.47110       9.308426      79.47822       7.229193  663.0854 36.28514 637.7312 29.18933 25.35425       46.56853 
1 1 1 -2  13 17 o 1146.124 16.80004 255.5698       7.477735      262.4462       10.42900      248.2941       10.72755  1160.425 23.14181 1128.457 24.47867 31.96863       33.68603 
1 1 1 -2  13 18 o 250.8038 49.72044 12.83687       4.671696      15.83300       6.459094      9.550144       6.765075  276.8075 61.66460 219.7895 70.20273 57.01799       93.43953 
1 1 1 -2  13 19 o 851.9985 21.11266 141.4007       6.985698      142.6396       8.513330      138.8472       12.22215  855.0814 25.63681 841.4294 37.40262 13.65204       45.34537 
1 1 1 -2  13 20 f 743.9379 23.47811 107.9451       6.783095      120.1507       8.496103      86.48878       11.26465  784.1546 27.89909 660.7983 44.14968 123.3563       52.22599 
1 1 1 -2  13 21 o 335.4482 44.42922 22.61225       5.645493      17.70036       6.777106      33.74857       10.20448  291.7087 61.74734 403.7326 67.46382 -112.0239      91.45546 
1 1 1 -2  13 22 o 665.5436 24.69288 86.54720       6.382288      88.80274       8.656897      83.86140       9.446547  672.4899 33.14732 651.4715 37.49616 21.01837       50.04705 
1 1 1 -2  13 23 o 199.9962 69.60040 7.526052       6.626257      5.291346       7.480547      15.66790       14.27857  188.5691 72.53180 282.0239 101.7831 -93.45476      124.9826 
1 1 1 -2  13 24 o 534.4880 40.55260 56.91454       8.354791      56.91454       8.354791      0.000000       0.000000  534.4880 40.55260 ?        ?        0.000000       40.55260 
1 1 1 -2  13 25 o 262.3376 59.81730 14.58570       5.958948      13.95290       8.088095      15.33700       8.812934  254.4295 76.01710 265.6673 79.34474 -11.23787      109.8826 
1 1 1 -2  13 26 o 187.9919 65.41866 6.921597       5.853891      7.129674       7.965440      6.677238       8.631978  200.0451 75.33826 200.7062 77.71400 -0.6610565     108.2373 
1 1 1 -2  13 27 o 248.2417 72.42469 13.80676       7.414284      21.48121       11.77148      8.760145       9.545688  299.5215 92.17812 214.9666 82.11163 84.55495       123.4469 
1 1 1 -2  13 28 o 182.4745 66.70789 6.539383       6.161740      6.272930       8.117361      6.901661       9.465106  190.1378 74.85675 200.3621 80.19933 -10.22432      109.7063 
1 1 1 -2  13 29 f 271.3707 59.91121 16.55907       6.145054      16.66848       8.168456      16.41643       9.327206  262.6964 75.84047 257.3062 82.45750 5.390289       112.0313 
1 1 1 -2  13 30 o 345.0286 48.69555 25.81613       6.343487      31.40133       8.742161      19.60515       9.218904  368.6725 63.34155 274.7365 80.93241 93.93607       102.7726 
1 1 1 -2  13 31 o 123.5776 56.37123 -1.636028      5.996287      -1.665371      8.503923      -1.607012      8.456338  144.3597 66.32802 144.2310 66.22208 0.1286621      93.72710 
1 1 1 -2  14 1  o 194.8660 34.37844 7.679258       2.506561      9.873128       3.440569      5.197785       3.659145  219.9829 41.80117 162.4049 51.60498 57.57803       66.41093 
1 1 1 -2  14 2  o 828.1790 14.18478 133.4726       4.562205      133.3434       6.344640      133.6109       6.564858  826.9332 19.75644 827.6422 20.42466 -0.7089844     28.41625 
1 1 1 -2  14 3  o 212.5129 34.21815 9.098329       2.728163      10.62932       3.742906      7.363000       3.984860  227.9075 43.88076 188.9722 52.44649 38.93527       68.38242 
1 1 1 -2  14 4  o 433.7019 17.95876 36.65881       3.024793      42.33697       3.537241      21.20946       5.834668  465.9235 19.54889 323.0542 47.96255 142.8693       51.79349 
1 1 1 -2  14 5  f 733.0105 17.15176 104.6942       4.882551      104.6942       4.882551      0.000000       0.000000  733.0105 17.15176 ?        ?        0.000000       17.15176 
1 1 1 -2  14 6  f 125.9507 46.66732 2.503392       3.032055      2.503392       3.032055      0.000000       0.000000  125.9507 46.66732 ?        ?        0.000000       46.66732 
1 1 1 -2  14 7  f 651.0821 14.98282 82.54040       3.788413      79.54506       5.292476      85.68790       5.425242  638.2544 21.35193 662.4861 21.08698 -24.23175      30.00942 
1 1 1 -2  14 8  o 692.8140 14.96695 93.45952       4.026967      89.17030       5.569420      98.15862       5.829457  675.7941 21.22109 709.0456 21.17025 -33.25153      29.97522 
1 1 1 -2  14 9  o 402.3501 20.75869 31.67982       3.232582      32.19892       4.711854      31.21825       4.443097  403.9037 30.25892 397.9464 28.94806 5.957397       41.87592 
1 1 1 -2  14 10 o 842.7869 17.05501 138.3810       5.582102      141.1494       9.536905      136.9382       6.884639  848.5352 28.94074 837.6324 21.16410 10.90283       35.85366 
1 1 1 -2  14 11 f 184.5029 43.78972 7.008584       3.090579      1.409136       4.608232      11.58609       4.166544  134.6948 55.20404 237.6077 46.81823 -102.9128      72.38393 
1 1 1 -2  14 12 o 506.6087 22.40715 50.07921       4.408463      63.17430       8.012500      44.39410       5.279381  565.5613 36.67832 475.3979 28.73048 90.16333       46.59120 
1 1 1 -2  14 13 o 592.9263 20.99736 68.53053       4.834966      73.67160       8.582743      66.14059       5.851854  611.3733 36.31160 581.9092 25.89467 29.46411       44.59895 
1 1 1 -2  14 14 o 828.9864 19.27814 133.8407       6.206410      130.7525       10.59003      135.4564       7.659716  816.9393 33.37946 833.3456 23.66789 -16.40625      40.91891 
1 1 1 -2  14 15 f 352.9966 34.32329 24.63074       4.645798      31.25758       7.653824      20.76481       5.845911  394.3108 51.18946 320.8447 48.42401 73.46609       70.46449 
1 1 1 -2  14 16 o 607.8782 21.61670 71.98119       5.103099      68.15441       7.148437      75.95810       7.287311  589.6493 31.32928 623.5122 30.09500 -33.86292      43.44230 
1 1 1 -2  14 17 o 745.7816 19.63725 108.2776       5.687486      115.7464       7.910336      100.2846       8.183243  770.2694 26.44383 716.5843 29.40561 53.68512       39.54701 
1 1 1 -2  14 18 o 824.8951 21.51077 132.5532       6.891006      123.5025       8.119047      155.8693       13.03137  795.6074 26.27715 891.5652 37.63647 -95.95776      45.90199 
1 1 1 -2  14 19 o 109.0666 49.73671 -2.896919      4.663413      -6.549952      6.269417      1.627701       6.977364  115.4676 54.34326 162.4105 67.37990 -46.94289      86.56351 
1 1 1 -2  14 20 o 702.7318 24.64000 96.40855       6.724473      92.66706       8.030342      105.1892       12.30200  688.0605 30.05242 728.6188 43.67728 -40.55823      53.01747 
1 1 1 -2  14 21 o 199.3817 63.78610 7.918922       5.583216      5.296906       6.862885      13.05076       9.601203  184.7366 69.84712 253.8422 83.82629 -69.10561      109.1122 
1 1 1 -2  14 22 o 943.1741 23.74302 173.7740       8.696724      179.7057       10.18676      157.8295       16.70140  958.1938 27.37502 889.2286 48.54638 68.96527       55.73278 
1 1 1 -2  14 23 o 454.2302 41.91616 41.21769       7.310694      41.25935       8.221748      41.06034       15.97831  452.6997 47.47200 429.0294 98.04178 23.67023       108.9302 
1 1 1 -2  14 24 o 477.5357 35.27847 45.27315       6.496178      45.70678       8.570511      44.68764       9.959019  475.8650 46.98991 466.8088 56.05601 9.056152       73.14594 
1 1 1 -2  14 25 o 648.4561 27.18091 82.67837       6.844986      82.89144       9.327877      82.42975       10.07588  644.7119 37.41632 641.3909 40.66160 3.320923       55.25710 
1 1 1 -2  14 26 o 493.1993 41.53086 49.24458       7.880622      67.83598       12.78232      37.84484       10.00924  568.4927 58.74420 420.7366 63.21222 147.7561       86.29407 
1 1 1 -2  14 27 f 179.4382 66.27455 6.071238       6.105486      8.868669       8.324307      2.814241       8.982085  209.4024 77.37695 177.6042 75.23903 31.79822       107.9264 
1 1 1 -2  14 28 o 131.3419 58.25719 -0.7760372     5.916538      -1.969352      7.970835      0.6881858      8.829372  145.7296 65.88869 163.9129 71.99877 -18.18323      97.59684 
1 1 1 -2  14 29 o 516.2850 34.23990 54.31516       6.826193      51.51322       9.617078      57.16018       9.690735  488.7020 51.44498 517.5054 48.79455 -28.80334      70.90482 
1 1 1 -2  14 30 o 233.3759 64.94048 13.14655       6.101159      18.91162       8.552302      7.171781       8.706446  269.9099 77.50895 187.5696 76.26191 82.34023       108.7360 
1 1 1 -2  14 31 o 149.8089 62.44571 3.351980       6.033376      0.7110124      8.503410      6.029375       8.561854  152.3654 68.54764 177.1372 74.15945 -24.77177      100.9871 
1 1 1 -2  15 1  o 517.5649 18.86629 52.23151       3.792097      45.37608       4.611908      66.53999       6.662851  481.0604 24.77021 581.6833 29.59245 -100.6229      38.59114 
1 1 1 -2  15 2  o 302.2247 25.64346 17.99896       2.981376      24.01501       4.093420      11.20210       4.350960  348.4695 30.55633 232.6539 49.66691 115.8157       58.31374 
1 1 1 -2  15 3  o 243.7228 31.93158 11.86563       2.949644      7.831459       3.990874      16.72248       4.378932  194.3332 51.90031 288.0804 40.23893 -93.74715      65.67202 
1 1 1 -2  15 4  o 667.0106 22.19705 86.89976       5.749844      86.89976       5.749844      0.000000       0.000000  667.0106 22.19705 ?        ?        0.000000       22.19705 
1 1 1 -2  15 5  o 688.2512 17.94501 92.33488       4.796436      92.33488       4.796436      0.000000       0.000000  688.2512 17.94501 ?        ?        0.000000       17.94501 
1 1 1 -2  15 6  o 221.1268 35.97537 9.877213       2.983194      10.75142       3.434172      7.189002       6.022092  230.0135 39.89115 193.7786 66.41154 36.23491       77.47127 
1 1 1 -2  15 7  o 261.3559 30.91939 13.59180       3.077457      14.69997       3.560379      10.31774       6.119792  271.1570 34.59877 222.7463 66.02668 48.41064       74.54259 
1 1 1 -2  15 8  o 763.4545 20.95581 113.7387       6.213205      113.7387       6.213205      0.000000       0.000000  763.4545 20.95581 ?        ?        0.000000       20.95581 
1 1 1 -2  15 9  o 219.4028 40.17574 9.791945       3.297061      5.175909       5.511541      12.36438       4.114440  173.7856 63.15722 246.1472 44.68741 -72.36156      77.36794 
1 1 1 -2  15 10 o 875.8913 15.09632 149.3085       5.135105      149.5564       7.315364      149.0676       7.210051  875.5954 21.51317 874.2146 21.23696 1.380798       30.22954 
1 1 1 -2  15 11 o 868.8099 17.90637 147.0002       6.041717      158.7097       10.84125      141.7253       7.276389  900.1253 31.01333 852.4490 21.97958 47.67627       38.01221 
1 1 1 -2  15 12 o 578.1385 18.67984 65.09221       4.194046      59.16611       6.059578      70.54169       5.810793  549.4091 28.49787 601.1743 24.88898 -51.76520      37.83636 
1 1 1 -2  15 13 o 358.3664 31.67813 25.32222       4.363338      26.39279       7.474880      24.76888       5.373931  360.6278 55.12297 352.8186 39.92298 7.809143       68.06164 
1 1 1 -2  15 14 o 171.3902 54.48871 5.735945       4.079113      9.293503       6.978905      3.889913       5.027256  218.1829 71.43987 159.9593 59.92780 58.22363       93.24696 
1 1 1 -2  15 15 o 646.0005 22.50666 81.30843       5.646404      82.70779       9.642912      80.57829       6.965396  648.3257 38.47108 642.5087 27.91508 5.817017       47.53183 
1 1 1 -2  15 16 o 733.8542 22.08060 104.9087       6.292868      110.1728       7.812391      95.18267       10.61912  751.4751 26.76957 695.4807 39.47927 55.99445       47.69930 
1 1 1 -2  15 17 o 658.1964 24.90052 84.47906       6.364905      79.73977       7.683108      94.84718       11.36398  638.7289 30.97365 693.3904 42.40498 -54.66150      52.51237 
1 1 1 -2  15 18 o 641.3431 22.54843 80.17733       5.616099      82.65712       7.762741      77.45397       8.135062  650.1126 30.74670 628.0361 33.47480 22.07654       45.45242 
1 1 1 -2  15 19 o 393.6321 34.24735 30.61411       5.183176      27.17897       6.902887      35.05423       7.847955  367.1154 49.69450 417.8098 49.31781 -50.69437      70.01278 
1 1 1 -2  15 20 o 495.6789 32.48045 48.39232       6.217880      44.11207       7.546385      57.44210       10.97295  470.9585 41.69072 534.1099 53.62516 -63.15143      67.92477 
1 1 1 -2  15 21 o 605.3911 28.31366 71.75764       6.656716      68.49462       7.941127      79.46929       12.20804  589.2247 34.85856 629.6545 50.34576 -40.42981      61.23573 
1 1 1 -2  15 22 o 327.4036 55.28114 22.06029       6.778615      20.37427       7.688473      27.94584       14.36493  311.1296 65.69272 353.8917 100.0622 -42.76215      119.6995 
1 1 1 -2  15 23 o 518.6462 31.16932 53.07338       6.248932      62.94040       8.506849      41.50887       9.209571  562.4740 39.18863 451.2154 53.60541 111.2586       66.40248 
1 1 1 -2  15 24 o 418.9026 52.62823 36.03566       8.372709      36.03566       8.372709      0.000000       0.000000  418.9026 52.62823 ?        ?        0.000000       52.62823 
1 1 1 -2  15 25 o 220.4259 66.80515 10.43579       6.213883      14.13196       8.433169      6.045299       9.191197  252.8413 78.05486 199.6702 79.32157 53.17108       111.2855 
1 1 1 -2  15 26 o 369.7425 54.01831 28.83219       7.527696      28.03449       12.18892      29.32404       9.571082  341.9392 90.40940 363.4966 70.34335 -21.55740      114.5515 
1 1 1 -2  15 27 o 239.9740 65.07215 12.97381       6.217190      11.80965       8.381860      14.39772       9.269928  228.5119 78.34981 247.6848 82.39508 -19.17293      113.6998 
1 1 1 -2  15 28 o 143.7909 61.28912 1.468589       6.023724      0.8260621E-01  8.002190      3.280882       9.150484  153.3842 67.90653 176.0591 75.30328 -22.67488      101.3996 
1 1 1 -2  15 29 o 191.4502 66.85046 8.373405       6.115443      11.58991       8.854006      5.439055       8.456749  217.4061 79.89032 179.1824 74.24597 38.22369       109.0639 
1 1 1 -2  15 30 o 117.9766 54.68050 -2.891126      5.963109      -1.388536      8.382028      -4.430912      8.485138  144.6740 66.24280 135.0574 63.45455 9.616653       91.73106 
1 1 1 -2  16 1  o 222.9031 37.89058 10.06442       3.162613      7.731216       3.859675      14.83196       5.517236  193.2278 50.77260 267.2884 54.98606 -74.06061      74.84200 
1 1 1 -2  16 2  o 414.6794 22.73342 33.68615       3.647089      33.35640       4.572754      34.26258       6.045965  411.5498 28.79202 415.0271 37.93053 -3.477325      47.62044 
1 1 1 -2  16 3  o 534.3940 25.05116 55.84694       5.198971      55.84694       5.198971      0.000000       0.000000  534.3940 25.05116 ?        ?        0.000000       25.05116 
1 1 1 -2  16 4  o 446.6927 28.74601 39.26088       4.960233      39.26088       4.960233      0.000000       0.000000  446.6927 28.74601 ?        ?        0.000000       28.74601 
1 1 1 -2  16 5  o 414.3000 20.92488 33.57467       3.355816      31.67262       3.880864      39.21208       6.681246  401.7274 24.99926 444.0021 39.14827 -42.27463      46.44944 
1 1 1 -2  16 6  o 349.2146 24.57587 23.94876       3.311705      20.46781       3.814405      34.60586       6.674174  321.5850 30.92367 416.2944 41.84973 -94.70944      52.03531 
1 1 1 -2  16 7  o 688.7363 16.43367 92.36365       4.395572      88.57864       4.981321      105.6782       9.342750  674.1608 19.02624 733.7031 32.78886 -59.54230      37.90919 
1 1 1 -2  16 8  o 341.6740 35.02390 23.16947       4.581666      26.64414       6.169534      18.89690       6.841322  364.3855 44.52379 301.7115 60.49339 62.67401       75.11205 
1 1 1 -2  16 9  o 1019.560 17.43874 202.4028       6.904880      211.9020       12.39439      198.1279       8.314651  1040.227 30.68097 1008.068 21.23861 32.15875       37.31488 
1 1 1 -2  16 10 o 275.1818 32.58084 15.03679       3.414248      19.40167       5.245965      11.82922       4.497043  310.4570 44.80773 240.0716 49.86447 70.38535       67.03878 
1 1 1 -2  16 11 o 503.4287 23.17867 49.42029       4.531630      36.10985       7.716595      56.42715       5.598752  424.9644 47.57295 537.5514 26.81905 -112.5870      54.61178 
1 1 1 -2  16 12 o 1069.618 18.02209 222.6874       7.486207      222.8939       12.96032      222.5840       9.170879  1067.551 31.26072 1068.726 22.09615 -1.174927      38.28148 
1 1 1 -2  16 13 o 770.0799 34.61875 116.1013       10.35321      116.1013       10.35321      0.000000       0.000000  770.0799 34.61875 ?        ?        0.000000       34.61875 
1 1 1 -2  16 14 o 390.7484 54.61044 30.77257       8.060614      30.77257       8.060614      0.000000       0.000000  390.7484 54.61044 ?        ?        0.000000       54.61044 
1 1 1 -2  16 15 o 316.9730 41.21632 20.04424       4.953596      22.11180       6.152183      16.23288       8.352962  331.4052 49.30336 279.2482 75.30170 52.15698       90.00648 
1 1 1 -2  16 16 o 322.4906 35.88409 20.61581       4.417936      32.99222       6.441536      9.623211       6.070748  407.8402 41.23628 218.3092 66.00164 189.5310       77.82446 
1 1 1 -2  16 17 f 663.8957 30.50324 86.18437       7.864549      86.18437       7.864549      0.000000       0.000000  663.8957 30.50324 ?        ?        0.000000       30.50324 
1 1 1 -2  16 18 o 523.6472 26.68089 53.70339       5.407859      56.00381       7.571798      51.30815       7.726276  532.7540 36.82287 509.2284 39.37472 23.52557       53.91004 
1 1 1 -2  16 19 f 653.5211 23.35140 83.35725       5.926531      84.35809       8.131290      82.22305       8.656064  655.9782 31.91847 646.1912 34.61887 9.787048       47.08774 
1 1 1 -2  16 20 o 289.0808 56.89219 17.29303       6.159605      17.33030       7.655095      17.22460       10.37387  286.3547 69.53187 284.8212 86.31655 1.533508       110.8387 
1 1 1 -2  16 21 o 476.8152 42.31462 45.34605       7.754116      45.34605       7.754116      0.000000       0.000000  476.8152 42.31462 ?        ?        0.000000       42.31462 
1 1 1 -2  16 22 o 328.9960 49.10261 22.07353       6.081625      13.88522       7.891580      34.04838       9.543369  255.5203 74.76861 404.9237 62.71544 -149.4034      97.58878 
1 1 1 -2  16 23 f 565.8921 29.73887 63.16705       6.512691      63.98653       8.674476      62.10836       9.859597  566.1472 39.70475 555.0912 46.15543 11.05597       60.88342 
1 1 1 -2  16 24 o 177.2856 65.61456 5.534239       5.990612      8.562973       7.908219      1.456065       9.176582  210.0933 75.75974 176.2942 75.40740 33.79906       106.8916 
1 1 1 -2  16 25 o 269.2959 70.09946 16.16290       7.402481      17.18275       12.10586      15.55384       9.355301  272.7936 94.12383 261.4791 82.45387 11.31448       125.1317 
1 1 1 -2  16 26 o 443.7224 39.32148 40.07511       6.705749      41.21624       8.919674      38.59179       10.16948  442.0317 53.01763 419.9658 64.40827 22.06592       83.42239 
1 1 1 -2  16 27 o 96.70966 47.37006 -10.39477      6.001096      -8.025666      8.066886      -13.33058      8.980023  125.4866 59.80902 120.6992 58.86659 4.787399       83.91898 
1 1 1 -2  16 28 o 253.6688 63.08650 14.95614       6.188874      20.21124       8.763183      9.726857       8.741637  284.8377 77.26289 207.3544 78.72639 77.48329       110.3059 
1 1 1 -2  16 29 o 201.6616 66.86939 9.757849       6.107397      14.23609       8.851799      5.689070       8.437420  232.6109 80.47258 178.2613 74.03702 54.34964       109.3495 
1 1 1 -2  17 1  o 685.2118 16.08952 91.40529       4.281499      94.99457       5.981658      87.63453       6.131012  697.7407 22.07494 669.9389 23.56508 27.80176       32.28957 
1 1 1 -2  17 2  o 144.4350 51.65248 3.590400       3.668609      5.838352       4.161274      -4.252617      7.772744  172.2404 55.06398 141.4594 64.39335 30.78098       84.72630 
1 1 1 -2  17 3  o 938.1528 21.06054 171.6467       7.673105      171.6467       7.673105      0.000000       0.000000  938.1528 21.06054 ?        ?        0.000000       21.06054 
1 1 1 -2  17 4  o 356.1378 27.97057 24.96381       3.837422      22.93060       4.777036      28.66281       6.443315  339.5138 36.82053 378.0813 44.75128 -38.56747      57.95195 
1 1 1 -2  17 5  o 787.7394 18.23577 120.8701       5.578722      117.7363       6.839815      127.0976       9.642074  776.8002 22.67290 805.4501 30.82505 -28.64990      38.26544 
1 1 1 -2  17 6  o 286.7826 37.02345 16.42455       4.027137      16.34490       5.058427      16.56243       6.654963  283.6227 47.61190 281.9584 62.42448 1.664368       78.50929 
1 1 1 -2  17 7  o 478.9552 33.06071 45.17100       6.111781      43.96109       10.07352      45.87583       7.688572  466.2229 56.81122 480.7763 41.58845 -14.55341      70.40678 
1 1 1 -2  17 8  o 639.6651 37.29603 80.61417       9.224768      0.000000       0.000000      80.61417       9.224768  ?        ?        639.6651 37.29603 0.000000       37.29603 
1 1 1 -2  17 9  o 1505.913 22.97503 442.1438       13.43643      433.8480       18.47338      451.4620       19.57873  1488.902 31.94864 1518.350 33.20356 -29.44849      46.07811 
1 1 1 -2  17 10 o 593.6558 21.23840 68.65961       4.896485      72.78184       8.570388      66.66203       5.966061  608.2112 36.45232 584.4440 26.28553 23.76721       44.94109 
1 1 1 -2  17 11 o 743.7086 19.40571 107.6788       5.604803      118.4212       10.10097      102.8999       6.737093  777.9437 33.43390 726.5347 23.87746 51.40900       41.08477 
1 1 1 -2  17 12 o 264.4324 41.74903 14.05597       4.145070      28.82421       7.597800      7.797682       4.945967  378.3051 53.18391 197.1941 59.56458 181.1110       79.85279 
1 1 1 -2  17 13 o 256.9151 56.11552 13.56240       5.442140      13.55495       7.504442      13.57066       7.903771  256.3486 72.26757 256.9648 74.72205 -0.6161194     103.9518 
1 1 1 -2  17 14 o 204.1113 52.56798 8.542027       4.192246      8.405532       6.263306      8.652808       5.642619  207.9548 67.65819 207.9760 63.78862 -0.2120972E-01 92.98720 
1 1 1 -2  17 15 f 914.5671 17.55339 162.7573       6.234544      160.9653       8.894523      164.4881       8.741423  908.5071 25.20962 918.5037 24.50604 -9.996582      35.15780 
1 1 1 -2  17 16 o 346.2138 34.81556 23.71840       4.617610      16.40615       6.646642      30.54013       6.419836  281.3079 62.46727 391.6195 42.91437 -110.3116      75.78788 
1 1 1 -2  17 17 o 798.8694 28.30790 124.7648       8.782362      124.7648       8.782362      0.000000       0.000000  798.8694 28.30790 ?        ?        0.000000       28.30790 
1 1 1 -2  17 18 o 606.9528 24.69455 71.94005       5.820819      68.32882       8.221441      75.56969       8.242360  588.5585 36.14405 619.5094 34.39433 -30.95087      49.89351 
1 1 1 -2  17 19 o 267.9778 59.61060 14.96838       6.043498      18.60121       7.529258      8.388695       10.13286  297.4853 66.80598 225.2366 84.94067 72.24870       108.0646 
1 1 1 -2  17 20 o 781.7558 30.58067 119.8659       9.284234      119.8659       9.284234      0.000000       0.000000  781.7558 30.58067 ?        ?        0.000000       30.58067 
1 1 1 -2  17 21 f 511.1127 44.22178 52.28296       8.691221      52.28296       8.691221      0.000000       0.000000  511.1127 44.22178 ?        ?        0.000000       44.22178 
1 1 1 -2  17 22 o 571.4119 44.83902 65.57893       9.870351      0.000000       0.000000      65.57893       9.870351  ?        ?        571.4119 44.83902 0.000000       44.83902 
1 1 1 -2  17 23 o 258.4381 62.78569 14.35959       6.239262      13.43744       8.343180      15.52966       9.397997  248.7811 77.77554 265.3262 82.48009 -16.54510      113.3667 
1 1 1 -2  17 24 o 522.2730 40.08006 55.03029       8.067309      55.60820       13.12111      54.67905       10.22918  507.7903 68.26557 514.1792 51.93893 -6.388916      85.77785 
1 1 1 -2  17 25 o 345.4821 50.09866 25.03963       6.525630      24.53409       8.997554      25.60065       9.478483  329.5159 72.29699 335.2625 74.70964 -5.746643      103.9634 
1 1 1 -2  17 26 o 131.0985 58.21991 -0.8896345     5.926391      6.285184       8.143289      -8.968707      8.641221  189.2224 74.82335 128.8323 61.54108 60.39011       96.88054 
1 1 1 -2  17 27 o 219.6866 65.15967 11.17797       5.958766      17.46379       8.528235      5.182108       8.329224  266.1996 77.67827 180.2858 74.09132 85.91383       107.3473 
1 1 1 -2  17 28 o 178.1988 65.22071 6.904198       5.892521      9.593150       8.453958      4.363480       8.217633  203.0723 77.34368 171.6396 72.29755 31.43275       105.8725 
1 1 1 -2  17 29 o 147.7837 61.48228 3.101866       5.832526      2.200959       8.487121      3.908102       8.028822  159.7245 70.36207 165.3059 70.61620 -5.581421      99.68685 
1 1 1 -2  18 1  o 1176.630 17.74273 269.5350       8.107524      268.8202       9.701877      271.1896       14.76139  1174.397 21.27223 1176.678 32.30289 -2.281616      38.67796 
1 1 1 -2  18 2  f 134.4646 51.47211 2.495013       3.755965      4.107903       4.306697      -2.629220      7.676377  155.4685 55.92563 147.7278 65.89116 7.740677       86.42523 
1 1 1 -2  18 3  o 835.0827 15.94616 135.6940       5.171465      138.8418       7.250201      132.4336       7.378602  843.9028 22.12227 824.0560 23.05629 19.84680       31.95289 
1 1 1 -2  18 4  o 709.5990 17.29208 98.00867       4.765279      107.7859       6.720646      88.12321       6.757751  743.4300 23.27785 671.8632 25.89962 71.56683       34.82311 
1 1 1 -2  18 5  o 376.6970 24.12589 27.79099       3.510873      28.94019       4.102367      24.64535       6.787182  383.9278 27.70023 349.1270 51.61448 34.80084       58.57779 
1 1 1 -2  18 6  o 140.1849 61.47487 -1.291144      6.413533      0.000000       0.000000      -1.291144      6.413533  ?        ?        140.1849 61.47487 0.000000       61.47487 
1 1 1 -2  18 7  o 415.8487 37.82470 34.19957       6.041772      20.04519       9.487936      43.85387       7.835857  308.5903 78.87200 470.0952 43.41164 -161.5049      90.02979 
1 1 1 -2  18 8  o 778.4516 20.36658 118.0120       6.157122      130.3537       7.895334      98.85722       9.836051  817.5617 24.86692 709.4449 35.81625 108.1168       43.60238 
1 1 1 -2  18 9  o 184.1219 56.42810 6.745634       4.416541      7.328855       5.534119      5.722651       7.329358  194.7697 63.60910 192.6184 72.32103 2.151382       96.31432 
1 1 1 -2  18 10 o 340.5699 31.55146 22.85694       4.125650      25.64094       7.269108      21.53400       5.010917  356.1950 54.26368 328.9650 40.04936 27.23007       67.44256 
1 1 1 -2  18 11 o 595.0377 22.42402 68.96888       5.181864      68.85033       8.969010      69.02828       6.348671  591.3448 39.27834 594.8250 27.48310 -3.480103      47.93859 
1 1 1 -2  18 12 o 637.0994 27.60456 79.19238       6.829926      88.86921       9.538367      69.01015       9.784275  672.7109 36.64867 591.2465 42.90416 81.46436       56.42599 
1 1 1 -2  18 13 o 1917.181 18.09125 715.2275       13.46975      723.6120       19.31266      707.2855       18.79605  1926.275 25.81642 1904.547 25.41247 21.72766       36.22542 
1 1 1 -2  18 14 o 288.4442 39.44843 16.62281       4.303129      17.05368       6.375953      16.26237       5.831514  287.9149 59.00602 281.7951 55.26160 6.119873       80.84278 
1 1 1 -2  18 15 o 553.1143 23.13201 59.65143       4.968853      51.86244       7.255526      66.53102       6.818827  512.8774 36.66918 582.5211 30.24593 -69.64374      47.53362 
1 1 1 -2  18 16 o 183.8012 57.08486 6.733063       4.502884      11.39045       6.619933      2.722752       6.142874  234.9056 68.40679 160.9833 64.54822 73.92224       94.05297 
1 1 1 -2  18 17 o 781.0012 20.60947 118.9089       6.250957      118.1750       9.050578      119.5784       8.643818  776.8783 29.99821 781.8000 28.46964 -4.921753      41.35714 
1 1 1 -2  18 18 o 308.5179 44.85441 19.21826       5.216787      25.88479       7.459402      12.83617       7.298530  355.7741 55.82605 247.7749 71.73348 107.9992       90.89687 
1 1 1 -2  18 19 o 622.4689 29.17616 75.92038       7.052997      77.76578       8.523576      71.91286       12.56075  627.7875 35.10138 596.8076 54.80659 30.97992       65.08356 
1 1 1 -2  18 20 o 429.9708 50.63866 37.45216       8.293580      37.45216       8.293580      0.000000       0.000000  429.9708 50.63866 ?        ?        0.000000       50.63866 
1 1 1 -2  18 21 f 279.8629 56.77751 16.40002       5.959936      19.62974       8.155241      12.69775       8.731478  302.0890 70.75647 246.0379 79.87646 56.05101       106.7086 
1 1 1 -2  18 22 o 485.4350 35.08758 46.92942       6.570185      37.63690       8.905223      58.03017       9.733171  426.5767 55.03885 534.8428 47.34912 -108.2661      72.60313 
1 1 1 -2  18 23 o 365.2596 57.10059 28.12025       7.834538      20.44171       13.52680      31.99633       9.610631  295.1463 99.54088 384.9279 66.70719 -89.78165      119.8259 
1 1 1 -2  18 24 o 273.5270 68.66220 16.73794       7.282640      9.564057       12.36262      20.55046       9.012380  229.3113 91.70263 299.1891 77.08694 -69.87785      119.7989 
1 1 1 -2  18 25 o 157.5875 63.71999 3.321794       6.041147      11.28773       8.347376      -5.439270      8.754071  224.5643 78.12008 140.9455 65.63975 83.61882       102.0359 
1 1 1 -2  18 26 o 251.0146 60.24949 14.23847       5.798668      15.35014       8.396015      13.22461       8.018140  251.3518 77.93032 235.2497 76.55243 16.10208       109.2401 
1 1 1 -2  18 27 o 159.3953 62.47455 4.555016       5.631074      -0.1069799     8.559111      8.112884       7.477176  154.1342 69.10202 192.5448 72.88046 -38.41066      100.4323 
1 1 1 -2  18 28 o 113.0659 52.53430 -3.111050      5.555758      0.2085132      8.541355      -5.545532      7.314582  152.6320 68.68089 122.0141 57.80695 30.61784       89.77031 
1 1 1 -2  19 1  o 1197.036 18.02394 278.8681       8.378860      281.0906       10.07727      273.8906       15.08121  1201.202 21.60224 1183.202 32.82082 18.00073       39.29202 
1 1 1 -2  19 2  f 244.5860 46.56311 12.16856       4.261287      11.16159       7.672357      12.61776       5.124338  236.1344 74.69236 247.6699 54.73385 -11.53557      92.59991 
1 1 1 -2  19 3  o 1244.729 15.78794 301.3686       7.631819      302.8254       10.67375      299.8449       10.91639  1246.712 22.04565 1240.443 22.66074 6.268555       31.61518 
1 1 1 -2  19 4  o 799.8348 19.23293 124.5378       5.974117      119.5116       9.435365      127.9010       7.718307  781.9343 31.07137 809.9188 24.53876 -27.98450      39.59269 
1 1 1 -2  19 5  o 826.1353 24.00470 133.0381       7.701500      153.9649       12.54431      120.3785       9.756767  886.5154 36.43614 784.6699 32.01776 101.8455       48.50494 
1 1 1 -2  19 6  o 1197.018 18.17835 278.8278       8.450514      272.8765       10.25899      291.3882       14.90389  1183.528 22.32022 1221.069 31.42908 -37.54089      38.54840 
1 1 1 -2  19 7  o 1263.268 15.87024 310.3736       7.785868      314.2150       9.050936      299.4410       15.26911  1270.720 18.34068 1237.846 31.76283 32.87427       36.67776 
1 1 1 -2  19 8  f 1357.154 18.97212 358.4446       9.999376      362.2947       12.43008      351.3838       16.83338  1363.620 23.47214 1340.889 32.32588 22.73047       39.94876 
1 1 1 -2  19 9  o 234.3357 43.42981 11.12004       3.806798      10.54965       4.423488      12.74863       7.474530  226.8778 51.39596 249.5487 72.69323 -22.67094      89.02724 
1 1 1 -2  19 10 o 1244.532 16.36266 301.2473       7.908387      295.2991       8.977349      321.8574       16.71070  1231.865 18.76536 1283.036 33.53728 -51.17065      38.43030 
1 1 1 -2  19 11 f 1060.683 22.27583 219.1414       9.175875      219.1414       9.175875      0.000000       0.000000  1060.683 22.27583 ?        ?        0.000000       22.27583 
1 1 1 -2  19 12 o 557.9232 21.40457 60.62710       4.637767      63.39591       6.675707      58.04411       6.447814  568.8583 30.32742 544.1973 30.63361 24.66101       43.10650 
1 1 1 -2  19 13 o 666.2488 19.82419 86.43868       5.129321      90.10741       7.413477      83.06958       7.104306  679.2659 28.10309 652.2070 28.04841 27.05896       39.70513 
1 1 1 -2  19 14 f 136.1699 53.85688 2.093714       4.219844      -3.213423      6.227373      6.599708       5.738126  128.4839 58.15163 188.6339 64.81794 -60.14993      87.08029 
1 1 1 -2  19 15 o 211.2303 55.14683 9.217098       4.572496      10.91126       6.784892      7.807423       6.189074  230.8023 69.77521 201.3420 67.33409 29.46036       96.96628 
1 1 1 -2  19 16 o 812.5451 20.02859 128.6823       6.320127      129.2005       9.283364      128.2345       8.628534  812.4238 29.42353 809.8054 27.43648 2.618347       40.23064 
1 1 1 -2  19 17 o 532.1241 26.98574 55.51757       5.558426      47.38768       8.091881      62.78083       7.648451  487.7310 43.16682 564.1361 35.08472 -76.40506      55.62654 
1 1 1 -2  19 18 o 711.4283 26.82230 99.03265       7.410630      103.2006       9.233877      91.49013       12.42170  724.8792 32.80126 676.7564 47.56516 48.12274       57.77861 
1 1 1 -2  19 19 o 545.4055 40.96281 59.22333       8.612979      59.22333       8.612979      0.000000       0.000000  545.4055 40.96281 ?        ?        0.000000       40.96281 
1 1 1 -2  19 20 o 262.1992 64.49446 14.64095       6.521889      26.80981       8.194623      -6.385440      10.77176  358.1811 61.10361 161.6544 74.41319 196.5267       96.28590 
1 1 1 -2  19 21 o 630.8615 26.62877 78.18761       6.523988      79.37991       8.982818      76.85665       9.490746  631.3320 36.79710 619.9541 39.62687 11.37793       54.07693 
1 1 1 -2  19 22 o 408.4824 40.03081 33.70766       6.268714      38.20979       8.765619      28.99475       8.968462  428.7754 53.82742 367.0934 65.30229 61.68192       84.62730 
1 1 1 -2  19 23 o 548.2612 38.63514 60.66634       8.173556      68.77389       14.62675      56.98509       9.856011  562.4756 68.36575 525.3957 48.86445 37.07996       84.03339 
1 1 1 -2  19 24 o 568.3207 31.28841 64.59909       6.879054      76.47728       9.426656      51.06790       10.06122  613.1136 39.80568 491.4127 53.58887 121.7010       66.75522 
1 1 1 -2  19 25 o 187.3048 65.50980 7.485006       5.873761      8.435952       8.373966      6.563990       8.241130  202.0675 76.97309 189.7805 75.19936 12.28697       107.6095 
1 1 1 -2  19 26 o 265.3109 58.95717 16.02446       5.916960      10.43075       8.600281      21.05182       8.153290  211.4827 78.54894 295.2402 71.80141 -83.75748      106.4208 
1 1 1 -2  19 27 o 235.9259 60.48356 13.10058       5.567672      18.06448       8.235538      8.922021       7.556028  265.1160 76.03895 195.8476 73.45094 69.26834       105.7211 
1 1 1 -2  20 1  o 611.2595 20.89349 72.74398       4.959805      66.91665       7.817346      76.67017       6.416683  583.9176 34.62762 627.0498 26.35000 -43.13220      43.51315 
1 1 1 -2  20 2  o 925.6666 18.55737 166.7293       6.671126      155.0582       10.41111      174.8594       8.689384  891.1725 30.08204 947.3561 23.61825 -56.18359      38.24593 
1 1 1 -2  20 3  o 556.8343 23.46272 60.40748       5.073788      61.51073       8.001199      59.66546       6.561830  559.3199 37.04526 551.9077 30.73669 7.412292       48.13621 
1 1 1 -2  20 4  o 239.0640 52.12158 11.70250       4.702583      7.879895       8.276698      13.52477       5.714576  214.3970 77.47494 256.3434 58.67086 -41.94643      97.18351 
1 1 1 -2  20 5  o 1162.486 22.93664 263.2273       10.35489      263.7854       15.32872      262.7589       14.04357  1161.554 33.98120 1159.918 31.17614 1.635742       46.11588 
1 1 1 -2  20 6  o 645.0806 18.73089 80.97082       4.692459      81.68719       5.460719      78.94858       9.174776  647.6972 21.70950 633.9285 37.43328 13.76874       43.27301 
1 1 1 -2  20 7  o 718.7623 18.11080 100.5118       5.055347      96.57044       5.813981      112.7273       10.23545  704.2695 21.25723 759.2083 34.71508 -54.93878      40.70635 
1 1 1 -2  20 8  o 264.2068 39.55038 13.97607       3.933304      14.02560       4.551937      13.83009       7.814570  263.3497 46.19217 259.2332 73.97894 4.116455       87.21582 
1 1 1 -2  20 9  o 1305.993 16.44489 331.7500       8.340651      322.1021       9.440681      366.0634       17.80406  1286.516 18.89557 1368.251 33.50620 -81.73462      38.46697 
1 1 1 -2  20 10 o 721.7551 18.88978 101.3890       5.294742      100.8927       6.122739      102.8607       10.54364  719.6974 21.90624 723.5192 37.65438 -3.821838      43.56301 
1 1 1 -2  20 11 o 831.4061 20.36277 134.6151       6.574731      138.7494       7.939982      125.5964       11.72700  843.5640 24.23670 800.2360 37.73470 43.32800       44.84780 
1 1 1 -2  20 12 o 459.7269 25.51944 41.36932       4.538252      34.04787       6.373848      48.89747       6.463201  414.3268 40.11463 498.5647 33.57642 -84.23788      52.31214 
1 1 1 -2  20 13 o 527.4059 23.77014 54.26488       4.868608      51.12116       6.858066      57.45895       6.912762  509.3771 34.87838 540.5403 33.08960 -31.16321      48.07726 
1 1 1 -2  20 14 o 666.4896 21.27107 86.60238       5.505677      82.25431       7.946713      90.61607       7.635041  647.9804 31.57895 680.6083 28.88592 -32.62787      42.79750 
1 1 1 -2  20 15 o 1090.487 17.81985 231.5990       7.546621      233.5353       10.89344      229.8122       10.46454  1093.287 25.65683 1084.746 24.84072 8.540283       35.71182 
1 1 1 -2  20 16 o 446.9302 31.21826 39.34731       5.384433      43.40062       7.980145      35.95982       7.295328  466.1675 44.62521 423.8496 45.00927 42.31790       63.38173 
1 1 1 -2  20 17 o 137.8744 59.72427 -0.4475519     5.897504      9.552219       7.610639      -15.47687      9.330303  220.7124 74.66345 124.4848 60.55518 96.22767       96.13303 
1 1 1 -2  20 18 o 846.5466 30.96793 140.7633       10.18102      140.7633       10.18102      0.000000       0.000000  846.5466 30.96793 ?        ?        0.000000       30.96793 
1 1 1 -2  20 19 o 261.9599 64.75423 14.63331       6.550127      13.20839       7.938985      17.67134       11.59217  248.8533 75.53132 284.7622 91.99615 -35.90889      119.0305 
1 1 1 -2  20 20 o 382.0526 40.59400 29.41617       5.930735      26.93612       8.354088      31.93608       8.420962  356.7514 62.58048 391.6934 57.03325 -34.94199      84.67059 
1 1 1 -2  20 21 o 309.9431 51.61349 20.06265       5.994112      22.26387       8.346140      17.71780       8.614120  318.8014 69.38255 281.2280 76.73628 37.57339       103.4524 
1 1 1 -2  20 22 o 828.6072 27.19623 135.5905       8.751558      132.1561       15.25084      137.2766       10.68610  801.6613 49.22445 830.3811 33.13704 -28.71979      59.33894 
1 1 1 -2  20 23 o 126.1817 56.64524 -1.666384      5.771619      0.3667214      8.085535      -3.778577      8.241297  158.3803 69.24989 142.5467 65.42139 15.83360       95.26544 
1 1 1 -2  20 24 o 266.4372 60.49001 15.90039       6.116019      10.89268       8.670520      20.85952       8.628348  219.7757 79.31544 296.6084 74.89216 -76.83275      109.0861 
1 1 1 -2  20 25 o 310.1209 52.88836 21.08879       6.141207      29.87161       8.992056      13.41103       8.407354  358.8785 66.98201 233.5366 78.47684 125.3419       103.1756 
1 1 1 -2  20 26 o 228.9645 61.80764 12.37180       5.623976      4.284866       7.955497      20.45064       7.951511  169.4781 71.24768 288.0120 71.43729 -118.5339      100.8936 
1 1 1 -2  20 27 o 243.5710 59.90401 14.05949       5.627120      18.66626       8.037155      9.629951       7.881041  268.6384 74.45766 199.0286 74.94146 69.60983       105.6417 
1 1 1 -2  21 1  o 1113.557 18.44552 241.2480       7.976848      231.1337       12.67098      247.8880       10.26660  1088.238 29.98186 1128.108 23.43409 -39.87000      38.05349 
1 1 1 -2  21 2  o 428.1530 28.33094 35.91376       4.684103      35.28953       7.240655      36.36302       6.142598  421.5742 44.91757 429.4722 37.19622 -7.897949      58.31935 
1 1 1 -2  21 3  o 728.3177 27.34545 103.4461       7.734529      0.000000       0.000000      103.4461       7.734529  ?        ?        728.3177 27.34545 0.000000       27.34545 
1 1 1 -2  21 4  o 1106.577 24.25142 238.5908       10.42190      0.000000       0.000000      238.5908       10.42190  ?        ?        1106.577 24.25142 0.000000       24.25142 
1 1 1 -2  21 5  o 482.9234 35.29179 45.85873       6.572973      46.07130       10.43105      45.71875       8.465034  479.2628 57.17205 480.1054 45.96258 -0.8426208     73.35667 
1 1 1 -2  21 6  o 337.4475 30.75901 22.41991       3.986662      19.36989       4.623601      31.25900       7.871046  312.0335 39.00718 394.5921 52.67921 -82.55856      65.54890 
1 1 1 -2  21 7  o 663.3136 19.20496 85.63452       4.947208      81.06606       5.689986      99.78610       10.01448  645.0782 22.71281 712.9951 36.28698 -67.91681      42.80907 
1 1 1 -2  21 8  o 1015.180 16.61224 200.4848       6.549363      211.7586       7.762862      172.6414       12.19966  1043.016 19.16474 939.4244 33.43935 103.5913       38.54190 
1 1 1 -2  21 9  o 255.3765 43.50631 13.17799       4.160134      14.75976       4.887174      9.016188       7.927318  269.5414 48.46992 220.1398 76.15466 49.40152       90.27107 
1 1 1 -2  21 10 o 236.1392 48.06112 11.40164       4.257586      16.02018       5.009711      -0.6096253     8.078942  281.1402 47.58158 161.4950 69.92947 119.6452       84.58214 
1 1 1 -2  21 11 o 1347.188 17.23985 353.2661       9.019650      350.8203       10.35751      360.9413       18.34824  1341.984 19.87376 1356.718 34.82386 -14.73389      40.09573 
1 1 1 -2  21 12 o 482.9734 29.92159 45.81552       5.584601      57.88914       6.861443      22.12070       9.612217  542.5458 32.71807 323.1284 77.57923 219.4174       84.19625 
1 1 1 -2  21 13 o 577.5847 33.67095 65.66218       7.519891      0.000000       0.000000      65.66218       7.519891  ?        ?        577.5847 33.67095 0.000000       33.67095 
1 1 1 -2  21 14 o 541.2059 25.37886 57.22446       5.334117      48.37260       7.506772      66.25211       7.580937  493.9553 39.46193 580.0128 33.80211 -86.05753      51.95985 
1 1 1 -2  21 15 o 747.0743 21.26692 108.8712       6.170159      111.8740       8.940226      106.1400       8.526328  755.4932 30.47122 736.0205 29.82937 19.47272       42.64138 
1 1 1 -2  21 16 o 665.8986 46.46585 88.55592       11.94096      0.000000       0.000000      88.55592       11.94096  ?        ?        665.8986 46.46585 0.000000       46.46585 
1 1 1 -2  21 17 o 303.7924 67.51995 19.59756       7.759346      19.59756       7.759346      0.000000       0.000000  303.7924 67.51995 ?        ?        0.000000       67.51995 
1 1 1 -2  21 18 o 656.5184 37.86932 85.69588       9.614244      85.69588       9.614244      0.000000       0.000000  656.5184 37.86932 ?        ?        0.000000       37.86932 
1 1 1 -2  21 19 o 340.6376 52.06099 24.02333       6.668377      33.25594       8.663155      10.59924       10.44615  399.4106 57.50859 234.2884 86.65811 165.1222       104.0042 
1 1 1 -2  21 20 f 180.5143 64.50243 6.182529       5.719880      12.04752       7.969573      -0.4809457E-01 8.214239  235.7373 76.29158 160.4755 69.99207 75.26184       103.5340 
1 1 1 -2  21 21 o 402.1998 48.75028 33.52691       7.459033      36.91600       14.24505      32.24667       8.755246  391.0149 94.79266 388.3046 59.99236 2.710297       112.1817 
1 1 1 -2  21 22 o 299.2943 63.52926 19.84199       7.155755      12.60135       13.08290      22.93271       8.547632  243.2643 95.25999 317.7794 71.04536 -74.51512      118.8356 
1 1 1 -2  21 23 f 586.5410 28.38097 68.52616       6.464778      67.23489       8.987475      69.91058       9.305997  572.2280 40.70826 583.0359 41.36835 -10.80798      58.03881 
1 1 1 -2  21 24 o 287.2840 54.25106 18.22545       5.830828      23.45468       8.250135      13.00661       8.241940  315.7028 69.19975 231.1917 77.70092 84.51109       104.0482 
1 1 1 -2  21 25 o 204.6243 65.19256 9.893417       5.836767      4.360960       8.292701      15.32492       8.216693  172.1380 72.57362 244.9826 77.27583 -72.84464      106.0117 
1 1 1 -2  21 26 o 176.1906 63.63707 6.968155       5.583119      10.26418       7.989953      3.823162       7.804749  204.1613 75.73409 164.4350 69.91818 39.72636       103.0738 
1 1 1 -2  22 1  o 846.1729 20.37946 139.3875       6.696992      133.2139       7.681716      158.9425       13.67165  826.8242 23.92308 900.5135 39.09334 -73.68933      45.83233 
1 1 1 -2  22 2  o 318.3171 43.51300 20.26200       5.238198      -8.700540      8.428428      38.48907       6.686315  134.0799 63.07446 441.3799 39.42221 -307.3000      74.38076 
1 1 1 -2  22 3  o 680.6086 24.25571 90.28452       6.411202      67.39651       10.86099      102.5250       7.942651  582.8979 48.41697 724.8034 28.21742 -141.9055      56.03950 
1 1 1 -2  22 4  o 247.6580 52.56503 12.56790       4.899251      8.095578       7.283957      16.26274       6.620623  210.1775 72.98250 280.5837 62.37475 -70.40620      96.00549 
1 1 1 -2  22 5  o 518.5512 30.81859 52.73195       6.178375      61.54658       8.539918      43.05140       8.949552  558.6634 39.61881 464.2786 50.44759 94.38477       64.14522 
1 1 1 -2  22 6  o 707.4846 20.78274 97.48946       5.710152      89.32633       6.712293      118.8699       10.86302  676.6908 25.54187 778.8671 35.91363 -102.1763      44.07012 
1 1 1 -2  22 7  o 798.5535 24.62379 124.3807       7.636367      102.4367       9.928920      156.1579       11.94817  722.9789 35.36294 892.8542 34.45823 -169.8754      49.37517 
1 1 1 -2  22 8  o 438.4106 29.28006 37.73452       4.956510      38.08653       6.004858      36.98197       8.779982  439.3415 35.49753 428.4458 53.96510 10.89569       64.59339 
1 1 1 -2  22 9  o 680.7208 20.45482 90.28539       5.407452      90.92168       6.288450      88.47975       10.59332  682.7150 23.71790 669.2584 40.95481 13.45660       47.32690 
1 1 1 -2  22 10 o 125.9947 53.03954 0.4923318      4.418561      -2.601801      5.172152      8.850562       8.500783  117.6166 53.13609 220.8082 78.66257 -103.1916      94.92758 
1 1 1 -2  22 11 o 931.8630 20.34518 169.2414       7.362776      170.3197       8.854719      166.8254       13.25404  934.0704 24.40997 921.2628 37.04562 12.80762       44.36467 
1 1 1 -2  22 12 o 742.3213 21.47600 107.4585       6.191177      113.7050       7.276874      91.08368       11.78180  763.0915 24.55502 677.1136 45.06186 85.97784       51.31784 
1 1 1 -2  22 13 o 199.2542 62.59750 7.970170       5.397147      7.596681       6.638021      8.698665       9.270711  201.2244 69.68282 222.8196 81.76848 -21.59523      107.4327 
1 1 1 -2  22 14 o 522.4586 31.45643 53.74352       6.352721      58.97258       7.682298      42.43471       11.29764  546.1215 36.43119 453.0661 66.15993 93.05542       75.52727 
1 1 1 -2  22 15 o 329.6909 85.43470 23.71013       11.02804      0.000000       0.000000      23.71013       11.02804  ?        ?        329.6909 85.43470 0.000000       85.43470 
1 1 1 -2  22 16 o 763.0854 32.48894 114.6386       9.628013      114.6386       9.628013      0.000000       0.000000  763.0854 32.48894 ?        ?        0.000000       32.48894 
1 1 1 -2  22 17 o 168.4454 70.73493 1.831050       7.827281      1.831050       7.827281      0.000000       0.000000  168.4454 70.73493 ?        ?        0.000000       70.73493 
1 1 1 -2  22 18 o 301.3989 58.36640 19.22556       6.584926      17.29422       8.341747      22.41908       10.72661  279.8247 75.16456 314.4355 85.56070 -34.61081      113.8874 
1 1 1 -2  22 19 o 535.5737 30.56430 56.92895       6.330785      60.20446       9.107891      53.86704       8.805909  544.9534 43.39549 514.7542 44.48726 30.19922       62.14728 
1 1 1 -2  22 20 o 207.3145 70.81521 9.043624       6.846983      -4.337623      14.18653      13.10725       7.817807  187.4940 85.97028 241.8158 75.23615 -54.32178      114.2426 
1 1 1 -2  22 21 o 142.5051 62.37573 -0.1051935     6.575658      -11.94037      11.69433      5.366947       7.951823  148.3143 71.04767 184.0952 73.57250 -35.78082      102.2775 
1 1 1 -2  22 22 o 227.0858 62.73383 11.66525       5.715786      9.835097       8.070107      13.50745       8.096642  211.4984 76.49049 239.1993 76.84373 -27.70094      108.4240 
1 1 1 -2  22 23 o 164.5052 62.53043 5.118647       5.518898      5.055711       7.597405      5.188961       8.030379  175.2838 71.24995 178.3521 72.95953 -3.068329      101.9787 
1 1 1 -2  22 24 o 119.4022 54.33474 -1.830868      5.528290      1.990443       7.964654      -5.383458      7.679506  158.6254 69.05965 127.1444 59.93178 31.48098       91.43880 
1 1 1 -2  22 25 o 194.3888 64.54593 8.963704       5.689641      2.221473       8.186538      15.26316       7.913158  159.1527 69.63188 242.7312 75.72191 -83.57852      102.8708 
1 1 1 -2  23 1  o 916.8511 20.86952 163.7438       7.430863      162.7595       12.75653      164.2494       9.142075  911.2507 36.04679 917.5270 25.65653 -6.276306      44.24509 
1 1 1 -2  23 2  o 257.4369 55.07289 13.63402       5.339497      14.13430       8.886575      13.35137       6.679698  262.3642 79.97443 253.5305 66.87767 8.833694       104.2523 
1 1 1 -2  23 3  o 424.3733 36.48304 35.56982       5.954209      35.56982       5.954209      0.000000       0.000000  424.3733 36.48304 ?        ?        0.000000       36.48304 
1 1 1 -2  23 4  o 531.2206 24.77711 55.05318       5.111563      55.06929       6.809720      55.03239       7.736285  529.2840 33.29907 528.1418 37.97189 1.142151       50.50438 
1 1 1 -2  23 5  o 474.4150 27.30903 44.10253       5.010197      45.38728       6.717515      42.49188       7.521416  479.6557 36.33178 462.6970 42.32658 16.95871       55.78115 
1 1 1 -2  23 6  o 318.7981 39.18536 20.26822       4.749266      18.15352       5.716904      24.97800       8.531730  298.6784 51.12489 347.4498 65.63454 -48.77145      83.19644 
1 1 1 -2  23 7  o 950.8057 19.71065 176.1127       7.278145      169.4636       8.652700      192.1969       13.45773  931.9736 23.90672 989.8268 35.00940 -57.85321      42.39328 
1 1 1 -2  23 8  o 367.8376 35.97618 26.81112       5.073451      34.06805       6.306743      13.50215       8.540847  414.2361 39.68979 255.8255 78.48137 158.4106       87.94660 
1 1 1 -2  23 9  o 504.0941 34.72516 50.10046       6.756577      50.39311       9.536975      49.80555       9.573615  501.6849 49.59950 498.5697 50.12411 3.115143       70.51622 
1 1 1 -2  23 10 o 720.8537 23.09257 101.3969       6.464684      99.31784       7.769041      106.0770       11.65620  712.5915 28.07364 732.3085 41.15277 -19.71698      49.81646 
1 1 1 -2  23 11 o 752.5499 22.81668 110.5230       6.668309      106.8799       7.905172      119.5100       12.41608  739.1969 27.53741 777.0856 41.29039 -37.88867      49.63070 
1 1 1 -2  23 12 o 1192.461 20.48736 277.3107       9.487640      283.2538       11.63613      265.5231       16.38756  1203.936 24.88728 1161.475 36.33094 42.46082       44.03764 
1 1 1 -2  23 13 o 955.8387 22.00726 178.3688       8.169182      177.4753       9.884274      180.2945       14.51107  952.2209 26.72878 955.4340 39.10846 -3.213013      47.36982 
1 1 1 -2  23 14 o 362.9286 43.99306 26.54637       6.073899      19.04805       7.398032      42.05371       10.63905  300.0617 65.33783 450.8971 62.43235 -150.8354      90.37051 
1 1 1 -2  23 15 o 735.2991 26.19583 106.0062       7.480388      112.4790       9.191461      93.30981       12.87308  755.8549 31.31252 680.1106 49.06835 75.74432       58.20805 
1 1 1 -2  23 16 o 150.6057 66.14728 -0.9094346     7.450959      -0.9094346     7.450959      0.000000       0.000000  150.6057 66.14728 ?        ?        0.000000       66.14728 
1 1 1 -2  23 17 o 850.4824 25.36061 142.1213       8.376317      139.5039       10.26845      147.3268       14.48118  839.9519 31.47911 855.0522 43.75629 -15.10028      53.90313 
1 1 1 -2  23 18 o 462.2261 32.92945 42.63515       5.872440      46.18974       8.494613      39.38130       8.127326  474.9591 46.65533 437.2434 48.68951 37.71570       67.43432 
1 1 1 -2  23 19 o 144.3790 59.94063 1.829305       5.527194      3.439813       8.099979      0.4259652      7.561080  175.3804 72.66615 155.3015 67.44918 20.07889       99.14516 
1 1 1 -2  23 20 o 237.4824 70.31168 12.83146       6.942944      30.69704       12.96711      5.651280       8.220573  350.1732 93.56815 186.9725 74.77600 163.2006       119.7767 
1 1 1 -2  23 21 f 282.8882 52.42281 17.33461       5.547129      10.24992       7.566930      25.56482       8.155771  213.4068 74.37062 336.7305 64.71822 -123.3237      98.58720 
1 1 1 -2  23 22 o 232.4866 59.69945 12.33836       5.418033      19.35869       7.690824      5.421390       7.634004  285.3988 69.93614 177.5559 71.68723 107.8429       100.1505 
1 1 1 -2  23 23 o 164.3572 61.68978 5.430829       5.332044      -0.3517618     7.576238      11.10602       7.505556  145.1857 65.05721 213.8112 74.09341 -68.62560      98.60160 
1 1 1 -2  23 24 o 224.7490 59.64626 11.89475       5.292456      13.96711       7.380175      9.700725       7.593719  234.5806 73.11887 200.7985 73.95630 33.78209       103.9995 
1 1 1 -2  24 1  o 986.8870 21.28193 189.8145       8.156547      178.1451       13.43195      196.6313       10.26612  952.7375 36.30261 1003.472 26.34347 -50.73474      44.85374 
1 1 1 -2  24 2  o 217.7261 56.86949 9.793471       4.861133      10.74202       5.827363      7.623077       8.814767  228.0049 63.47398 214.3625 79.54142 13.64240       101.7634 
1 1 1 -2  24 3  o 595.2961 22.59430 69.10423       5.223479      64.53606       6.927788      75.12276       7.951872  573.3510 31.23104 618.2898 33.23887 -44.93884      45.60921 
1 1 1 -2  24 4  o 862.9995 19.12919 145.0641       6.411137      144.5549       8.633080      145.6901       9.573032  860.3914 25.83698 863.2270 28.55595 -2.835632      38.50963 
1 1 1 -2  24 5  o 441.1533 34.64028 38.40728       5.886983      32.74789       6.598928      60.47147       13.02965  405.4071 42.54798 545.7321 62.61200 -140.3250      75.70068 
1 1 1 -2  24 6  o 350.0627 33.18111 24.23422       4.457047      24.23003       5.174543      24.24625       8.773244  348.8694 38.85275 340.8512 68.65163 8.018158       78.88335 
1 1 1 -2  24 7  o 627.4737 21.76455 76.77970       5.303630      67.00951       6.008564      111.2428       11.28486  585.6014 26.42047 750.8276 38.83438 -165.2261      46.96968 
1 1 1 -2  24 8  o 445.2734 28.47643 38.94648       4.898466      35.89038       5.669866      47.94150       9.727249  426.1882 34.55399 488.1511 52.11626 -61.96292      62.53066 
1 1 1 -2  24 9  o 882.5500 21.20458 151.9129       7.267702      158.9626       8.904598      137.8469       12.57809  901.9269 25.42231 836.4067 38.72303 65.52026       46.32243 
1 1 1 -2  24 10 o 466.9107 39.79713 43.32701       7.147402      40.90915       10.05410      45.79738       10.16268  447.3922 59.32991 474.9099 56.19152 -27.51770      81.71613 
1 1 1 -2  24 11 o 257.7956 65.77778 14.03444       6.606970      19.09136       9.276623      8.828635       9.412186  297.8909 78.92496 223.2867 82.32192 74.60417       114.0441 
1 1 1 -2  24 12 o 440.0057 35.30114 38.40638       5.981402      40.19814       7.257294      34.61124       10.56205  448.2321 42.18750 405.4867 69.57777 42.74539       81.36861 
1 1 1 -2  24 13 o 449.3294 35.72503 40.13222       6.182510      53.46199       7.574968      13.53529       10.70004  518.2938 37.89642 256.4389 88.48951 261.8549       96.26283 
1 1 1 -2  24 14 o 618.1237 28.55700 75.13016       6.855134      80.08939       8.401830      65.25433       11.85641  635.6234 34.16188 564.4236 54.78026 71.19977       64.55936 
1 1 1 -2  24 15 o 189.9887 67.09686 6.925618       6.171937      16.69290       7.624047      -11.64664      10.51310  276.2612 70.75182 142.9240 68.16356 133.3372       98.24505 
1 1 1 -2  24 16 o 407.4276 36.71269 33.33434       5.746517      29.33713       8.142989      37.29993       8.110711  372.9363 58.11790 425.4164 50.04974 -52.48004      76.69855 
1 1 1 -2  24 17 o 504.4861 30.74954 50.63641       5.995668      62.11964       8.667249      40.09861       8.302798  554.2078 40.55146 440.2944 49.40985 113.9134       63.91991 
1 1 1 -2  24 18 o 722.6138 23.29610 102.7892       6.537589      115.4667       9.304352      90.42721       9.187842  761.6353 31.45655 671.0019 35.38343 90.63342       47.34449 
1 1 1 -2  24 19 o 175.2379 65.76350 5.739950       6.059045      3.507457       9.805070      7.119101       7.706578  184.2694 78.36004 193.1356 73.77740 -8.866226      107.6262 
1 1 1 -2  24 20 o 114.1987 52.63152 -3.052964      5.410648      -11.09633      7.576680      5.317545       7.729225  112.0623 54.52537 179.4433 72.24397 -67.38102      90.51080 
1 1 1 -2  24 21 o 120.1327 54.12098 -1.397354      5.322156      -4.272182      7.257000      1.948364       7.828813  128.1580 59.71105 159.4092 68.93244 -31.25121      91.19809 
1 1 1 -2  24 22 o 182.8304 61.82334 7.543178       5.218049      15.48602       7.193225      -1.278887      7.580899  251.0988 70.74114 141.2272 64.01814 109.8717       95.40771 
1 1 1 -2  25 1  o 800.4365 19.26364 124.8178       5.988159      121.6566       7.945914      128.9730       9.110011  789.1878 25.92600 811.9918 28.88945 -22.80396      38.81698 
1 1 1 -2  25 2  o 1439.906 17.53383 403.7014       9.804807      386.7321       13.00103      426.0813       14.93052  1407.697 23.78158 1476.841 26.03235 -69.14319      35.25970 
1 1 1 -2  25 3  o 643.4355 21.98998 80.74493       5.494876      82.44401       7.445764      78.71284       8.142791  649.0270 29.54055 632.6582 33.25853 16.36877       44.48341 
1 1 1 -2  25 4  o 203.9149 56.88580 8.563651       4.675362      13.46182       6.317592      2.632810       6.951726  253.6850 64.10003 167.6948 68.15899 85.99017       93.56528 
1 1 1 -2  25 5  f 584.5483 24.41036 66.72836       5.541440      79.01218       7.572865      52.56939       8.130359  635.0321 30.70694 514.6298 41.02129 120.4023       51.24121 
1 1 1 -2  25 6  o 670.8612 24.14083 87.89600       6.289452      87.89600       6.289452      0.000000       0.000000  670.8612 24.14083 ?        ?        0.000000       24.14083 
1 1 1 -2  25 7  o 225.4074 59.00923 10.59168       5.226103      10.59168       5.226103      0.000000       0.000000  225.4074 59.00923 ?        ?        0.000000       59.00923 
1 1 1 -2  25 8  o 684.2682 21.75938 91.39172       5.782304      95.98369       6.784432      79.20027       11.05456  700.6802 24.93249 629.9946 45.48906 70.68561       51.87373 
1 1 1 -2  25 9  o 462.9174 28.67187 42.17042       5.129143      38.65406       5.914958      52.82978       10.29843  441.7206 34.76157 510.8741 52.66238 -69.15347      63.10066 
1 1 1 -2  25 10 o 578.6771 24.99092 65.54586       5.616251      62.87971       6.523911      73.17772       11.03776  565.0704 29.83455 603.4987 47.47857 -38.42834      56.07419 
1 1 1 -2  25 11 o 363.6877 37.85246 26.46563       5.267931      30.70913       6.099055      14.00058       10.45315  391.1682 40.74673 258.6924 87.50266 132.4758       96.52467 
1 1 1 -2  25 12 o 1133.415 22.08809 251.3369       9.722440      259.4359       12.15974      236.9827       16.18825  1149.280 27.24397 1092.449 38.15668 56.83057       46.88460 
1 1 1 -2  25 13 o 355.2890 41.31461 25.53489       5.594066      25.30318       6.592676      26.13070       10.57177  350.5590 49.82773 342.2078 80.83548 8.351227       94.95882 
1 1 1 -2  25 14 o 741.6758 27.03164 108.3052       7.786001      108.3052       7.786001      0.000000       0.000000  741.6758 27.03164 ?        ?        0.000000       27.03164 
1 1 1 -2  25 15 o 257.0987 57.61212 14.20907       5.609784      21.45884       6.600904      -4.642592      10.64428  318.4538 55.38492 162.6604 74.54092 155.7934       92.86462 
1 1 1 -2  25 16 o 457.9958 31.77725 41.89636       5.617081      39.20707       8.136454      44.34516       7.764125  434.7728 49.04575 465.7750 43.42343 -31.00223      65.50633 
1 1 1 -2  25 17 o 178.5951 62.57487 6.441904       5.360381      10.52151       7.690789      2.587758       7.475253  218.9229 75.05070 164.8313 69.16689 54.09166       102.0621 
1 1 1 -2  25 18 o 497.4788 34.19767 49.99632       6.566790      57.90143       10.62605      45.11182       8.352716  521.7841 53.18226 464.5911 46.93816 57.19302       70.93337 
1 1 1 -2  25 19 o 106.0047 49.21187 -3.293042      4.858872      8.751882       6.462072      -18.96073      7.370079  198.5039 68.75240 93.74103 46.99812 104.7628       83.28094 
1 1 1 -2  25 20 o 193.3057 61.95059 8.491914       5.264755      12.19966       7.203917      4.241492       7.713115  224.9378 72.50697 170.2640 70.75771 54.67380       101.3110 
1 1 1 -2  25 21 o 165.2594 60.31947 5.701870       5.035229      14.41257       7.267266      -2.340736      6.983015  241.0990 72.06165 131.5681 60.32290 109.5309       93.97731 
1 1 1 -2  26 1  o 790.1516 26.86278 122.1463       8.243075      122.1463       8.243075      0.000000       0.000000  790.1516 26.86278 ?        ?        0.000000       26.86278 
1 1 1 -2  26 2  f 472.0748 27.44766 43.76242       5.010319      45.78560       6.586135      40.98314       7.719348  481.1257 35.49953 452.6528 44.48714 28.47293       56.91504 
1 1 1 -2  26 3  o 227.2719 54.23086 10.74621       4.719824      10.18617       6.234501      11.49812       7.223949  222.0903 66.82786 235.5826 72.16219 -13.49239      98.35316 
1 1 1 -2  26 4  o 633.1888 34.14395 79.08504       8.365014      0.000000       0.000000      79.08504       8.365014  ?        ?        633.1888 34.14395 0.000000       34.14395 
1 1 1 -2  26 5  o 189.2416 58.66720 7.246537       4.758433      12.00493       6.369724      1.237691       7.157906  238.8311 66.31741 160.4867 67.53077 78.34442       94.64884 
1 1 1 -2  26 6  o 166.5799 61.75955 4.564964       5.311937      -1.458967      6.505399      16.61692       9.201586  139.1015 61.42274 277.8548 80.57404 -138.7534      101.3160 
1 1 1 -2  26 7  o 130.0825 54.04151 1.031257       4.497108      1.503725       5.169273      -0.4393630     9.119966  141.2558 58.24703 169.6809 73.88559 -28.42511      94.08399 
1 1 1 -2  26 8  o 415.2298 36.91859 34.36446       5.891249      34.36446       5.891249      0.000000       0.000000  415.2298 36.91859 ?        ?        0.000000       36.91859 
1 1 1 -2  26 9  o 441.2048 30.55415 38.50061       5.203035      38.78621       5.920933      37.53245       10.90149  441.6565 34.80252 420.5338 69.15537 21.12271       77.41887 
1 1 1 -2  26 10 o 140.4614 56.64707 2.095991       4.760989      2.102704       5.496346      2.075816       9.528067  148.0829 60.44377 183.0434 77.51479 -34.96051      98.29543 
1 1 1 -2  26 11 o 388.6757 34.98246 30.18953       5.223812      34.63396       6.132498      18.43678       9.972388  415.3344 38.45637 286.4976 84.11182 128.8368       92.48616 
1 1 1 -2  26 12 o 145.5724 58.40395 2.499150       5.032361      3.087931       5.855844      0.8361723      9.841373  157.4533 63.06125 178.0713 77.14412 -20.61803      99.63904 
1 1 1 -2  26 13 o 636.9397 29.61923 80.23415       7.326559      80.23415       7.326559      0.000000       0.000000  636.9397 29.61923 ?        ?        0.000000       29.61923 
1 1 1 -2  26 14 o 184.5345 69.10684 6.213703       6.683914      8.821963       8.491421      1.965604       10.83683  211.1123 78.12170 187.5392 81.09883 23.57310       112.6056 
1 1 1 -2  26 15 o 470.9253 32.86322 44.46689       5.972539      49.16509       6.990879      31.77176       11.49171  493.3783 36.74927 368.0480 82.44603 125.3304       90.26548 
1 1 1 -2  26 16 o 284.4237 52.74772 17.40018       5.611828      22.80989       6.622976      3.628995       10.56700  325.7324 54.26489 189.2620 80.93558 136.4704       97.44355 
1 1 1 -2  26 17 o 406.2171 39.72602 33.98343       6.186808      23.91363       9.855575      40.53228       7.947932  313.1600 80.57262 438.8550 47.38631 -125.6950      93.47411 
1 1 1 -2  26 18 o 257.5726 58.96933 15.00045       5.771454      4.837541       8.870219      22.46165       7.600286  181.0802 75.61845 312.6469 64.72774 -131.5666      99.53809 
1 1 1 -2  26 19 o 232.9853 54.37807 12.21181       4.830501      16.70815       6.449204      6.465658       7.290642  267.7924 63.05577 181.1134 71.05760 86.67900       95.00112 
1 1 1 -2  26 20 o 267.1368 49.44735 15.71784       4.940919      14.93931       6.682688      16.65660       7.338262  248.2132 67.53022 259.8648 70.79214 -11.65158      97.83587 
1 1 1 -2  27 1  o 224.5060 54.70262 10.56288       4.725613      7.856317       6.127891      14.53415       7.422788  199.5352 66.99910 260.4984 71.29597 -60.96320      97.83658 
1 1 1 -2  27 2  f 709.6044 21.31804 98.37609       5.874779      91.72728       7.729905      107.4682       9.039301  683.4003 29.12534 739.0083 31.49615 -55.60803      42.89864 
1 1 1 -2  27 3  o 167.6701 58.82396 5.185482       4.737746      0.7626152      6.134914      11.72074       7.457409  146.6985 62.16570 236.1082 73.48499 -89.40971      96.25288 
1 1 1 -2  27 4  o 701.5547 32.71305 97.03060       8.912726      0.000000       0.000000      97.03060       8.912726  ?        ?        701.5547 32.71305 0.000000       32.71305 
1 1 1 -2  27 5  o 525.3174 27.09134 54.30854       5.508064      66.64796       7.497068      39.83609       8.119236  580.1476 33.41687 443.1130 47.94617 137.0345       58.44247 
1 1 1 -2  27 6  o 276.1264 53.40825 15.92242       5.520106      22.02532       6.811867      4.248518       9.421200  325.0044 55.99051 193.5796 79.08834 131.4248       96.90151 
1 1 1 -2  27 7  o 163.2148 57.42564 4.942831       4.516852      1.656570       5.136556      16.15034       9.485835  141.1599 58.11782 270.7726 82.64684 -129.6128      101.0355 
1 1 1 -2  27 8  o 247.3587 50.10128 12.79906       4.647885      9.826863       5.279178      23.04462       9.801570  214.9020 60.62373 321.5904 79.04161 -106.6884      99.61332 
1 1 1 -2  27 9  o 345.4067 38.05556 24.05313       5.020064      26.26744       5.783642      17.28871       10.10876  359.6664 42.20947 276.9888 85.44963 82.67761       95.30624 
1 1 1 -2  27 10 o 702.8155 29.04763 97.53227       7.928300      97.53227       7.928300      0.000000       0.000000  702.8155 29.04763 ?        ?        0.000000       29.04763 
1 1 1 -2  27 11 o 442.2376 31.64806 38.98320       5.399465      41.76301       6.254727      30.85236       10.69716  456.2860 35.57863 370.5891 76.84859 85.69696       84.68497 
1 1 1 -2  27 12 o 462.8437 36.57578 43.14899       6.520830      43.14899       6.520830      0.000000       0.000000  462.8437 36.57578 ?        ?        0.000000       36.57578 
1 1 1 -2  27 13 o 279.8605 60.10878 17.13959       6.337985      17.13959       6.337985      0.000000       0.000000  279.8605 60.10878 ?        ?        0.000000       60.10878 
1 1 1 -2  27 14 f 113.4039 52.24304 -3.178751      5.323420      0.9115630E-01  6.226839      -12.05921      10.26166  139.6905 60.93270 135.8915 65.47124 3.799026       89.43868 
1 1 1 -2  27 15 o 106.9745 50.54272 -5.216040      5.520327      -5.514325      6.459649      -4.408265      10.63012  116.9012 55.06157 158.2569 73.22878 -41.35576      91.62003 
1 1 1 -2  27 16 o 202.9991 68.04754 9.319894       6.321071      12.16613       7.852106      4.079066       10.65493  226.5254 75.84251 187.5685 80.76422 38.95683       110.7924 
1 1 1 -2  27 17 o 154.8253 63.50644 3.342583       6.104808      -3.176265      7.269034      18.94607       11.24610  132.1920 60.95220 265.6834 90.75652 -133.4914      109.3248 
1 1 1 -2  27 18 o 440.0455 30.82978 39.29756       5.235332      39.94762       7.135087      38.53939       7.705531  435.2376 42.76510 423.4688 47.68449 11.76874       64.05204 
1 1 1 -2  28 1  o 586.3672 24.25909 67.42473       5.524236      61.06003       7.183730      76.63496       8.641643  554.5889 33.51162 620.5071 36.01587 -65.91821      49.19524 
1 1 1 -2  28 2  o 208.5695 57.01986 9.209644       4.750872      4.869705       6.097344      15.91581       7.579421  173.2090 65.75278 269.9124 71.25888 -96.70340      96.96008 
1 1 1 -2  28 3  o 217.6116 56.30549 10.05668       4.794723      11.94282       6.295987      7.452415       7.398082  235.4415 66.13049 200.1289 73.10477 35.31261       98.57764 
1 1 1 -2  28 4  o 376.6545 36.54937 28.45181       5.278975      28.59616       6.932094      28.25254       8.144887  373.0170 49.04155 366.2761 59.28555 6.740906       76.94056 
1 1 1 -2  28 5  o 184.9413 59.65585 7.002604       4.875938      5.259142       6.390059      9.432560       7.543933  177.5768 67.33610 215.0468 74.29616 -37.47005      100.2700 
1 1 1 -2  28 6  o 515.2615 30.02625 52.62356       5.982332      58.48430       7.478503      42.20902       9.969160  541.0204 35.79598 448.4834 58.64240 92.53696       68.70432 
1 1 1 -2  28 7  o 373.6797 34.11820 27.97126       4.896626      27.39770       5.602480      29.82695       10.07728  367.7651 39.86496 367.4814 73.18377 0.2836609      83.33714 
1 1 1 -2  28 8  o 456.9849 29.38444 41.46787       5.187268      40.69075       5.952823      43.91976       10.57375  450.8882 34.25191 454.2895 61.51546 -3.401245      70.40842 
1 1 1 -2  28 9  o 247.3993 52.11694 13.03463       4.849238      14.96080       5.686089      7.897207       9.286224  263.4272 57.21845 208.6554 80.65751 54.77187       98.89178 
1 1 1 -2  28 10 o 272.9681 47.20645 15.62880       4.823189      18.62132       5.607061      7.114175       9.458008  297.0858 50.40012 203.7000 80.60916 93.38580       95.06844 
1 1 1 -2  28 11 o 153.8512 61.88299 3.134536       5.665473      3.134536       5.665473      0.000000       0.000000  153.8512 61.88299 ?        ?        0.000000       61.88299 
1 1 1 -2  28 12 o 153.6705 62.02275 3.157309       5.712322      3.157309       5.712322      0.000000       0.000000  153.6705 62.02275 ?        ?        0.000000       62.02275 
1 1 1 -2  28 13 o 155.1661 60.02476 4.038423       5.145862      2.678760       6.008627      7.779569       9.966946  151.9626 62.74377 204.5597 82.14980 -52.59714      103.3701 
1 1 1 -2  28 14 o 309.9649 47.19183 20.46137       5.501445      17.08177       6.412660      29.88323       10.70715  274.4536 61.66827 349.4376 80.55058 -74.98407      101.4464 
1 1 1 -2  28 15 o 280.8191 61.54700 18.02715       6.526887      20.50331       8.282077      13.96887       10.60281  291.1329 73.29967 236.3750 87.33022 54.75792       114.0149 
1 1 1 -2  28 16 o 106.4124 51.38587 -8.104959      6.407831      -14.99526      7.957958      4.599712       10.80598  105.8913 52.38010 186.9196 80.90694 -81.02828      96.38261 
1 1 1 -2  29 1  o 799.3876 20.29329 125.1559       6.299961      123.0465       8.543073      127.6705       9.327497  789.6344 27.85865 803.3585 29.89701 -13.72412      40.86485 
1 1 1 -2  29 2  o 1018.595 18.47506 202.9298       7.308281      199.9060       9.939765      206.4882       10.78254  1007.747 25.39782 1023.224 27.13454 -15.47632      37.16629 
1 1 1 -2  29 3  o 110.6051 51.99449 -5.303760      5.710237      -5.303760      5.710237      0.000000       0.000000  110.6051 51.99449 ?        ?        0.000000       51.99449 
1 1 1 -2  29 4  o 460.5559 29.27629 42.13696       5.209129      48.30700       6.862188      33.74670       8.002142  490.3670 36.29182 401.8962 52.52679 88.47079       63.84481 
1 1 1 -2  29 5  o 184.1937 58.08604 7.127245       4.642744      13.56554       6.220089      -0.9721093     6.976481  248.1544 64.09310 143.3492 63.43743 104.8052       90.17889 
1 1 1 -2  29 6  o 184.4177 61.18618 7.059144       5.113114      4.476583       6.308179      12.00583       8.730440  169.1220 66.16906 233.3513 79.96284 -64.22931      103.7902 
1 1 1 -2  29 7  o 410.6489 31.10201 33.73099       4.923255      30.45227       5.607812      44.75469       10.28265  387.3804 37.75579 457.1999 59.30968 -69.81955      70.30745 
1 1 1 -2  29 8  o 545.5253 24.91556 58.75969       5.278536      59.38164       6.084470      56.86741       10.61305  546.1894 28.78643 519.3783 53.37666 26.81110       60.64426 
1 1 1 -2  29 9  o 243.1462 52.07285 12.77094       4.768864      18.38822       5.519604      -3.768319      9.471154  293.9559 50.14952 152.6700 70.09170 141.2859       86.18481 
1 1 1 -2  29 10 o 126.5056 56.09959 -0.8117111     5.483455      -0.8117111     5.483455      0.000000       0.000000  126.5056 56.09959 ?        ?        0.000000       56.09959 
1 1 1 -2  29 11 o 350.3323 45.47457 25.80687       6.041020      25.80687       6.041020      0.000000       0.000000  350.3323 45.47457 ?        ?        0.000000       45.47457 
1 1 1 -2  29 12 o 120.2603 53.57591 -0.9002546     5.058817      -0.2996560E-01 5.993388      -3.056512      9.433893  134.9057 59.28688 152.0504 69.86128 -17.14474      91.62714 
1 1 1 -2  29 13 o 184.3634 61.47638 7.526573       5.159366      7.615002       5.869621      7.226080       10.82010  186.4278 65.47076 200.5972 83.62151 -14.16933      106.2025 
1 1 1 -2  29 14 o 254.6108 74.80457 16.05853       7.884999      16.05853       7.884999      0.000000       0.000000  254.6108 74.80457 ?        ?        0.000000       74.80457 
1 1 1 -2  30 1  o 530.3396 24.51727 55.48631       5.049566      53.93747       6.634924      57.61826       7.784335  518.5795 33.11811 533.5027 37.81639 -14.92322      50.26817 
1 1 1 -2  30 2  o 235.8585 51.81073 11.96704       4.615958      15.79964       6.102753      6.842865       7.056525  268.0354 60.11048 189.3785 70.99008 78.65694       93.02076 
1 1 1 -2  30 3  o 477.3745 27.69665 45.32759       5.112622      45.43880       6.794840      45.18246       7.761973  473.4700 37.25470 468.8369 43.11376 4.633118       56.97990 
1 1 1 -2  30 4  o 101.7155 47.45235 -3.697696      4.606743      -7.551463      6.006863      1.805883       7.178400  105.4397 50.61759 157.6588 67.04584 -52.21910      84.00764 
1 1 1 -2  30 5  o 239.5930 52.84101 12.45452       4.784594      12.81306       6.285029      11.96035       7.378658  237.8939 65.80980 228.8409 73.34089 9.052979       98.53840 
1 1 1 -2  30 6  o 153.5827 59.72933 3.811501       5.116388      5.062553       6.383824      1.564669       8.555166  171.4663 66.70900 166.1930 71.96239 5.273315       98.12582 
1 1 1 -2  30 7  o 118.1032 51.27126 0.2035067E-01  4.365189      3.709875       5.142339      -9.494550      8.258053  152.5605 59.72779 123.3100 59.23711 29.25050       84.12160 
1 1 1 -2  30 8  o 370.0246 34.29260 27.84530       4.871858      27.07569       5.630506      30.13795       9.718039  361.4955 40.82173 359.7855 72.06384 1.709961       82.82277 
1 1 1 -2  30 9  o 152.2334 61.22033 3.390566       5.543612      3.390566       5.543612      0.000000       0.000000  152.2334 61.22033 ?        ?        0.000000       61.22033 
1 1 1 -2  30 10 o 363.8371 42.10960 27.68994       5.840024      27.68994       5.840024      0.000000       0.000000  363.8371 42.10960 ?        ?        0.000000       42.10960 
1 1 1 -2  30 11 o 286.8214 46.38167 17.64120       4.990030      20.27905       5.864862      10.72440       9.496986  304.8369 51.36688 215.2918 81.98131 89.54518       96.74446 
1 1 1 -2  31 1  o 419.4821 29.78058 35.32713       4.819955      34.42470       6.359085      36.54561       7.389204  408.3985 40.63380 417.2700 46.38363 -8.871521      61.66479 
1 1 1 -2  31 2  o 163.0514 57.11596 5.394685       4.465798      -0.2008606     5.796622      13.56559       7.004690  132.6381 58.29758 240.8779 70.43001 -108.2398      91.42754 
1 1 1 -2  31 3  o 271.8250 45.59848 15.68200       4.643111      15.51914       6.182323      15.89272       7.032161  261.8118 61.79764 261.2065 68.48375 0.6052551      92.24409 
1 1 1 -2  31 4  o 122.8531 53.02602 0.3615469      4.615314      -3.256476      6.064012      5.342957       7.115420  120.6949 55.65812 175.8962 69.81883 -55.20129      89.28883 
1 1 1 -2  31 5  o 306.4090 42.18074 19.66891       4.886250      16.01928       6.471129      24.50980       7.452785  264.1960 63.79256 331.1900 60.16056 -66.99402      87.68571 
1 1 1 -2  31 6  o 181.5494 61.13465 7.179777       5.102233      9.079871       6.499383      4.128130       8.236670  200.7124 68.98279 174.1843 72.81435 26.52805       100.3023 
1 1 1 -2  31 7  o 153.1814 56.55639 4.494786       4.445415      8.156592       5.208963      -5.321784      8.528712  190.7920 61.67162 136.5278 63.97603 54.26416       88.86124 
1 1 1 -2  31 8  o 346.2036 41.88042 25.14135       5.516308      25.14135       5.516308      0.000000       0.000000  346.2036 41.88042 ?        ?        0.000000       41.88042 
1 1 1 -1  0  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -1  0  2  o 234.4647 20.68777 10.95355       1.849999      10.95355       1.849999      10.95355       1.849999  234.4647 20.68777 234.4647 20.68777 0.000000       0.000000 
1 1 1 -1  0  3  o 135.2632 33.58045 4.165937       1.526610      4.165937       1.526610      4.165937       1.526610  135.2632 33.58045 135.2632 33.58045 -0.000000      0.000000 
1 1 1 -1  0  4  o 1537.290 19.40294 460.1316       11.57965      460.1316       11.57965      460.1316       11.57965  1537.290 19.40294 1537.290 19.40294 0.000000       0.000000 
1 1 1 -1  0  5  o 192.2730 22.56001 7.486711       1.623879      7.486711       1.623879      7.486711       1.623879  192.2730 22.56001 192.2730 22.56001 -0.000000      0.000000 
1 1 1 -1  0  6  o 42.10205 28.86004 -1.018930      1.510795      -1.018930      1.510795      -1.018930      1.510795  42.10205 28.86004 42.10205 28.86004 0.000000       0.000000 
1 1 1 -1  0  7  o 221.7097 25.74463 9.942767       2.138714      9.942767       2.138714      9.942767       2.138714  221.7097 25.74463 221.7097 25.74463 -0.000000      0.000000 
1 1 1 -1  0  8  o 305.8362 22.51944 18.47890       2.641363      18.47890       2.641363      18.47890       2.641363  305.8362 22.51944 305.8362 22.51944 -0.000000      0.000000 
1 1 1 -1  0  9  o 87.40602 49.03654 1.997783       2.510890      1.997783       2.510890      1.997783       2.510890  87.40602 49.03654 87.40602 49.03654 -0.000000      0.000000 
1 1 1 -1  0  10 o 1708.382 21.80305 567.6204       14.46008      567.6204       14.46008      567.6204       14.46008  1708.382 21.80305 1708.382 21.80305 -0.000000      0.000000 
1 1 1 -1  0  11 o 338.9732 26.86446 22.76896       3.485388      22.76896       3.485388      22.76896       3.485388  338.9732 26.86446 338.9732 26.86446 0.000000       0.000000 
1 1 1 -1  0  12 o 1042.356 19.04573 211.4102       7.703972      211.4102       7.703972      211.4102       7.703972  1042.356 19.04573 1042.356 19.04573 0.000000       0.000000 
1 1 1 -1  0  13 o 469.7034 24.05803 43.26161       4.362178      43.26161       4.362178      43.26161       4.362178  469.7034 24.05803 469.7034 24.05803 -0.000000      0.000000 
1 1 1 -1  0  14 o 706.0408 29.99091 97.69553       8.189580      97.69553       8.189580      97.69553       8.189580  706.0408 29.99091 706.0408 29.99091 -0.000000      0.000000 
1 1 1 -1  0  15 o 390.1320 43.26825 30.91350       6.349404      30.91350       6.349404      30.91350       6.349404  390.1320 43.26825 390.1320 43.26825 0.000000       0.000000 
1 1 1 -1  0  16 o 111.2505 62.64839 3.318016       4.119082      3.318016       4.119082      3.318016       4.119082  111.2505 62.64839 111.2505 62.64839 -0.000000      0.000000 
1 1 1 -1  0  17 o 131.2485 68.34970 5.038376       4.540348      5.038376       4.540348      5.038376       4.540348  131.2485 68.34970 131.2485 68.34970 0.000000       0.000000 
1 1 1 -1  0  18 o 568.8609 38.66531 64.29411       8.451329      64.29411       8.451329      64.29411       8.451329  568.8609 38.66531 568.8609 38.66531 -0.000000      0.000000 
1 1 1 -1  0  19 o 176.8690 87.18380 9.308588       7.164827      9.308588       7.164827      9.308588       7.164827  176.8690 87.18380 176.8690 87.18380 -0.000000      0.000000 
1 1 1 -1  0  20 o 1373.141 22.98523 367.3716       12.24947      367.3716       12.24947      367.3716       12.24947  1373.141 22.98523 1373.141 22.98523 -0.000000      0.000000 
1 1 1 -1  0  21 f 682.1987 27.79472 91.11458       7.336006      91.11458       7.336006      91.11458       7.336006  682.1987 27.79472 682.1987 27.79472 -0.000000      0.000000 
1 1 1 -1  0  22 o 512.7352 34.04348 51.94281       6.710263      51.94281       6.710263      51.94281       6.710263  512.7352 34.04348 512.7352 34.04348 -0.000000      0.000000 
1 1 1 -1  0  23 o 1148.212 24.32990 256.9139       10.83803      256.9139       10.83803      256.9139       10.83803  1148.212 24.32990 1148.212 24.32990 -0.000000      0.000000 
1 1 1 -1  0  24 o 767.7155 28.76372 115.3184       8.548450      115.3184       8.548450      115.3184       8.548450  767.7155 28.76372 767.7155 28.76372 -0.000000      0.000000 
1 1 1 -1  0  25 o 896.7007 28.06060 157.2018       9.750086      157.2018       9.750086      157.2018       9.750086  896.7007 28.06060 896.7007 28.06060 -0.000000      0.000000 
1 1 1 -1  0  26 o 518.5625 41.29243 53.69961       8.194423      53.69961       8.194423      53.69961       8.194423  518.5625 41.29243 518.5625 41.29243 -0.000000      0.000000 
1 1 1 -1  0  27 o 179.7579 90.10089 9.708312       7.705921      9.708312       7.705921      9.708312       7.705921  179.7579 90.10089 179.7579 90.10089 -0.000000      0.000000 
1 1 1 -1  0  28 o 253.4786 90.62797 17.12256       8.146873      17.12256       8.146873      17.12256       8.146873  253.4786 90.62797 253.4786 90.62797 -0.000000      0.000000 
1 1 1 -1  0  29 o 493.2363 48.13969 49.58367       9.019527      49.58367       9.019527      49.58367       9.019527  493.2363 48.13969 493.2363 48.13969 -0.000000      0.000000 
1 1 1 -1  0  30 o 231.8178 114.9148 17.83908       12.47630      17.83908       12.47630      17.83908       12.47630  231.8178 114.9148 231.8178 114.9148 -0.000000      0.000000 
1 1 1 -1  0  31 o 254.0191 116.5517 21.47705       12.57422      21.47705       12.57422      21.47705       12.57422  254.0191 116.5517 254.0191 116.5517 -0.000000      0.000000 
1 1 1 -1  0  32 o 281.5967 116.7438 25.86700       12.70158      25.86700       12.70158      25.86700       12.70158  281.5967 116.7438 281.5967 116.7438 -0.000000      0.000000 
1 1 1 -1  0  33 o 114.5845 76.10076 0.1325013      9.014956      0.1325013      9.014956      0.1325013      9.014956  114.5845 76.10076 114.5845 76.10076 -0.000000      0.000000 
1 1 1 -1  0  34 o 172.4577 105.0381 12.34847       13.22267      12.34847       13.22267      12.34847       13.22267  172.4577 105.0381 172.4577 105.0381 -0.000000      0.000000 
1 1 1 -1  1  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 -1  1  2  o 236.4101 14.28206 10.92332       1.305092      10.03050       1.808547      11.89342       1.885197  225.6383 20.87560 246.0062 19.90306 -20.36792      28.84307 
1 1 1 -1  1  3  o 420.8031 13.93001 34.47318       2.276450      36.40779       3.276820      32.66849       3.164871  431.9095 19.53583 409.0875 19.92103 22.82202       27.90155 
1 1 1 -1  1  4  o 1202.748 12.10232 281.3801       5.652901      292.7722       8.299731      271.5226       7.720480  1225.724 17.43586 1180.545 16.83968 45.17883       24.24013 
1 1 1 -1  1  5  o 648.2593 10.58296 81.68877       2.664306      77.18803       3.685756      86.61434       3.855788  629.8003 15.06939 667.1669 14.88163 -37.36664      21.17899 
1 1 1 -1  1  6  o 852.4675 11.25864 141.2481       3.727277      133.1003       5.080871      150.7421       5.484577  827.1182 15.81767 880.2033 16.04472 -53.08514      22.53069 
1 1 1 -1  1  7  o 1156.652 12.41464 260.0173       5.576540      255.1646       7.743165      265.2465       8.037927  1145.300 17.40890 1167.668 17.72543 -22.36816      24.84473 
1 1 1 -1  1  8  o 857.1663 11.89826 142.7698       3.960740      144.3271       5.607932      141.2198       5.594756  861.5278 16.76121 852.1929 16.90500 9.334900       23.80582 
1 1 1 -1  1  9  o 1807.333 15.74841 634.9977       11.05358      643.5074       15.90839      627.0544       15.36976  1818.314 22.52835 1795.007 22.04819 23.30701       31.52221 
1 1 1 -1  1  10 o 589.4597 13.27421 67.52456       3.038721      70.47128       4.396590      64.82954       4.204635  601.9360 18.80779 577.3415 18.75286 24.59448       26.55942 
1 1 1 -1  1  11 o 417.1860 16.34683 33.84146       2.648447      35.38980       3.839275      32.43571       3.658220  425.6911 23.31204 407.4911 23.21267 18.20001       32.89801 
1 1 1 -1  1  12 o 948.9310 13.37740 175.0340       4.929858      174.3293       7.021445      175.7190       6.923334  946.5043 19.10187 950.3053 18.75962 -3.800964      26.77321 
1 1 1 -1  1  13 o 1416.444 14.66080 390.1627       8.064638      388.7862       11.40277      391.5404       11.40747  1412.878 20.78153 1417.887 20.71667 -5.009155      29.34369 
1 1 1 -1  1  14 o 569.7160 18.41879 63.21024       4.075188      65.79127       5.139324      58.83885       6.688348  580.7806 22.78588 547.2200 31.60689 33.56061       38.96399 
1 1 1 -1  1  15 o 506.3087 20.47141 50.00085       4.025234      59.39447       7.268876      45.84624       4.834104  548.5807 34.29124 483.5022 25.83835 65.07855       42.93611 
1 1 1 -1  1  16 o 108.7510 44.25034 0.9840862      2.934176      -0.8310876E-01 4.236070      1.968338       4.068126  118.8535 51.04611 132.4927 52.72848 -13.63921      73.38935 
1 1 1 -1  1  17 o 323.4801 27.64593 20.66501       3.439659      16.58658       4.855760      24.77264       4.873112  285.2536 45.35069 352.4634 36.11096 -67.20984      57.97142 
1 1 1 -1  1  18 o 973.6996 17.90893 184.8188       6.772088      184.2358       11.90975      185.0973       8.232519  968.1501 31.67611 973.5248 21.77498 -5.374634      38.43859 
1 1 1 -1  1  19 o 1182.073 18.16852 272.2793       8.340496      266.9676       10.05488      283.9959       14.93348  1169.491 22.13868 1202.819 31.96926 -33.32800      38.88643 
1 1 1 -1  1  20 o 463.8577 23.86360 42.10453       4.284251      40.12475       6.007089      44.15405       6.111965  450.8636 34.57096 473.3148 33.46660 -22.45111      48.11615 
1 1 1 -1  1  21 o 541.4868 21.98191 57.15133       4.622547      43.96344       6.412497      71.41801       6.669620  472.2464 35.21803 604.5422 28.40838 -132.2958      45.24760 
1 1 1 -1  1  22 o 636.9320 20.80917 79.01265       5.147257      79.38201       7.221230      78.63116       7.338837  637.4918 29.16813 634.3892 29.78815 3.102661       41.69069 
1 1 1 -1  1  23 o 441.1861 28.28663 38.15468       4.820997      38.22388       6.810939      38.08519       6.824923  439.4619 40.35876 438.6252 40.52413 0.8366699      57.19296 
1 1 1 -1  1  24 o 975.6404 18.29768 185.2943       6.932883      179.7110       9.608399      191.3581       10.01328  959.6505 25.78161 990.2107 26.03880 -30.56024      36.64301 
1 1 1 -1  1  25 o 888.8282 19.43544 153.9155       6.708727      156.1259       9.594586      151.8010       9.384063  893.6665 27.64540 881.2496 27.41978 12.41687       38.93729 
1 1 1 -1  1  26 f 168.8749 61.26488 4.862346       5.182926      8.114365       7.319535      1.592083       7.340037  208.6275 73.11995 164.8316 68.80642 43.79587       100.4034 
1 1 1 -1  1  27 o 141.2897 59.00809 1.054581       5.402128      5.958185       7.616734      -3.908780      7.663003  194.0998 73.53624 141.3210 64.17832 52.77887       97.60346 
1 1 1 -1  1  28 o 798.9981 32.85232 125.6717       10.19389      0.000000       0.000000      125.6717       10.19389  ?        ?        798.9981 32.85232 0.000000       32.85232 
1 1 1 -1  1  29 f 727.3005 25.05005 103.7510       7.075393      101.6689       9.932630      105.8959       10.08126  716.2782 35.70710 731.0989 35.50673 -14.82068      50.35598 
1 1 1 -1  1  30 o 211.5009 72.45088 9.262518       7.167136      14.27247       9.123346      1.186910       11.58311  253.2554 81.59267 191.1028 83.23897 62.15259       116.5594 
1 1 1 -1  1  31 o 176.1107 69.51653 4.888984       7.017668      14.36526       12.76802      0.7871560      8.400276  253.1149 95.37189 163.4626 71.04379 89.65233       118.9244 
1 1 1 -1  1  32 o 148.4712 62.50003 1.957849       6.135172      8.784740       8.701659      -4.790482      8.651447  205.8887 78.45613 140.9905 65.52480 64.89824       102.2197 
1 1 1 -1  1  33 o 186.2525 72.25842 7.112872       7.473884      7.480022       9.061943      6.331884       13.21665  193.9960 78.18186 203.2918 88.72119 -9.295792      118.2533 
1 1 1 -1  1  34 o 236.5929 83.21077 15.25935       9.483100      2.562069       12.95148      29.93394       13.92346  183.1366 83.27094 307.2809 100.9211 -124.1443      130.8400 
1 1 1 -1  2  1  o 87.55568 27.01033 1.500764       1.010038      0.000000       0.000000      1.500764       1.010038  ?        ?        87.55568 27.01033 0.000000       27.01033 
1 1 1 -1  2  2  o 831.6652 14.55351 134.6947       4.700501      135.0323       6.682914      134.3642       6.612667  831.4805 20.69597 829.4599 20.52831 2.020569       29.15021 
1 1 1 -1  2  3  f 1083.307 11.47550 228.2475       4.827819      229.6615       6.868949      226.8670       6.786924  1085.764 16.29022 1079.158 16.19421 6.605225       22.97006 
1 1 1 -1  2  4  o 391.1275 10.77992 29.74255       1.637427      27.62025       2.287825      31.97141       2.344561  376.6545 15.64054 405.2877 14.89602 -28.63312      21.59902 
1 1 1 -1  2  5  o 208.1581 15.15919 8.475337       1.217035      7.084584       1.710193      9.902302       1.732314  189.0641 23.82084 224.5352 20.07802 -35.47110      31.15380 
1 1 1 -1  2  6  o 1162.851 12.29696 262.8534       5.553281      263.8645       7.864265      261.8478       7.842829  1164.458 17.39026 1159.997 17.40956 4.461304       24.60719 
1 1 1 -1  2  7  o 275.9947 15.53405 14.85811       1.658227      12.73497       2.354350      16.94816       2.335932  254.5480 24.10336 294.3696 20.56250 -39.82164      31.68262 
1 1 1 -1  2  8  o 612.4160 12.10079 72.87846       2.877983      76.70848       4.146514      69.31836       3.997728  628.0854 16.99951 597.0524 17.24141 31.03302       24.21259 
1 1 1 -1  2  9  o 753.9879 12.33401 110.4662       3.611576      106.7503       5.032718      114.4115       5.185801  740.9374 17.49013 767.0695 17.40817 -26.13208      24.67690 
1 1 1 -1  2  10 f 556.1529 13.52418 60.11161       2.921011      61.13994       4.161060      59.11255       4.101451  560.6505 19.11102 551.2742 19.15763 9.376282       27.06004 
1 1 1 -1  2  11 o 488.4565 15.20150 46.38449       2.883635      51.86281       4.178114      41.40114       3.984895  516.2234 20.84081 461.1554 22.25060 55.06808       30.48652 
1 1 1 -1  2  12 o 497.0974 15.93927 48.05513       3.077074      50.48690       4.450317      45.82769       4.259248  509.1361 22.50760 485.0679 22.61010 24.06818       31.90311 
1 1 1 -1  2  13 o 140.7512 46.12988 3.755024       2.909595      5.753709       3.616504      0.8733591E-01  4.899063  169.6342 50.86527 129.7345 55.28439 39.89970       75.12416 
1 1 1 -1  2  14 o 830.1887 16.51817 134.1542       5.325577      133.2254       6.501360      136.0483       9.284769  826.8073 20.24753 834.0005 28.66664 -7.193237      35.09613 
1 1 1 -1  2  15 o 518.3741 20.80121 52.42514       4.187550      46.75987       7.145902      55.38811       5.167863  485.4227 38.21512 532.2634 25.00094 -46.84076      45.66665 
1 1 1 -1  2  16 o 690.9310 18.64315 93.10211       5.002440      83.06719       8.528687      98.36508       6.176475  648.5193 33.98168 709.5043 22.41598 -60.98505      40.70910 
1 1 1 -1  2  17 o 527.8448 22.14092 54.44457       4.538684      54.02838       7.960903      54.64500       5.524469  520.8000 39.65883 527.3228 27.06773 -6.522766      48.01547 
1 1 1 -1  2  18 o 604.9234 21.03891 71.43610       4.942556      63.65884       8.594345      75.27940       6.041599  566.0081 39.34317 620.2878 25.08018 -54.27966      46.65727 
1 1 1 -1  2  19 o 122.3251 51.46847 0.5104112      4.157241      3.241823       5.104160      -4.872391      7.165309  154.3310 59.75884 132.0595 60.75328 22.27150       85.21784 
1 1 1 -1  2  20 f 485.3189 23.89170 45.96800       4.503004      39.47135       6.297038      52.76688       6.441849  446.7564 36.61595 517.9359 32.18552 -71.17950      48.75075 
1 1 1 -1  2  21 o 1077.807 23.37492 226.5309       9.784063      0.000000       0.000000      226.5309       9.784063  ?        ?        1077.807 23.37492 0.000000       23.37492 
1 1 1 -1  2  22 o 635.1495 21.00169 78.57305       5.180337      78.28542       7.319564      78.86171       7.332660  633.0137 29.77448 635.3467 29.71822 -2.333008      42.06771 
1 1 1 -1  2  23 o 343.1413 35.11927 23.29000       4.614062      23.12037       6.490960      23.46327       6.560129  338.5217 50.95281 341.0316 51.10664 -2.509827      72.16702 
1 1 1 -1  2  24 o 1305.559 17.45583 331.7324       8.850441      333.0703       12.45939      330.3696       12.57423  1306.724 24.55188 1301.336 24.88078 5.388062       34.95494 
1 1 1 -1  2  25 o 172.4371 60.04577 5.404838       4.932204      9.346464       6.874839      1.224368       7.080067  217.3146 70.89309 160.6338 67.35492 56.68082       97.78812 
1 1 1 -1  2  26 o 695.3765 33.37785 94.94991       9.013766      0.000000       0.000000      94.94991       9.013766  ?        ?        695.3765 33.37785 0.000000       33.37785 
1 1 1 -1  2  27 o 210.6328 62.95970 9.134766       5.547249      11.78969       7.801598      6.419937       7.889124  239.0119 75.28848 198.9653 74.96772 40.04668       106.2474 
1 1 1 -1  2  28 o 189.3603 64.99673 6.873473       5.769063      -0.9646921     8.027233      15.24695       8.296819  157.2091 68.86190 266.4834 76.28931 -109.2743      102.7717 
1 1 1 -1  2  29 o 522.1130 38.22117 54.46326       7.696045      46.85917       12.76143      58.80954       9.647943  467.4147 72.66220 539.0846 46.54024 -71.66986      86.28899 
1 1 1 -1  2  30 o 308.5995 62.50579 20.56409       7.234274      21.38058       8.976086      19.05069       12.22039  308.5473 75.52111 286.0113 94.57728 22.53604       121.0302 
1 1 1 -1  2  31 o 165.9989 68.57410 3.116313       7.182464      -5.255649      12.33803      7.407793       8.833559  171.0038 79.04443 201.7308 78.47480 -30.72701      111.3836 
1 1 1 -1  2  32 o 172.8875 70.37228 4.454023       7.424238      -11.58982      12.74486      12.69470       9.134031  154.3876 74.01329 232.3971 81.66885 -78.00941      110.2169 
1 1 1 -1  2  33 o 176.3988 70.50031 5.740499       7.302009      -4.417342      11.88623      11.89773       9.254143  162.1549 75.83852 220.7245 81.57943 -58.56956      111.3853 
1 1 1 -1  2  34 o 132.0524 61.42274 -3.315922      7.627934      0.3706740      9.656234      -9.434617      12.44011  159.7920 72.35882 149.4471 72.02350 10.34496       102.0940 
1 1 1 -1  3  1  o 129.4350 13.61918 3.296664       0.6743199     2.810145       0.9393341     3.813974       0.9686039 118.1888 21.24626 138.6452 18.44714 -20.45637      28.13717 
1 1 1 -1  3  2  f 900.3959 10.68362 157.6384       3.735767      158.5127       5.299911      156.7751       5.266591  902.2671 15.12535 897.3101 15.11329 4.956970       21.38195 
1 1 1 -1  3  3  o 922.8536 10.89612 165.5892       3.905106      164.6856       5.500231      166.5077       5.545353  919.7324 15.39896 924.8000 15.44022 -5.067627      21.80661 
1 1 1 -1  3  4  o 632.5089 10.44333 77.76344       2.565273      72.29012       3.521111      83.95465       3.744912  609.5229 14.87516 656.8779 14.68010 -47.35498      20.89918 
1 1 1 -1  3  5  o 731.2639 10.91256 103.9339       3.099051      111.7795       4.538944      97.08254       4.241590  758.0051 15.41895 706.4141 15.46113 51.59094       21.83554 
1 1 1 -1  3  6  o 615.3885 11.32253 73.59456       2.705957      74.75786       3.853856      72.46336       3.800308  619.9848 16.00613 610.3947 16.03172 9.590149       22.65419 
1 1 1 -1  3  7  o 325.1529 14.47701 20.55182       1.828078      20.64286       2.543167      20.45450       2.629582  325.0768 20.24517 323.5045 21.04493 1.572235       29.20199 
1 1 1 -1  3  8  o 1104.451 12.60004 237.0365       5.404384      240.0292       7.699527      234.1302       7.587609  1110.984 17.84549 1097.251 17.80619 13.73303       25.20956 
1 1 1 -1  3  9  o 602.3427 12.74472 70.50298       2.981274      76.04333       4.327363      65.49767       4.113109  625.3408 17.81880 580.3416 18.24982 44.99921       25.50619 
1 1 1 -1  3  10 o 784.5535 12.72976 119.6132       3.878563      115.2625       5.409923      124.2146       5.563535  769.8488 18.09496 799.1975 17.92539 -29.34869      25.47052 
1 1 1 -1  3  11 o 709.3194 13.36395 97.79080       3.681329      94.61589       5.140850      101.1324       5.274078  697.3699 18.98208 720.9959 18.83588 -23.62598      26.74153 
1 1 1 -1  3  12 o 749.6567 13.71519 109.2523       3.992936      110.6074       5.630722      107.8816       5.663147  753.8662 19.23277 744.4873 19.58721 9.378906       27.45102 
1 1 1 -1  3  13 o 589.9393 17.68855 67.73657       4.052542      65.53484       4.969757      72.10607       7.001137  579.8975 22.06764 607.3895 29.68065 -27.49200      36.98542 
1 1 1 -1  3  14 o 184.8624 40.07742 6.988381       2.794288      13.69033       4.067781      1.000237       3.845059  260.3450 41.63580 122.1264 50.28266 138.2186       65.28312 
1 1 1 -1  3  15 f 513.9233 20.50771 51.52994       4.093016      41.50948       6.927756      56.90334       5.073101  456.7355 39.44409 539.5506 24.21103 -82.81506      46.28186 
1 1 1 -1  3  16 o 572.8101 20.11884 64.03961       4.475501      60.88176       7.590361      65.72258       5.541223  554.4594 35.43569 579.5505 24.61991 -25.09106      43.14890 
1 1 1 -1  3  17 f 367.0133 28.77382 26.59017       4.068309      23.91881       6.787301      28.08812       5.082530  341.3157 52.91824 375.7759 35.23915 -34.46021      63.57781 
1 1 1 -1  3  18 o 440.1012 23.27439 37.95493       3.963804      29.51663       5.546857      46.76082       5.666384  384.9375 37.58418 487.2229 30.09412 -102.2854      48.14797 
1 1 1 -1  3  19 o 676.6535 21.45792 89.32545       5.638739      85.82625       6.798559      97.03832       10.09347  662.4643 26.42570 701.0214 37.20824 -38.55713      45.63739 
1 1 1 -1  3  20 o 474.6960 26.88245 44.16866       4.935433      41.05380       6.039156      50.43250       8.564015  456.2210 34.33756 503.5191 44.24479 -47.29807      56.00598 
1 1 1 -1  3  21 f 1343.352 16.67172 351.1537       8.697575      339.5504       11.95360      364.2079       12.67887  1319.636 23.32473 1366.572 23.89021 -46.93665      33.38840 
1 1 1 -1  3  22 f 960.6436 17.62348 179.5747       6.574789      186.3441       9.401019      173.0936       9.198598  977.5728 24.76269 942.1149 25.14142 35.45795       35.28855 
1 1 1 -1  3  23 o 1224.878 17.32320 291.9274       8.240413      288.9951       11.54995      294.9673       11.76030  1217.478 24.42818 1229.954 24.62077 -12.47595      34.68311 
1 1 1 -1  3  24 o 405.1344 32.97568 32.34495       5.143231      22.34392       7.095235      43.41907       7.466190  330.6602 57.33106 468.0090 41.50949 -137.3488      70.78056 
1 1 1 -1  3  25 o 697.1555 22.52720 94.80916       6.099087      96.28886       8.528437      93.26019       8.725773  701.0781 31.32384 689.7162 32.57658 11.36194       45.19310 
1 1 1 -1  3  26 o 636.4120 25.14484 79.15188       6.214631      83.92075       8.726398      74.24409       8.852590  652.5728 34.55637 612.9133 37.36999 39.65948       50.89851 
1 1 1 -1  3  27 o 589.0319 28.44031 67.98102       6.505806      60.92479       9.157614      75.17130       9.244197  552.8901 42.98761 615.8571 38.85017 -62.96698      57.94196 
1 1 1 -1  3  28 o 465.1047 40.37007 43.20711       7.219529      62.93594       12.41652      33.13053       8.873719  554.2527 58.57249 400.3737 58.82444 153.8791       83.01236 
1 1 1 -1  3  29 o 1079.617 23.79559 228.4732       9.976870      229.3996       12.09809      226.5038       17.63877  1079.419 28.86015 1063.928 42.69017 15.49121       51.53018 
1 1 1 -1  3  30 o 444.7310 38.19738 39.85453       6.533167      45.67952       9.069988      33.57335       9.418447  470.2480 50.45351 395.5788 63.45314 74.66919       81.06699 
1 1 1 -1  3  31 o 318.6211 52.89223 21.60580       6.315259      23.56936       8.762224      19.48318       9.110187  322.0706 71.87727 288.3085 79.01728 33.76205       106.8179 
1 1 1 -1  3  32 o 186.1538 73.12417 6.371777       7.729710      -18.08730      13.98398      17.13286       9.275533  149.6946 73.10732 263.8935 81.92554 -114.1989      109.8020 
1 1 1 -1  3  33 o 242.9809 80.55685 15.12484       8.863659      4.030571       12.36485      26.85193       12.71260  190.8382 84.45362 306.6613 96.02715 -115.8231      127.8813 
1 1 1 -1  3  34 o 118.9867 55.73217 -3.941785      6.460329      4.151183       9.227743      -11.72167      9.047494  172.6743 74.75321 120.6100 58.88126 52.06426       95.15800 
1 1 1 -1  4  1  o 419.4378 10.47601 34.20121       1.706441      34.69549       2.410520      33.70468       2.416034  422.2184 14.70096 416.1297 14.95018 6.088745       20.96726 
1 1 1 -1  4  2  o 314.7821 15.27580 19.28542       1.867420      0.000000       0.000000      19.28542       1.867420  ?        ?        314.7821 15.27580 0.000000       15.27580 
1 1 1 -1  4  3  o 171.2301 15.25777 5.750238       1.003980      6.195880       1.418478      5.302877       1.421210  177.0425 21.04297 163.2759 23.05485 13.76659       31.21430 
1 1 1 -1  4  4  o 414.7292 15.60024 33.46305       2.512603      0.000000       0.000000      33.46305       2.512603  ?        ?        414.7292 15.60024 0.000000       15.60024 
1 1 1 -1  4  5  o 673.1721 10.99830 88.06364       2.875276      85.09393       4.035600      91.12532       4.097618  661.4501 15.71025 684.5110 15.41427 -23.06097      22.00935 
1 1 1 -1  4  6  o 685.9199 11.36704 91.42270       3.027951      91.47266       4.279560      91.37260       4.284785  685.8639 16.06694 685.4869 16.09540 0.3770142      22.74222 
1 1 1 -1  4  7  o 1323.543 13.27412 340.4441       6.822943      337.7773       9.564857      343.2068       9.735607  1317.796 18.68970 1328.323 18.87259 -10.52686      26.56086 
1 1 1 -1  4  8  o 637.6874 12.26883 79.01562       3.038359      75.13233       4.195393      83.29882       4.406126  621.6048 17.37922 654.5184 17.33433 -32.91357      24.54621 
1 1 1 -1  4  9  o 1137.520 12.98398 251.4505       5.735808      251.6439       8.084281      251.2545       8.139313  1137.522 18.30011 1136.628 18.43917 0.8935547      25.97878 
1 1 1 -1  4  10 o 694.2355 13.20545 93.66739       3.560313      94.06054       5.012718      93.26716       5.057667  695.3969 18.56148 692.4421 18.80783 2.954773       26.42467 
1 1 1 -1  4  11 o 997.7834 13.22781 193.5079       5.125689      193.0923       7.227516      193.9284       7.270311  996.2234 18.68118 998.3706 18.75138 -2.147156      26.46886 
1 1 1 -1  4  12 o 458.8204 18.66638 40.97092       3.326066      40.88271       4.190229      41.12117       5.468509  457.4032 23.67010 457.7226 30.94549 -0.3193970     38.96020 
1 1 1 -1  4  13 o 1185.001 16.09279 273.2291       7.405902      283.7586       9.386919      255.8689       12.05300  1206.939 20.02671 1144.580 27.11571 62.35913       33.70950 
1 1 1 -1  4  14 f 479.0157 17.84432 44.69547       3.319540      44.62834       4.598244      44.76852       4.797146  477.3102 24.89261 477.8815 25.94571 -0.5713806     35.95583 
1 1 1 -1  4  15 o 268.6577 29.63126 14.32611       3.040126      10.31081       4.256908      18.50576       4.343163  222.9230 50.35937 304.0046 37.58815 -81.08157      62.84055 
1 1 1 -1  4  16 o 531.7706 25.63540 55.37279       5.294103      0.000000       0.000000      55.37279       5.294103  ?        ?        531.7706 25.63540 0.000000       25.63540 
1 1 1 -1  4  17 o 351.9161 29.98315 24.49119       4.058664      20.51618       6.869515      26.62285       5.030561  313.8416 58.51483 365.6419 35.88942 -51.80038      68.64427 
1 1 1 -1  4  18 o 339.4335 27.84380 22.71904       3.638060      26.92830       5.213153      18.72293       5.079440  367.7412 37.00574 304.1419 44.30589 63.59930       57.72726 
1 1 1 -1  4  19 o 703.8459 17.66676 96.49124       4.829058      98.24810       6.842697      94.74805       6.816020  709.1614 24.84587 696.3538 25.20420 12.80756       35.39165 
1 1 1 -1  4  20 f 434.5207 29.38133 37.09416       4.928902      40.11756       6.063299      31.20373       8.463196  450.9156 34.89638 391.6988 57.33316 59.21689       67.11817 
1 1 1 -1  4  21 o 1284.727 16.49009 321.1401       8.227386      328.9236       11.82177      313.8291       11.45735  1298.871 23.43627 1268.758 23.25290 30.11304       33.01448 
1 1 1 -1  4  22 o 1374.794 16.89202 367.7153       9.018768      385.0044       13.18847      352.5286       12.36066  1405.324 24.16518 1344.856 23.66672 60.46838       33.82410 
1 1 1 -1  4  23 o 476.6398 27.06840 44.47839       4.989833      42.17779       6.995348      46.86150       7.119673  461.9703 39.36682 487.4131 37.91100 -25.44281      54.65337 
1 1 1 -1  4  24 o 574.3049 24.69367 64.35406       5.507521      67.40485       7.820087      61.35159       7.757906  585.4238 34.54953 558.1207 35.98396 27.30316       49.88502 
1 1 1 -1  4  25 o 706.0552 22.39153 97.24870       6.139746      104.3525       8.720582      90.26638       8.645724  729.8950 30.76501 678.4423 32.81410 51.45276       44.98056 
1 1 1 -1  4  26 o 135.8497 59.89362 -1.419376      6.161940      -4.448359      10.07858      0.3887036      7.786817  163.6411 74.02905 162.5138 69.48670 1.127243       101.5318 
1 1 1 -1  4  27 o 278.4143 75.27654 16.56826       8.334283      0.000000       0.000000      16.56826       8.334283  ?        ?        278.4143 75.27654 0.000000       75.27654 
1 1 1 -1  4  28 o 209.7435 70.23886 8.787562       6.734674      12.25490       8.038677      0.6241425      12.33452  241.5880 76.45866 199.0464 86.29778 42.54160       115.2963 
1 1 1 -1  4  29 o 170.5588 79.16782 -7.757862      12.56716      0.000000       0.000000      -7.757862      12.56716  ?        ?        170.5588 79.16782 0.000000       79.16782 
1 1 1 -1  4  30 f 210.5537 67.13255 9.487223       6.188415      7.311059       8.529311      11.90618       8.992532  202.2389 77.52988 234.8440 81.11746 -32.60506      112.2093 
1 1 1 -1  4  31 o 176.5514 70.22568 4.866645       7.212493      5.036644       8.771229      4.511695       12.67420  186.9657 76.34024 205.5074 88.28041 -18.54173      116.7102 
1 1 1 -1  4  32 o 150.5532 68.90767 -2.814198      9.057719      0.000000       0.000000      -2.814198      9.057719  ?        ?        150.5532 68.90767 0.000000       68.90767 
1 1 1 -1  4  33 o 220.7245 74.94562 11.98993       7.668551      10.27153       14.92529      12.60627       8.938618  220.0390 95.16416 224.2163 80.57915 -4.177292      124.6965 
1 1 1 -1  4  34 o 174.7343 67.52382 6.555214       6.506648      8.900643       9.403297      4.400588       9.012704  196.4831 79.48022 172.4628 74.26984 24.02026       108.7801 
1 1 1 -1  5  1  f 1166.078 12.08592 264.3500       5.473125      269.7349       7.871254      259.3095       7.615418  1177.161 17.21789 1154.226 16.98928 22.93579       24.18866 
1 1 1 -1  5  2  o 987.9658 11.30855 189.7256       4.338874      184.4910       5.996740      195.4766       6.285637  973.7609 15.85751 1002.296 16.14825 -28.53503      22.63242 
1 1 1 -1  5  3  o 311.4431 16.80395 18.92788       2.024920      18.92788       2.024920      0.000000       0.000000  311.4431 16.80395 ?        ?        0.000000       16.80395 
1 1 1 -1  5  4  o 1100.084 11.90931 235.2000       5.087923      239.0964       7.296318      231.5120       7.098576  1108.652 16.94652 1090.949 16.75479 17.70325       23.83081 
1 1 1 -1  5  5  o 949.9061 11.60275 175.3401       4.280253      170.4668       5.938304      180.6097       6.175016  936.2720 16.33174 963.7097 16.49924 -27.43762      23.21531 
1 1 1 -1  5  6  o 1354.427 13.30358 356.5230       6.997646      355.9047       9.866439      357.1489       9.926165  1352.667 18.78199 1355.019 18.86289 -2.352295      26.61901 
1 1 1 -1  5  7  o 1321.497 13.32931 339.3799       6.840719      338.8784       9.637929      339.8890       9.710959  1319.985 18.80124 1321.939 18.91571 -1.953613      26.67004 
1 1 1 -1  5  8  o 627.2809 12.69091 76.46091       3.091597      71.18934       4.303980      82.08035       4.443724  605.0318 18.31741 649.7036 17.61180 -44.67175      25.41069 
1 1 1 -1  5  9  o 501.8994 14.33801 48.96147       2.794689      49.46155       3.919280      48.44418       3.986144  504.2231 20.01500 498.9839 20.57020 5.239227       28.70075 
1 1 1 -1  5  10 o 1012.431 13.09891 199.2150       5.150254      200.2993       7.255015      198.1135       7.312443  1014.735 18.41016 1009.158 18.65843 5.576599       26.21205 
1 1 1 -1  5  11 o 1162.011 13.65794 262.4848       6.163442      263.7358       8.695440      261.2216       8.737559  1164.137 19.23355 1158.550 19.41991 5.587280       27.33244 
1 1 1 -1  5  12 f 1039.668 15.60742 210.2480       6.301646      207.6089       7.739142      215.4402       10.85545  1032.655 19.29788 1050.715 26.60326 -18.05969      32.86550 
1 1 1 -1  5  13 o 1037.729 13.98192 209.4584       5.634804      209.6553       7.981214      209.2627       7.956476  1037.337 19.81166 1036.373 19.76863 0.9642334      27.98751 
1 1 1 -1  5  14 o 516.0958 17.27011 51.88310       3.461413      50.45459       4.898060      53.30825       4.892299  508.0909 24.82303 522.3566 24.11670 -14.26569      34.60922 
1 1 1 -1  5  15 o 544.1362 17.44270 57.70657       3.685948      59.53757       5.198809      55.85583       5.226739  551.7467 24.26253 534.2660 25.19099 17.48071       34.97509 
1 1 1 -1  5  16 o 910.4393 21.23822 161.8875       7.509261      0.000000       0.000000      161.8875       7.509261  ?        ?        910.4393 21.23822 0.000000       21.23822 
1 1 1 -1  5  17 o 283.3982 35.96998 16.08400       3.869670      15.72093       7.076389      16.23889       4.621961  271.8962 67.36255 282.8683 43.46473 -10.97205      80.16792 
1 1 1 -1  5  18 f 1081.325 15.42232 227.6369       6.476407      222.2812       8.987240      233.4225       9.341048  1067.173 21.68520 1093.510 21.99606 -26.33667      30.88810 
1 1 1 -1  5  19 o 519.1470 21.52289 52.56143       4.339293      51.69591       6.054003      53.47591       6.222854  512.8447 30.53506 521.5629 30.85969 -8.718140      43.41325 
1 1 1 -1  5  20 o 201.0474 55.59575 8.292632       4.486470      10.42089       5.466190      3.899312       7.853601  224.5652 61.06638 183.8869 73.23722 40.67825       95.35614 
1 1 1 -1  5  21 o 1155.545 19.24794 259.9717       8.637720      261.6682       10.61963      256.6551       14.84803  1158.535 23.60327 1145.101 33.38851 13.43420       40.88896 
1 1 1 -1  5  22 o 561.5330 32.70210 61.87211       7.100593      61.87211       7.100593      0.000000       0.000000  561.5330 32.70210 ?        ?        0.000000       32.70210 
1 1 1 -1  5  23 o 315.2086 39.69738 19.80326       4.751677      20.17827       6.529708      19.38114       6.927711  314.6152 55.46948 307.0464 60.24931 7.568817       81.89531 
1 1 1 -1  5  24 o 370.0763 36.31619 27.13012       5.152144      20.58768       7.282663      33.68541       7.289805  315.7283 61.60659 410.3878 46.56397 -94.65942      77.22419 
1 1 1 -1  5  25 o 413.7192 38.99313 33.99892       6.191104      43.71310       10.56934      28.92484       7.638774  463.1300 60.18739 377.4092 53.62571 85.72086       80.61165 
1 1 1 -1  5  26 o 435.5768 34.50242 37.52147       5.788608      34.18832       7.834923      41.52774       8.589695  411.4813 50.06091 454.2184 49.49631 -42.73706      70.39872 
1 1 1 -1  5  27 o 312.7257 49.81024 19.97746       5.846449      14.26425       7.850037      27.09365       8.761030  259.1670 74.21032 359.9589 65.06700 -100.7919      98.69593 
1 1 1 -1  5  28 o 325.7138 58.91985 22.17604       7.178557      15.33206       8.518208      38.94792       13.33474  266.2820 77.61260 421.3810 84.42773 -155.0990      114.6811 
1 1 1 -1  5  29 o 180.5386 66.85471 5.754867       6.220874      10.02233       8.366303      0.4778665      9.303412  222.4484 78.16197 172.9065 74.95628 49.54193       108.2947 
1 1 1 -1  5  30 o 321.7145 58.88429 22.19719       7.085839      23.30805       8.518122      19.70157       12.76743  324.1389 69.73661 287.5164 96.70778 36.62250       119.2291 
1 1 1 -1  5  31 o 183.6327 67.89442 6.548527       6.410904      8.763971       8.821659      4.068974       9.332685  208.7859 79.12991 184.6580 77.37477 24.12790       110.6725 
1 1 1 -1  5  32 o 205.7114 73.98083 9.456931       7.535906      4.574275       12.91761      11.97600       9.278416  200.1075 87.51125 225.5440 81.94855 -25.43651      119.8907 
1 1 1 -1  5  33 o 166.3063 70.63203 3.624134       7.948130      -11.82043      14.75539      9.937200       9.433720  160.3084 77.54760 206.7583 80.91134 -46.44994      112.0726 
1 1 1 -1  5  34 o 203.1469 69.90563 10.24667       6.675441      7.492054       9.804209      12.62735       9.114479  189.6218 79.36948 217.9823 80.88280 -28.36046      113.3205 
1 1 1 -1  6  1  o 439.0518 16.34034 37.49517       2.786153      0.000000       0.000000      37.49517       2.786153  ?        ?        439.0518 16.34034 0.000000       16.34034 
1 1 1 -1  6  2  o 450.1164 13.61654 39.38568       2.380234      45.80343       3.067263      29.67053       3.773851  485.2880 16.27509 389.3519 25.09187 95.93613       29.90787 
1 1 1 -1  6  3  o 227.3315 15.25668 10.09319       1.339129      8.818098       1.885257      11.39170       1.902491  211.5063 23.34073 241.0611 20.51721 -29.55482      31.07645 
1 1 1 -1  6  4  o 1379.435 13.23857 369.8259       7.092028      372.9745       10.08974      366.7512       9.970609  1384.658 18.76331 1373.066 18.69831 11.59180       26.48940 
1 1 1 -1  6  5  o 241.1297 23.88715 11.43135       2.207453      11.43135       2.207453      0.000000       0.000000  241.1297 23.88715 ?        ?        0.000000       23.88715 
1 1 1 -1  6  6  o 493.0267 12.49473 47.23343       2.392353      51.60826       3.465520      43.25048       3.306664  515.1838 17.32121 471.5984 18.05468 43.58542       25.01991 
1 1 1 -1  6  7  o 753.0518 12.13290 110.1884       3.548276      102.6653       4.848410      118.8648       5.206776  726.6478 17.18096 781.8795 17.14751 -55.23169      24.27390 
1 1 1 -1  6  8  o 443.2002 14.53259 38.17891       2.501330      37.78534       3.571896      38.55764       3.503913  440.6806 20.87118 445.1870 20.26669 -4.506409      29.09201 
1 1 1 -1  6  9  o 840.2562 12.75298 137.2078       4.161515      141.4715       5.901987      132.9921       5.868695  852.8776 17.81901 826.8885 18.27539 25.98907       25.52463 
1 1 1 -1  6  10 o 231.4968 26.57522 10.58341       2.345880      6.204163       3.324437      14.92669       3.310755  174.8111 47.65930 274.6989 31.61071 -99.88782      57.18956 
1 1 1 -1  6  11 o 1017.400 15.48872 201.3082       6.119773      204.4120       7.637853      195.7424       10.22793  1024.784 19.19158 1001.764 26.29021 23.02020       32.54984 
1 1 1 -1  6  12 o 733.2635 14.27771 104.5697       4.065806      100.7697       5.529971      109.0407       5.998385  719.2924 19.79654 748.1298 20.64569 -28.83734      28.60328 
1 1 1 -1  6  13 o 704.7842 15.12969 96.66407       4.141084      94.51646       5.731950      99.00882       5.989275  696.1749 21.20099 712.4622 21.64634 -16.28735      30.29927 
1 1 1 -1  6  14 o 302.3358 25.96042 18.01362       3.018535      19.67589       4.304384      16.40513       4.234189  314.0721 35.93705 285.6611 39.20094 28.41095       53.18068 
1 1 1 -1  6  15 o 749.4246 17.61181 109.4832       5.125780      100.9805       8.517609      114.3107       6.417997  716.9262 30.59252 765.0181 21.60229 -48.09186      37.45079 
1 1 1 -1  6  16 o 674.5989 19.62045 88.80000       5.140229      86.10926       9.085988      90.06654       6.233683  659.7097 35.59604 678.6429 23.65241 -18.93317      42.73774 
1 1 1 -1  6  17 o 532.8541 22.80895 55.47397       4.719996      61.93445       8.356876      52.44765       5.719646  558.5301 38.76744 516.4348 28.63051 42.09534       48.19358 
1 1 1 -1  6  18 o 194.4932 47.40732 7.808949       3.548220      12.81759       5.083203      3.049524       4.955128  248.6116 54.17931 151.3812 58.80630 97.23045       79.95986 
1 1 1 -1  6  19 o 497.9097 22.28655 48.35092       4.309445      50.98145       6.137882      45.79350       6.051979  509.2786 31.18402 482.3143 32.49961 26.96432       45.04073 
1 1 1 -1  6  20 o 962.6840 19.56835 180.4928       7.315869      181.4196       8.868977      178.5194       12.94149  964.4865 23.67824 954.3099 34.91941 10.17664       42.19033 
1 1 1 -1  6  21 o 689.7940 22.75990 92.72498       6.097021      90.30154       7.404511      97.82819       10.74493  680.0898 28.03510 704.9369 39.40646 -24.84711      48.36151 
1 1 1 -1  6  22 f 428.7718 28.53584 36.04943       4.724519      29.66136       6.462141      43.38491       6.924782  385.9641 43.89301 468.8562 38.36711 -82.89206      58.29778 
1 1 1 -1  6  23 o 1112.366 20.25183 240.9801       8.748629      242.1357       14.71688      240.3486       10.87970  1112.019 34.07813 1109.999 25.23868 2.019897       42.40648 
1 1 1 -1  6  24 o 809.4550 20.40896 127.6797       6.415662      126.0961       8.876674      129.4117       9.283207  803.0792 28.46190 813.3843 29.38828 -10.30511      40.91150 
1 1 1 -1  6  25 o 390.3024 36.41669 30.21058       5.456126      29.38000       7.291054      31.26767       8.225421  381.2234 50.48960 391.9101 55.60266 -10.68668      75.10563 
1 1 1 -1  6  26 o 477.8061 32.24889 45.01587       5.949019      43.22490       8.102592      47.11042       8.762469  464.6678 45.48394 484.7562 47.14157 -20.08835      65.50661 
1 1 1 -1  6  27 o 505.2446 37.78839 50.68830       7.360919      48.81089       8.509952      56.26645       14.66873  493.5161 44.89239 516.6284 75.32758 -23.11221      87.69019 
1 1 1 -1  6  28 o 395.0562 58.18158 32.39358       8.659025      32.39358       8.659025      0.000000       0.000000  395.0562 58.18158 ?        ?        0.000000       58.18158 
1 1 1 -1  6  29 o 309.1389 55.42781 20.12417       6.409946      10.68058       8.295161      34.12059       10.09868  226.4658 77.92661 398.1103 67.74454 -171.6445      103.2564 
1 1 1 -1  6  30 o 511.8230 34.14422 52.47993       6.747849      44.06486       8.921852      63.72773       10.31478  460.2966 50.75403 556.0429 48.24470 -95.74634      70.02515 
1 1 1 -1  6  31 o 192.8158 72.38799 7.319316       7.342579      3.793209       11.75981      9.572282       9.400045  196.2746 84.67958 214.8627 81.62292 -18.58806      117.6135 
1 1 1 -1  6  32 o 359.8092 51.14362 27.96133       6.945327      17.94801       9.801295      38.06044       9.843192  265.0929 84.48231 409.8961 63.92010 -144.8032      105.9389 
1 1 1 -1  6  33 f 157.3490 68.03573 2.367479       7.625138      -8.021224      14.27680      6.513616       9.019287  164.5262 78.73125 185.7193 76.79221 -21.19305      109.9802 
1 1 1 -1  7  1  o 642.7154 11.44172 80.26453       2.855866      90.28410       4.205664      71.69105       3.890350  681.4417 15.89198 607.2030 16.49783 74.23871       22.90706 
1 1 1 -1  7  2  o 830.3320 11.70454 133.9662       3.774281      134.1610       5.323619      133.7693       5.351770  830.6581 16.50276 829.4370 16.61445 1.221191       23.41754 
1 1 1 -1  7  3  o 103.6220 33.43391 2.033760       1.531455      1.462692       1.821681      3.410047       2.828025  97.97736 36.19844 135.9643 45.51574 -37.98690      58.15505 
1 1 1 -1  7  4  o 713.7144 11.32563 98.96999       3.139168      101.2935       4.463947      96.69680       4.415360  721.8353 15.92403 705.2566 16.12096 16.57874       22.65966 
1 1 1 -1  7  5  o 230.3331 17.98582 10.37932       1.596087      9.060489       2.289844      11.62555       2.225928  213.7875 28.27378 243.2133 23.87430 -29.42580      37.00526 
1 1 1 -1  7  6  o 1178.410 12.81033 269.8425       5.862527      261.7227       8.065655      278.9370       8.536058  1160.139 17.90200 1197.640 18.35283 -37.50146      25.63802 
1 1 1 -1  7  7  o 1324.342 13.50553 340.8506       6.946077      345.8416       9.931638      336.0717       9.718309  1333.432 19.17883 1314.479 19.03746 18.95300       27.02318 
1 1 1 -1  7  8  f 326.6158 17.71184 20.80756       2.238217      21.21537       3.137217      20.38479       3.194185  329.1204 24.72563 322.4597 25.72082 6.660645       35.67796 
1 1 1 -1  7  9  o 605.9677 13.64872 71.37443       3.211955      72.63876       4.619885      70.19152       4.468668  610.9868 19.47024 600.6263 19.15780 10.36047       27.31505 
1 1 1 -1  7  10 o 925.8193 15.13639 166.6753       5.442226      162.8861       6.657295      174.3090       9.449087  914.8872 18.73709 945.5071 25.73339 -30.61993      31.83216 
1 1 1 -1  7  11 f 540.4697 17.62254 56.84854       3.698859      54.71438       4.573252      60.88536       6.289723  529.8758 22.22404 557.4935 29.15245 -27.61774      36.65752 
1 1 1 -1  7  12 o 230.9629 31.47618 10.63586       2.749743      9.779000       3.817745      11.55954       3.963816  218.3654 46.44718 238.2561 44.47495 -19.89076      64.30678 
1 1 1 -1  7  13 o 336.2600 23.23290 22.18413       3.015330      22.27407       4.211523      22.08953       4.319156  335.2520 32.76632 333.6314 33.80183 1.620636       47.07648 
1 1 1 -1  7  14 o 629.5273 18.69417 77.27795       4.570343      78.00443       7.713887      76.88499       5.673334  629.2473 31.66760 627.1974 23.29196 2.049866       39.31097 
1 1 1 -1  7  15 o 642.1677 19.14016 80.44855       4.773336      79.64878       7.900489      80.90833       5.990287  635.5131 32.11528 643.1486 23.98326 -7.635498      40.08226 
1 1 1 -1  7  16 o 293.2227 36.03425 17.20463       4.017018      12.74530       6.789237      19.60663       4.982800  245.3256 68.58952 311.6917 42.25342 -66.36613      80.55975 
1 1 1 -1  7  17 o 589.8639 38.28248 68.94115       8.722197      68.94115       8.722197      0.000000       0.000000  589.8639 38.28248 ?        ?        0.000000       38.28248 
1 1 1 -1  7  18 o 1177.820 15.72193 270.0179       7.191387      276.8299       10.33679      263.6282       10.01133  1191.136 22.34584 1162.429 22.17671 28.70654       31.48242 
1 1 1 -1  7  19 o 347.4036 30.68622 23.79905       4.097489      21.14301       5.783023      26.47669       5.806498  323.7308 47.40284 364.3320 41.79445 -40.60126      63.19656 
1 1 1 -1  7  20 o 522.1788 22.88989 53.15120       4.641849      48.34936       6.514621      58.10317       6.615677  495.7387 34.04463 544.1460 31.44019 -48.40729      46.34137 
1 1 1 -1  7  21 o 1178.607 19.55445 270.4279       8.950403      266.5626       10.83386      278.7377       15.88502  1169.421 23.85527 1193.410 34.27442 -23.98889      41.75895 
1 1 1 -1  7  22 o 371.1967 39.20354 27.32399       5.565916      40.75208       9.623295      20.57395       6.822917  450.0501 56.29108 317.3882 57.47018 132.6619       80.44568 
1 1 1 -1  7  23 o 1121.065 17.83988 244.6282       7.766953      238.3996       10.59372      251.8678       11.42115  1105.487 24.67555 1136.022 25.88781 -30.53516      35.76397 
1 1 1 -1  7  24 o 361.6119 36.86936 25.95378       5.105265      25.60795       6.909593      26.36956       7.576239  355.5632 51.54153 359.6165 56.07749 -4.053345      76.16570 
1 1 1 -1  7  25 o 454.4563 31.90781 40.70296       5.595715      47.50565       7.609942      32.69496       8.256628  489.0656 40.42946 401.1422 54.40368 87.92343       67.78128 
1 1 1 -1  7  26 o 294.5144 51.82571 17.79945       5.711159      19.96727       7.672636      15.10600       8.552390  308.0858 66.10694 266.9095 77.76035 41.17633       102.0627 
1 1 1 -1  7  27 o 165.0041 69.36885 1.469383       7.541809      1.469383       7.541809      0.000000       0.000000  165.0041 69.36885 ?        ?        0.000000       69.36885 
1 1 1 -1  7  28 o 138.3647 59.61426 0.3007931E-01  5.812344      -7.669372      7.849375      9.376804       8.648383  128.4801 60.57038 220.3667 79.25336 -91.88661      99.74902 
1 1 1 -1  7  29 o 537.4283 31.86875 57.40648       6.621725      58.63652       8.817411      55.81548       10.02803  538.4139 42.51526 521.1905 50.16357 17.22339       65.75660 
1 1 1 -1  7  30 o 432.3748 45.51249 38.51945       7.527453      34.73471       12.28506      40.79458       9.524920  384.8962 84.50291 437.9813 57.37876 -53.08508      102.1424 
1 1 1 -1  7  31 o 115.1511 55.27721 -8.517096      7.161911      -9.913733      11.87681      -7.719044      8.977877  152.8681 72.77991 135.2222 64.05835 17.64597       96.95559 
1 1 1 -1  7  32 o 316.9456 56.68022 22.38449       6.720511      19.62826       9.434270      25.22404       9.575788  277.2210 81.93134 319.2470 77.91973 -42.02600      113.0674 
1 1 1 -1  7  33 o 152.3529 66.80533 1.537637       7.572606      -25.41762      14.53159      11.58643       8.872546  136.3999 68.01993 214.3773 79.75122 -77.97746      104.8187 
1 1 1 -1  8  1  o 431.9429 13.01665 36.25618       2.183502      40.50815       3.116124      32.15464       3.060503  456.4258 17.57991 406.5891 19.38247 49.83664       26.16741 
1 1 1 -1  8  2  o 371.0196 14.43165 26.75444       2.079413      21.51598       2.826533      32.93422       3.069999  331.7863 22.06227 411.4970 19.21072 -79.71078      29.25398 
1 1 1 -1  8  3  o 1159.966 12.69179 261.4556       5.717364      264.0038       6.651536      254.2468       11.18765  1165.463 14.69588 1142.663 25.21115 22.79993       29.18169 
1 1 1 -1  8  4  o 453.6410 12.75306 39.98857       2.246749      40.09793       3.160064      39.87678       3.194991  454.1015 17.91905 452.8385 18.16763 1.263000       25.51774 
1 1 1 -1  8  5  o 573.6243 12.28249 63.93631       2.736164      63.90733       3.840075      63.96619       3.899652  573.3053 17.24748 573.5577 17.50736 -0.2523804     24.57608 
1 1 1 -1  8  6  o 1954.176 16.47294 742.4655       12.50152      728.7737       17.19449      757.8201       18.20872  1934.934 22.88206 1972.928 23.76513 -37.99377      32.99045 
1 1 1 -1  8  7  o 439.0924 14.67825 37.47837       2.502985      36.21902       3.518489      38.76863       3.561412  431.4076 21.00102 446.3549 20.54537 -14.94730      29.37950 
1 1 1 -1  8  8  o 811.4618 12.73764 127.9739       4.014071      121.1068       5.508015      135.7521       5.862015  789.0413 17.97494 835.3813 18.06900 -46.33997      25.48700 
1 1 1 -1  8  9  o 1063.338 13.23029 219.7897       5.463469      223.8583       7.818187      215.9065       7.637987  1072.551 18.76982 1053.341 18.67161 19.20984       26.47518 
1 1 1 -1  8  10 o 745.4727 15.50941 108.0924       4.490090      110.3319       5.645653      104.2373       7.407038  752.8065 19.31091 730.9305 26.09399 21.87592       32.46240 
1 1 1 -1  8  11 o 138.8802 42.86131 3.798362       2.543067      3.105563       3.542487      4.535033       3.652935  138.3884 50.58177 155.1024 51.72909 -16.71402      72.34925 
1 1 1 -1  8  12 o 431.0268 18.64745 36.20023       3.121416      38.88372       4.396547      33.47284       4.432369  445.3278 25.52818 412.6845 27.81833 32.64325       37.75642 
1 1 1 -1  8  13 o 473.4747 18.19082 43.69687       3.344852      44.90433       4.670926      42.42596       4.792071  478.4803 25.22600 464.7775 26.66059 13.70285       36.70338 
1 1 1 -1  8  14 o 435.7918 23.64970 37.24267       3.987525      37.57922       6.345605      37.02305       5.126030  434.4379 37.99327 433.0571 30.67806 1.380859       48.83270 
1 1 1 -1  8  15 o 398.6291 22.65961 31.15320       3.493432      25.97754       4.759738      37.19701       5.143461  361.5456 34.31038 434.0649 30.71038 -72.51932      46.04704 
1 1 1 -1  8  16 o 397.8675 23.92830 31.05440       3.680052      25.52416       5.058931      37.26973       5.363140  357.8893 36.92910 434.3563 32.01976 -76.46695      48.87764 
1 1 1 -1  8  17 o 691.0388 20.53786 93.13229       5.511700      105.2891       9.530610      87.02330       6.756081  732.1071 33.52109 667.1005 26.07808 65.00665       42.47034 
1 1 1 -1  8  18 o 293.0962 34.91774 17.09240       3.896287      9.676375       5.426411      24.98472       5.597955  216.6754 61.58221 353.6820 41.54715 -137.0066      74.28683 
1 1 1 -1  8  19 o 848.7980 24.43272 140.5500       8.053864      0.000000       0.000000      140.5500       8.053864  ?        ?        848.7980 24.43272 0.000000       24.43272 
1 1 1 -1  8  20 o 844.1470 20.82485 138.7873       6.826969      130.6486       11.71623      142.9712       8.400437  816.3728 36.95484 856.1655 25.26482 -39.79272      44.76574 
1 1 1 -1  8  21 o 706.7339 39.86914 98.30888       10.89792      0.000000       0.000000      98.30888       10.89792  ?        ?        706.7339 39.86914 0.000000       39.86914 
1 1 1 -1  8  22 o 677.1191 21.58286 89.31636       5.675474      100.8975       7.918962      77.08517       8.138192  718.8378 28.36674 626.7443 33.55739 92.09344       43.94053 
1 1 1 -1  8  23 o 376.2701 35.02338 27.99473       5.059055      25.96553       6.730191      30.63085       7.670926  358.9643 49.60328 389.7615 51.97337 -30.79718      71.84509 
1 1 1 -1  8  24 o 814.6765 20.65442 129.3839       6.534706      130.1363       8.840457      128.4777       9.702524  815.7181 27.90658 809.8600 30.84941 5.858093       41.59883 
1 1 1 -1  8  25 o 785.9786 24.29617 120.6775       7.416116      125.9204       9.052935      109.9804       12.93098  801.8358 29.07207 743.6782 44.98491 58.15759       53.56144 
1 1 1 -1  8  26 o 494.4428 37.56378 48.49086       7.159027      47.30071       8.068193      52.89691       15.52381  486.6795 43.13489 497.6272 83.27009 -10.94772      93.77914 
1 1 1 -1  8  27 f 405.0826 45.97131 33.14531       7.103928      29.29971       8.209591      44.60743       14.17331  376.2607 58.05058 453.1045 83.62701 -76.84378      101.8005 
1 1 1 -1  8  28 o 454.0648 35.68009 41.13083       6.241081      52.39386       8.476594      27.79689       9.223016  509.7979 43.22197 359.5384 68.55634 150.2595       81.04388 
1 1 1 -1  8  29 o 511.0511 33.22015 52.10529       6.557367      50.04925       8.863439      54.59135       9.746346  494.4644 46.71048 515.0882 49.32598 -20.62375      67.93322 
1 1 1 -1  8  30 o 801.0398 28.89571 127.3393       8.989083      115.0633       14.27415      135.4072       11.57192  744.6364 49.64490 820.9333 36.29689 -76.29694      61.49862 
1 1 1 -1  8  31 o 428.4255 59.59930 40.28609       9.647593      0.000000       0.000000      40.28609       9.647593  ?        ?        428.4255 59.59930 0.000000       59.59930 
1 1 1 -1  8  32 o 265.8116 64.83909 16.61874       6.633595      20.42946       9.405341      12.84670       9.357482  281.6139 81.40276 227.0612 82.32796 54.55266       115.7769 
1 1 1 -1  8  33 o 569.6049 32.42514 66.45876       7.143048      60.40246       10.58422      71.52430       9.679843  521.0204 53.04898 579.3930 43.33342 -58.37256      68.49802 
1 1 1 -1  9  1  o 380.8446 14.45822 28.18985       2.138408      29.49239       3.018549      26.87757       3.029814  388.8636 20.05647 371.0839 21.11129 17.77972       29.11955 
1 1 1 -1  9  2  o 291.8685 17.97431 16.62770       2.027450      15.86433       2.829396      17.43334       2.906659  284.2405 25.91674 298.1418 25.34435 -13.90128      36.24932 
1 1 1 -1  9  3  o 740.4786 12.13346 106.5395       3.489194      111.5207       4.103885      93.54652       6.628011  757.5104 13.95014 693.1431 24.62251 64.36737       28.29972 
1 1 1 -1  9  4  o 1137.485 12.98091 251.4366       5.734279      255.6487       6.693378      239.8169       11.11726  1146.820 15.02872 1109.613 25.79873 37.20740       29.85694 
1 1 1 -1  9  5  o 1520.436 14.35632 449.3345       8.476943      432.0096       11.43327      470.4851       12.63268  1490.169 19.75636 1554.934 20.91970 -64.76465      28.77408 
1 1 1 -1  9  6  o 298.5212 17.85564 17.39450       2.060544      17.00693       2.855185      17.81577       2.976710  294.3915 25.21698 301.3031 25.68452 -6.911560      35.99432 
1 1 1 -1  9  7  o 718.2337 12.74789 100.2597       3.555758      95.71500       4.948253      105.1120       5.112995  701.4365 18.16501 735.0820 17.91066 -33.64551      25.50998 
1 1 1 -1  9  8  o 1100.834 13.21514 235.5674       5.649653      230.6608       7.885521      240.7424       8.098361  1088.721 18.65030 1112.247 18.74856 -23.52563      26.44508 
1 1 1 -1  9  9  f 820.2519 15.09801 130.8545       4.809443      129.4397       6.009542      133.3750       8.021109  815.4269 18.97704 826.9643 24.97581 -11.53735      31.36749 
1 1 1 -1  9  10 f 1104.299 13.73457 237.1619       5.890194      240.0250       8.399349      234.3915       8.262326  1110.074 19.48343 1096.986 19.39427 13.08875       27.49076 
1 1 1 -1  9  11 o 712.9002 14.69911 98.89338       4.069562      98.45574       5.742085      99.33504       5.768467  710.5734 20.80811 713.7390 20.81100 -3.165588      29.42916 
1 1 1 -1  9  12 o 591.0144 15.83468 68.01648       3.634421      62.45417       5.035276      74.06611       5.251217  565.4636 22.92929 615.9421 21.95291 -50.47845      31.74402 
1 1 1 -1  9  13 o 364.6091 26.06811 26.15874       3.666833      27.67836       6.182056      25.33394       4.554516  370.8225 43.77165 357.3159 33.20140 13.50656       54.93897 
1 1 1 -1  9  14 o 333.9812 25.94127 21.97056       3.338260      24.47282       4.741299      19.51067       4.700985  350.5870 35.30391 311.5357 39.76241 39.05136       53.17344 
1 1 1 -1  9  15 o 520.4010 19.08403 52.81708       3.856880      50.14428       5.299931      55.82602       5.623327  505.2341 27.11056 533.1337 27.25102 -27.89963      38.43958 
1 1 1 -1  9  16 o 426.6114 22.98833 35.64328       3.794565      36.72892       5.268456      34.47305       5.469860  431.4579 31.66361 417.4030 34.04012 14.05493       46.48994 
1 1 1 -1  9  17 o 366.9226 30.94348 26.56100       4.368175      30.41684       7.291735      24.40269       5.455409  388.4172 49.46208 349.4695 40.97432 38.94775       64.22922 
1 1 1 -1  9  18 o 435.5782 25.68074 37.16795       4.324901      43.33530       6.150190      31.13456       6.083030  468.9871 33.99844 395.8588 40.12300 73.12830       52.59039 
1 1 1 -1  9  19 o 134.6315 55.75234 1.052899       4.764404      -2.595642      7.960712      3.089125       5.947101  151.2344 67.30374 162.0965 63.99155 -10.86212      92.86932 
1 1 1 -1  9  20 o 138.5435 53.86210 2.415447       4.159493      -4.887128      5.535820      11.88378       6.303485  112.4323 52.30641 240.0669 65.69971 -127.6346      83.97864 
1 1 1 -1  9  21 o 1046.307 20.03705 213.1440       8.141811      220.8913       10.02146      198.1017       13.96421  1064.496 24.24147 1005.794 35.75027 58.70227       43.19411 
1 1 1 -1  9  22 o 729.8804 23.76963 103.8691       6.737553      105.3040       8.106240      100.6629       12.11705  734.2570 28.42781 713.7080 43.93020 20.54895       52.32593 
1 1 1 -1  9  23 o 590.1152 24.29197 67.95982       5.567081      64.22572       7.439795      72.71097       8.392017  571.3931 33.67614 607.6135 35.72116 -36.22046      49.09260 
1 1 1 -1  9  24 o 327.6361 46.11928 21.65950       5.705749      24.75625       6.991053      15.48176       9.874273  348.6507 53.32779 272.1554 84.53458 76.49530       99.94973 
1 1 1 -1  9  25 o 673.6507 24.90054 88.69079       6.514356      102.4799       9.061725      73.94292       9.371461  722.5394 32.29396 610.8370 39.72104 111.7023       51.19239 
1 1 1 -1  9  26 o 419.4926 43.07251 35.26224       6.917419      40.38326       8.053225      20.85105       13.50957  447.9463 46.99311 309.2853 99.25024 138.6609       109.8133 
1 1 1 -1  9  27 o 181.4447 64.22215 6.107598       5.657429      13.70209       7.677916      -2.913857      8.368205  252.5746 73.70457 151.4738 68.08723 101.1008       100.3406 
1 1 1 -1  9  28 o 800.2709 31.28124 126.5828       9.721850      126.5828       9.721850      0.000000       0.000000  800.2709 31.28124 ?        ?        0.000000       31.28124 
1 1 1 -1  9  29 f 224.1465 71.26119 10.97512       6.976840      15.54236       10.75569      7.657382       9.167099  260.9809 88.75755 206.8613 80.08961 54.11963       119.5502 
1 1 1 -1  9  30 o 271.4621 68.47795 16.75681       7.218514      8.227680       11.49450      22.31098       9.275723  215.8393 87.67619 308.3992 77.53120 -92.55994      117.0393 
1 1 1 -1  9  31 o 191.1714 67.43587 7.926879       6.232710      9.036355       8.602404      6.700883       9.042849  205.4252 78.07226 192.9834 77.98492 12.44185       110.3491 
1 1 1 -1  9  32 f 188.8677 68.21148 8.037630       6.414479      11.98428       9.275076      4.419501       8.880660  219.6942 81.57758 175.6647 74.63489 44.02953       110.5679 
1 1 1 -1  9  33 o 182.3496 66.82902 7.644228       6.189669      -3.288679      9.491371      15.73440       8.164695  145.9742 68.10406 243.7967 77.04474 -97.82249      102.8302 
1 1 1 -1  10 1  o 1188.448 13.11063 274.4820       6.051061      282.4308       8.720711      267.1017       8.403109  1205.030 18.63486 1171.889 18.46399 33.14026       26.23313 
1 1 1 -1  10 2  o 760.5048 12.68502 112.3935       3.746460      114.6004       5.271821      110.1417       5.325173  767.6523 17.68349 752.5355 18.22127 15.11682       25.39135 
1 1 1 -1  10 3  o 565.6757 13.72232 62.19324       3.014555      67.46221       4.320402      57.19426       4.208258  588.9017 18.89093 542.1786 19.98628 46.72302       27.50125 
1 1 1 -1  10 4  o 787.3135 12.75957 120.4655       3.901322      123.2825       4.530289      112.3804       7.674825  796.3583 14.64837 759.4156 26.02322 36.94275       29.86273 
1 1 1 -1  10 5  o 387.7315 15.33454 29.22964       2.309032      29.13121       3.230573      29.33245       3.301510  386.2301 21.62490 387.5241 22.02840 -1.293976      30.86886 
1 1 1 -1  10 6  o 612.1182 13.03059 72.82921       3.097614      77.24131       4.453701      68.69503       4.311151  630.0858 18.20093 594.1754 18.68317 35.91040       26.08323 
1 1 1 -1  10 7  o 1301.579 13.78234 329.3638       6.966609      327.6887       9.800435      331.0748       9.904943  1297.471 19.45000 1304.140 19.55689 -6.668701      27.58215 
1 1 1 -1  10 8  o 706.0999 15.17364 96.97472       4.160868      97.62746       5.255731      95.87863       6.810674  708.1246 19.11153 701.0900 25.01430 7.034546       31.47961 
1 1 1 -1  10 9  o 506.4960 17.75181 49.94510       3.491779      44.83458       4.359248      59.09420       5.832678  479.4182 23.41365 549.9504 27.30968 -70.53220      35.97245 
1 1 1 -1  10 10 o 575.3278 15.47002 64.42255       3.456481      67.86082       4.992713      61.25783       4.789992  589.8069 21.79710 560.3526 22.01129 29.45435       30.97758 
1 1 1 -1  10 11 o 641.8516 15.26716 80.20242       3.805580      80.77841       5.372882      79.62253       5.390970  643.3375 21.50505 638.6831 21.73469 4.654419       30.57555 
1 1 1 -1  10 12 o 990.3072 16.49386 191.0585       6.343372      190.9941       10.83158      191.0921       7.825780  987.0089 28.25809 989.5427 20.36410 -2.533752      34.83125 
1 1 1 -1  10 13 o 325.3393 29.12549 20.93091       3.640975      22.73536       6.559205      20.12729       4.377289  332.8812 52.47615 317.4235 36.15403 15.45767       63.72488 
1 1 1 -1  10 14 o 414.0032 22.41299 33.58081       3.590137      30.91786       5.026412      36.35421       5.129600  395.0888 33.06331 429.1193 30.98905 -34.03046      45.31561 
1 1 1 -1  10 15 o 557.3869 18.55152 60.55909       4.015728      59.65031       5.640533      61.49317       5.718463  552.1205 26.30621 560.5908 26.26669 -8.470276      37.17467 
1 1 1 -1  10 16 o 436.6620 23.06958 37.32072       3.898246      36.05024       5.428604      38.67334       5.601358  427.3679 32.96295 442.7616 32.80930 -15.39371      46.50813 
1 1 1 -1  10 17 o 539.7314 24.05183 56.84626       5.041430      51.65443       8.552055      59.61138       6.241179  509.8549 43.61090 551.2923 29.25594 -41.43738      52.51496 
1 1 1 -1  10 18 o 509.2540 26.47721 50.76201       5.218362      47.19001       8.454515      52.96033       6.632519  487.1997 45.19891 519.0566 33.07529 -31.85690      56.00819 
1 1 1 -1  10 19 o 308.2672 35.59625 18.85361       4.183125      24.90002       5.682293      11.69987       6.180756  353.5215 42.22401 238.1413 65.00906 115.3802       77.51804 
1 1 1 -1  10 20 o 886.3054 17.83494 152.8507       6.138793      153.7977       8.463527      151.7995       8.917370  888.2239 24.53584 882.2181 26.02752 6.005798       35.76925 
1 1 1 -1  10 21 o 633.0636 24.45474 78.13868       6.012268      81.80347       7.289073      70.33846       10.63410  647.2036 29.00036 595.7846 46.32458 51.41901       54.65334 
1 1 1 -1  10 22 o 505.3213 29.72699 50.09620       5.808036      47.89196       7.033947      54.81929       10.29634  492.6358 37.03695 523.6041 51.29383 -30.96829      63.26763 
1 1 1 -1  10 23 o 1521.584 20.56658 451.2795       12.15307      451.6138       14.75739      450.5751       21.42338  1520.771 24.98721 1514.251 36.43024 6.520020       44.17605 
1 1 1 -1  10 24 o 729.5439 22.89374 103.8877       6.486287      101.6507       8.817924      106.5251       9.574730  719.9691 31.53730 736.5721 33.47212 -16.60309      45.98896 
1 1 1 -1  10 25 o 411.8829 43.42246 33.96522       6.841036      39.15401       8.012300      20.00698       13.14134  441.2945 47.50029 305.1341 97.88512 136.1604       108.8015 
1 1 1 -1  10 26 o 156.5897 62.02655 3.004207       5.605009      2.510639       7.503988      3.627096       8.429925  170.5243 70.23110 184.5330 75.03574 -14.00874      102.7753 
1 1 1 -1  10 27 o 829.8577 23.08659 134.8497       7.440315      142.5215       10.05731      125.5750       11.05814  850.5131 30.44899 796.1682 35.76427 54.34491       46.97046 
1 1 1 -1  10 28 o 358.8561 44.21912 26.31207       6.032155      25.72526       8.026888      27.07346       9.143225  346.9745 61.83639 352.2888 69.29905 -5.314209      92.87679 
1 1 1 -1  10 29 o 431.7324 45.15073 38.34441       7.458215      53.30993       11.95403      28.80596       9.543488  497.3042 63.33359 359.1689 70.93628 138.1352       95.09521 
1 1 1 -1  10 30 o 308.9626 54.11650 20.61268       6.256642      21.88655       8.403344      19.02815       9.372182  307.6732 71.66270 280.6464 81.29848 27.02689       108.3743 
1 1 1 -1  10 31 o 332.8822 51.63738 24.07624       6.459235      20.55215       8.983839      27.84748       9.293505  287.6899 78.31020 342.2160 72.19842 -54.52612      106.5134 
1 1 1 -1  10 32 o 311.0616 55.10369 21.80559       6.412982      22.70937       9.418409      21.02440       8.756387  294.7620 80.15965 286.2726 77.05784 8.489380       111.1912 
1 1 1 -1  11 1  o 1149.581 13.21038 256.8573       5.897700      253.0789       8.214953      260.8760       8.472209  1140.566 18.54628 1157.967 18.83963 -17.40186      26.43664 
1 1 1 -1  11 2  o 827.4381 12.95364 133.0686       4.162512      136.3055       5.889716      129.8384       5.883650  837.0668 18.11783 816.9324 18.54525 20.13440       25.92648 
1 1 1 -1  11 3  o 237.1063 25.23902 11.07939       2.288312      10.12702       3.085579      12.24336       3.411187  224.6680 36.62656 247.5430 36.58590 -22.87492      51.76903 
1 1 1 -1  11 4  o 886.1317 12.88760 152.6278       4.435047      152.4433       5.084363      153.2150       9.069889  885.4545 14.78571 886.4114 26.34745 -0.9568481     30.21267 
1 1 1 -1  11 5  o 424.8953 16.56545 35.11825       2.733462      35.04342       3.116574      35.36772       5.690476  424.3282 18.91244 423.7110 34.89227 0.6171875      39.68817 
1 1 1 -1  11 6  o 726.9338 12.95106 102.7304       3.656185      106.3107       5.206306      99.24662       5.135670  739.0746 18.13900 714.0630 18.51964 25.01166       25.92297 
1 1 1 -1  11 7  o 94.70282 38.59349 0.6731840      2.236268      2.487417       2.895798      -2.007302      3.519886  124.8214 45.71579 96.04563 43.57077 28.77578       63.15334 
1 1 1 -1  11 8  o 610.0555 15.96396 72.42967       3.782143      67.89824       4.679399      80.96747       6.423105  590.2413 20.41420 643.8578 25.68781 -53.61646      32.81163 
1 1 1 -1  11 9  o 413.8213 17.81611 33.35809       2.863213      36.56705       4.121645      30.36525       3.980436  431.9502 24.67256 393.2419 26.21433 38.70828       35.99898 
1 1 1 -1  11 10 o 558.2374 15.75507 60.67939       3.415603      64.67092       5.007547      57.20665       4.670799  575.4907 22.40571 541.2864 22.21959 34.20435       31.55513 
1 1 1 -1  11 11 o 250.6546 30.28651 12.50744       2.888392      11.70664       4.215421      13.21614       3.965622  238.4514 47.19169 255.1934 41.43542 -16.74205      62.80087 
1 1 1 -1  11 12 o 620.9888 18.64688 75.20245       4.496948      71.96505       7.662858      76.90307       5.553874  603.9158 32.79577 627.3059 22.79757 -23.39008      39.94111 
1 1 1 -1  11 13 f 262.6569 32.29955 13.76055       3.225254      16.24013       4.589416      11.34104       4.533494  283.0332 43.11563 233.6808 51.35643 49.35240       67.05551 
1 1 1 -1  11 14 o 254.9299 34.99560 13.02128       3.373263      11.75516       4.810903      14.24576       4.731125  237.8121 53.39854 263.6624 47.97220 -25.85028      71.78256 
1 1 1 -1  11 15 o 419.2961 23.58172 34.43585       3.824347      34.10371       5.382596      34.77444       5.434668  415.4088 33.65400 419.5021 33.64185 -4.093384      47.58536 
1 1 1 -1  11 16 o 563.7328 23.46157 62.00645       5.136394      80.36584       9.054152      53.29404       6.237172  638.5632 36.66407 520.8032 30.97773 117.7600       47.99868 
1 1 1 -1  11 17 o 630.6880 22.45115 77.54086       5.498969      73.02036       9.094940      80.14557       6.903783  608.5020 38.68758 640.5316 27.75355 -32.02960      47.61290 
1 1 1 -1  11 18 o 610.4734 24.10417 72.66060       5.714615      76.84239       9.661724      70.41048       7.087214  624.3251 40.06030 599.4470 30.54491 24.87817       50.37677 
1 1 1 -1  11 19 o 967.7821 17.32819 182.2234       6.512664      175.0254       8.950317      190.3231       9.494336  947.5759 24.32184 988.0524 24.74324 -40.47650      34.69553 
1 1 1 -1  11 20 o 714.3581 20.38671 99.36160       5.655762      106.3932       7.684602      91.05116       8.354198  738.4691 26.79545 682.5367 31.51743 55.93237       41.36840 
1 1 1 -1  11 21 o 444.2973 32.58425 38.82903       5.583030      41.49902       6.664269      32.54430       10.22448  458.4141 37.77024 397.5026 68.71899 60.91156       78.41486 
1 1 1 -1  11 22 o 543.0423 29.56374 57.85205       6.211295      63.02758       7.602526      47.46228       10.77168  565.8068 34.76722 484.2562 58.45977 81.55060       68.01694 
1 1 1 -1  11 23 o 210.5423 60.39582 9.128321       5.195210      11.38833       7.117881      6.551735       7.600076  235.2060 71.54769 198.9137 73.84821 36.29233       102.8233 
1 1 1 -1  11 24 o 779.0174 25.79335 118.6463       7.803381      116.4068       9.070224      125.0258       15.30861  770.6340 30.30692 790.8078 50.10567 -20.17377      58.55842 
1 1 1 -1  11 25 o 293.1013 60.93820 17.97663       6.710199      20.56036       7.568162      8.479950       14.50950  312.8378 64.43864 246.9530 99.13787 65.88484       118.2398 
1 1 1 -1  11 26 o 258.2174 60.15800 14.09683       5.920632      15.90137       7.956948      11.85841       8.862067  271.4022 73.62484 240.1279 80.57170 31.27429       109.1440 
1 1 1 -1  11 27 o 396.1183 39.09829 31.55521       5.936179      37.43471       7.880702      23.84385       9.025271  428.1210 48.23988 330.3093 72.35886 97.81174       86.96488 
1 1 1 -1  11 28 o 329.2708 57.62551 23.07496       7.100356      23.34170       11.27450      22.89963       9.140745  315.1424 88.48730 319.1106 75.02225 -3.968170      116.0101 
1 1 1 -1  11 29 o 293.4576 57.26898 18.65724       6.292399      10.25615       8.627624      28.20431       9.197259  219.2014 79.11733 354.9321 69.21067 -135.7307      105.1174 
1 1 1 -1  11 30 o 158.1697 64.07603 3.522077       6.121261      -3.113066      8.307084      11.40524       9.054693  143.6877 65.84804 223.4073 80.98779 -79.71954      104.3791 
1 1 1 -1  11 31 o 531.7192 33.01736 57.54874       6.784236      56.10596       9.408411      59.11148       9.791787  512.3497 47.83828 525.2678 48.55062 -12.91809      68.15911 
1 1 1 -1  11 32 f 173.0640 65.17404 6.425362       5.960988      -0.1142742     8.400274      13.05874       8.460266  150.5382 67.89005 224.2099 78.60982 -73.67172      103.8680 
1 1 1 -1  12 1  o 515.0859 14.80403 51.59152       2.961335      54.18774       4.151054      48.90088       4.225868  527.5580 20.26097 501.0622 21.71683 26.49582       29.70063 
1 1 1 -1  12 2  o 887.2272 13.31425 153.0317       4.587537      146.2228       6.268495      160.8842       6.731765  866.7750 18.62211 909.1411 19.06644 -42.36615      26.65168 
1 1 1 -1  12 3  o 833.9149 18.75781 135.3638       6.074798      135.3638       6.074798      0.000000       0.000000  833.9149 18.75781 ?        ?        0.000000       18.75781 
1 1 1 -1  12 4  f 1024.498 13.32779 204.0739       5.302700      211.3035       6.232724      185.1252       10.09046  1042.259 15.39835 973.8663 26.67988 68.39288       30.80463 
1 1 1 -1  12 5  o 301.2235 21.53655 17.77305       2.502760      17.31287       2.864308      19.25849       5.146209  296.8123 25.08393 309.6033 44.04261 -12.79095      50.68486 
1 1 1 -1  12 6  o 1099.566 15.72076 235.2735       6.713094      233.1501       8.000988      240.3233       12.33842  1094.082 18.83066 1108.544 28.66017 -14.46167      34.29285 
1 1 1 -1  12 7  o 677.0243 25.91531 89.57584       6.813789      0.000000       0.000000      89.57584       6.813789  ?        ?        677.0243 25.91531 0.000000       25.91531 
1 1 1 -1  12 8  o 670.2465 14.09093 87.41286       3.667769      88.87739       5.241991      86.00819       5.133722  675.1238 19.99332 664.1494 19.90392 10.97437       28.21168 
1 1 1 -1  12 9  o 341.3130 20.92512 22.81828       2.760245      21.07977       3.963885      24.45488       3.845937  326.1254 31.69791 352.1527 28.36223 -26.02737      42.53438 
1 1 1 -1  12 10 o 276.3211 26.06561 15.07710       2.764065      13.10884       4.033881      16.81914       3.795002  253.8831 42.40896 290.3159 34.32416 -36.43279      54.55885 
1 1 1 -1  12 11 o 492.9454 20.12493 47.41838       3.852664      43.96035       6.751752      49.08794       4.691412  470.4233 37.26214 501.0097 24.11179 -30.58643      44.38294 
1 1 1 -1  12 12 o 406.9651 21.42862 32.42412       3.374788      28.44444       4.853771      36.14850       4.695503  378.8281 33.33136 428.4984 28.37724 -49.67035      43.77496 
1 1 1 -1  12 13 o 558.7205 18.31892 60.84275       3.974865      56.91773       5.587701      64.86363       5.655529  539.2728 26.68066 575.9164 25.28633 -36.64355      36.75944 
1 1 1 -1  12 14 o 680.6386 19.93270 90.31526       5.268788      83.29671       9.221518      93.71695       6.419864  649.5839 36.70460 692.7418 23.86308 -43.15784      43.77983 
1 1 1 -1  12 15 o 277.3072 51.74039 15.74794       5.367142      0.000000       0.000000      15.74794       5.367142  ?        ?        277.3072 51.74039 0.000000       51.74039 
1 1 1 -1  12 16 o 972.1180 16.26108 183.8833       6.138982      183.5834       8.580741      184.1978       8.786580  970.3536 22.77020 971.8863 23.27965 -1.532654      32.56415 
1 1 1 -1  12 17 o 1457.566 19.05810 413.5974       10.78787      412.0637       18.40965      414.3994       13.31312  1451.233 32.66482 1457.996 23.51234 -6.762451      40.24699 
1 1 1 -1  12 18 o 982.5604 20.17298 187.9625       7.697633      192.3006       13.03686      185.6406       9.537716  991.4452 33.85916 975.7518 25.16964 15.69342       42.18950 
1 1 1 -1  12 19 o 150.8372 57.74209 3.134565       4.726885      4.261692       5.741406      0.7632681      8.327696  169.4230 63.92698 171.2334 72.48806 -1.810394      96.64977 
1 1 1 -1  12 20 o 337.9066 74.41990 23.84923       9.501936      0.000000       0.000000      23.84923       9.501936  ?        ?        337.9066 74.41990 0.000000       74.41990 
1 1 1 -1  12 21 o 887.2853 19.02129 153.3112       6.554374      161.5906       8.897779      143.4886       9.691580  909.9464 25.17896 856.7374 29.12855 53.20892       38.50263 
1 1 1 -1  12 22 o 397.1294 37.87117 31.29048       5.769973      24.60007       6.927186      46.44984       10.42727  347.9095 52.93966 478.9834 57.18668 -131.0740      77.92897 
1 1 1 -1  12 23 o 168.7756 61.34970 4.830320       5.200986      10.37317       6.857203      -2.677353      7.980554  225.6038 70.50679 150.2069 67.07674 75.39691       97.31647 
1 1 1 -1  12 24 o 232.3885 68.62915 11.24078       6.621724      5.122597       7.574306      31.07864       13.63890  188.2567 72.82424 375.7131 93.77184 -187.4564      118.7288 
1 1 1 -1  12 25 o 763.4263 23.74835 113.9687       7.040907      122.4838       9.632255      104.1984       10.31774  789.3596 31.42137 725.5567 36.73696 63.80286       48.34156 
1 1 1 -1  12 26 o 319.7997 47.53736 20.94658       5.724330      15.12804       7.696947      28.14816       8.562979  264.0399 72.73955 365.6017 62.55881 -101.5619      95.94085 
1 1 1 -1  12 27 o 283.5098 66.61420 17.52481       7.210018      26.74326       11.56772      11.66842       9.220059  340.9158 87.06386 235.6667 82.09538 105.2491       119.6652 
1 1 1 -1  12 28 o 160.8870 66.94933 2.443767       6.918224      3.583947       10.96025      1.688616       8.919703  195.0505 82.89380 172.7180 74.12328 22.33246       111.2009 
1 1 1 -1  12 29 o 271.2399 60.33549 16.28813       6.191441      13.14042       8.455979      19.92592       9.090446  238.2373 78.66799 289.7515 78.73273 -51.51414      111.2991 
1 1 1 -1  12 30 o 355.6361 47.66028 26.92095       6.416908      31.42026       8.820963      21.86353       9.352063  373.1530 63.12068 297.4986 79.44767 75.65439       101.4700 
1 1 1 -1  12 31 f 185.4095 67.38714 7.660231       6.274716      14.60123       8.991177      1.070242       8.760880  237.4279 81.14914 159.5514 70.82433 77.87657       107.7092 
1 1 1 -1  12 32 o 105.2979 50.37811 -5.975598      5.838698      2.306869       8.542563      -13.23682      7.998586  160.8009 70.72131 108.2751 53.36116 52.52571       88.59412 
1 1 1 -1  13 1  o 209.1005 29.87479 8.721330       2.357017      7.582265       3.146220      10.17836       3.558348  192.4359 43.16283 223.7299 42.50817 -31.29408      60.58031 
1 1 1 -1  13 2  o 869.7136 13.60840 147.1048       4.596332      152.1334       6.492632      142.0527       6.507783  883.8131 18.91614 853.9319 19.62374 29.88123       27.25640 
1 1 1 -1  13 3  o 386.4260 19.24670 29.09019       2.888355      32.44733       3.965838      25.29789       4.215043  406.8720 25.22291 358.1974 30.59406 48.67456       39.65087 
1 1 1 -1  13 4  o 688.2193 16.50421 92.20287       4.411126      91.01084       5.385386      94.63304       7.689415  683.3167 20.29396 695.5058 28.46850 -12.18915      34.96141 
1 1 1 -1  13 5  o 597.0194 14.88284 69.36153       3.450660      71.64254       3.958200      62.13864       7.043509  606.5760 16.80291 561.8953 32.41557 44.68079       36.51173 
1 1 1 -1  13 6  o 450.7242 19.83090 39.61069       3.471213      39.61069       3.471213      0.000000       0.000000  450.7242 19.83090 ?        ?        0.000000       19.83090 
1 1 1 -1  13 7  o 635.8145 14.27682 78.67757       3.525251      80.01932       4.943156      77.28889       5.028863  640.5287 19.87183 629.4059 20.57364 11.12280       28.60357 
1 1 1 -1  13 8  o 272.5997 24.42901 14.64481       2.558748      14.85797       3.646819      14.43812       3.591059  272.4572 35.29526 268.5181 35.29148 3.939056       49.91236 
1 1 1 -1  13 9  o 144.9256 42.62666 4.242023       2.559135      8.213367       3.692633      0.5717345      3.549911  199.0174 48.27208 114.1503 47.76756 84.86711       67.91122 
1 1 1 -1  13 10 o 123.8771 45.92199 2.412958       2.936705      -1.783822      5.270234      4.302874       3.536658  122.5266 54.62748 150.9586 50.89804 -28.43201      74.66440 
1 1 1 -1  13 11 o 717.4550 17.66756 100.3143       4.922652      105.2542       8.861463      98.10947       5.920149  732.1139 31.16727 708.9090 21.50375 23.20490       37.86568 
1 1 1 -1  13 12 o 567.5293 20.13939 62.81835       4.438769      62.16011       8.107903      63.10007       5.304263  560.3311 37.47548 568.2712 24.03485 -7.940063      44.52061 
1 1 1 -1  13 13 o 417.0619 25.57531 34.11834       4.122373      37.33137       7.356567      32.64758       4.977240  432.1279 44.47134 406.8228 31.75482 25.30515       54.64493 
1 1 1 -1  13 14 o 426.0451 23.45842 35.52235       3.866389      32.33227       5.431965      38.79825       5.504558  404.4349 34.92709 443.8553 32.15186 -39.42041      47.47256 
1 1 1 -1  13 15 o 371.8999 27.72841 27.16618       3.975998      29.66377       5.538984      24.51126       5.710771  387.0050 37.31656 350.2690 42.87749 36.73599       56.84193 
1 1 1 -1  13 16 o 566.8555 22.24099 62.61465       4.896147      60.63371       6.894267      64.63037       6.954522  555.8554 32.07355 574.0793 31.31201 -18.22394      44.82359 
1 1 1 -1  13 17 o 541.3325 25.93577 57.15280       5.452445      62.71078       8.711321      53.57305       6.991204  563.9615 40.03481 522.0818 34.67871 41.87964       52.96602 
1 1 1 -1  13 18 o 573.9650 31.78604 64.57462       7.057528      61.80129       9.532806      67.93839       10.49866  558.9869 44.27504 585.7009 46.53987 -26.71393      64.23580 
1 1 1 -1  13 19 o 616.8295 22.02872 74.11983       5.276941      68.28414       6.980916      81.89983       8.060386  590.3932 30.55151 647.2249 32.06806 -56.83167      44.29170 
1 1 1 -1  13 20 o 1344.785 17.27259 351.9524       9.020656      340.5469       12.10299      366.2065       13.53026  1321.528 23.58241 1369.944 25.43171 -48.41516      34.68288 
1 1 1 -1  13 21 o 521.9760 27.42159 53.39278       5.539201      62.00727       7.444901      42.71066       8.290348  561.2291 34.32284 462.4120 46.81019 98.81702       58.04525 
1 1 1 -1  13 22 o 428.7949 35.94695 36.38620       5.930804      36.26486       7.187347      36.64512       10.49923  426.0817 44.07284 421.1945 66.38512 4.887268       79.68312 
1 1 1 -1  13 23 o 141.0233 61.04116 -0.4300269     6.150926      1.801906       6.897341      -9.100220      13.59426  161.7402 67.03807 179.1585 82.86909 -17.41832      106.5898 
1 1 1 -1  13 24 o 663.9633 25.63307 86.25581       6.609562      101.6288       8.980292      68.08478       9.763398  719.1458 32.15478 584.3016 43.33529 134.8442       53.96181 
1 1 1 -1  13 25 o 538.4229 30.93574 57.22298       6.441449      56.69965       8.595041      57.89352       9.729188  532.3611 41.91217 535.8744 47.23349 -3.513245      63.14771 
1 1 1 -1  13 26 o 365.7184 44.08941 27.18923       6.135683      14.95411       8.008740      44.57516       9.546824  261.0667 75.01585 464.9410 53.87099 -203.8743      92.35508 
1 1 1 -1  13 27 o 149.8483 64.45760 0.5881351      6.773064      -12.80233      10.43399      10.33957       8.904035  138.0462 66.38541 224.0865 80.43468 -86.04030      104.2917 
1 1 1 -1  13 28 o 133.0326 58.66155 -0.6819295     5.913495      5.961444       7.841383      -9.442622      9.004665  187.8033 73.68932 132.1152 63.02950 55.68814       96.96821 
1 1 1 -1  13 29 o 325.0100 52.53853 22.73429       6.405108      21.98969       8.775585      23.58319       9.369987  305.1174 74.66756 314.3057 77.30047 -9.188263      107.4737 
1 1 1 -1  13 30 o 361.1155 47.24363 27.89830       6.466612      33.18312       9.223491      22.78925       9.068812  379.9554 64.83447 303.4388 76.86932 76.51657       100.5604 
1 1 1 -1  13 31 o 203.8718 66.28220 9.968705       6.011542      15.89240       8.597450      4.301991       8.408894  245.9774 79.20179 171.0985 72.65849 74.87892       107.4811 
1 1 1 -1  14 1  o 666.9280 14.49156 86.55282       3.753375      89.02155       5.259326      83.99039       5.358203  675.7164 20.04185 656.2101 21.02559 19.50623       29.04739 
1 1 1 -1  14 2  o 467.9055 17.36234 42.64504       3.154963      45.32779       4.408249      39.82788       4.517333  481.7681 23.56135 450.5945 25.92409 31.17361       35.03135 
1 1 1 -1  14 3  o 451.9046 18.30332 39.79605       3.212216      39.89546       4.375525      39.67985       4.730762  451.0818 25.07637 449.4706 27.23050 1.611145       37.01789 
1 1 1 -1  14 4  o 420.8396 19.56796 34.53480       3.198086      37.94109       4.381315      30.65009       4.678890  439.6920 25.77086 394.0789 30.81791 45.61313       40.17313 
1 1 1 -1  14 5  o 259.1685 31.34854 13.37340       3.091063      13.37340       3.091063      0.000000       0.000000  259.1685 31.34854 ?        ?        0.000000       31.34854 
1 1 1 -1  14 6  o 191.8560 36.38132 7.488663       2.611510      6.289095       2.964150      11.64950       5.520495  174.6583 43.78366 235.5670 60.13783 -60.90874      74.38795 
1 1 1 -1  14 7  o 371.5560 21.23265 27.03789       3.051059      29.92103       3.530173      18.52607       6.065597  390.5839 23.38054 299.5171 54.13899 91.06677       58.97186 
1 1 1 -1  14 8  f 699.1396 14.67786 95.15732       3.985241      87.39362       5.494284      103.7770       5.789241  669.0894 21.14458 729.2395 20.44200 -60.15015      29.41035 
1 1 1 -1  14 9  o 238.2796 34.76197 11.40460       3.122057      4.792652       5.409236      14.70751       3.823132  169.4171 62.41575 270.5852 37.38027 -101.1681      72.75308 
1 1 1 -1  14 10 o 561.1646 18.87437 61.39096       4.113304      62.38150       7.228964      60.91672       5.001979  562.3871 33.24657 558.4469 23.06386 3.940247       40.46327 
1 1 1 -1  14 11 f 259.1946 34.29067 13.42458       3.366931      21.68787       6.527654      10.42930       3.930061  325.5331 53.49232 225.3162 46.45727 100.2170       70.84988 
1 1 1 -1  14 12 o 234.6497 36.73224 11.07723       3.237500      17.20281       4.766188      5.829672       4.411399  292.0681 43.33456 173.4903 56.79790 118.5778       71.44148 
1 1 1 -1  14 13 f 203.1345 42.99793 8.436449       3.286301      5.660385       4.893221      10.71743       4.435485  174.7627 59.86436 228.0509 51.32164 -53.28813      78.85210 
1 1 1 -1  14 14 o 891.8278 15.97871 154.7446       5.534147      164.7370       8.040386      145.7492       7.628759  919.2795 22.52171 864.6497 22.71882 54.62976       31.99019 
1 1 1 -1  14 15 o 658.2919 19.00156 84.36103       4.857757      89.04112       6.906636      79.77919       6.833755  675.5153 26.32712 639.2726 27.52614 36.24274       38.08944 
1 1 1 -1  14 16 o 250.3506 58.83499 12.92819       5.623453      16.48031       7.685092      8.834171       8.250504  281.4298 70.47211 220.7403 77.61597 60.68947       104.8359 
1 1 1 -1  14 17 o 417.6234 32.92918 34.30544       5.297317      34.98368       8.161909      33.81180       6.963157  418.0143 51.35770 412.4914 44.15307 5.522949       67.72818 
1 1 1 -1  14 18 o 375.1360 32.94078 27.72680       4.750402      26.73321       6.477421      28.88310       6.987732  365.6146 46.68528 379.8389 48.47598 -14.22424      67.30109 
1 1 1 -1  14 19 o 189.5176 57.64544 7.192394       4.620628      6.342697       6.207142      8.248442       6.919921  189.5099 67.24924 209.1781 71.19265 -19.66818      97.93290 
1 1 1 -1  14 20 o 664.6207 21.92124 86.11543       5.658053      84.08940       7.605476      88.62652       8.467082  655.6371 29.86998 672.6522 32.41270 -17.01508      44.07719 
1 1 1 -1  14 21 o 117.3202 52.39616 -1.851614      4.870879      5.813892       6.285583      -13.37456      7.706495  184.9193 67.40934 112.4086 54.75930 72.51065       86.84814 
1 1 1 -1  14 22 o 186.8890 69.90969 5.618740       6.836345      5.618740       6.836345      0.000000       0.000000  186.8890 69.90969 ?        ?        0.000000       69.90969 
1 1 1 -1  14 23 o 166.0024 67.28043 2.754063       6.752188      2.783920       7.587178      2.640372       14.80537  173.5878 70.95341 225.3021 96.06048 -51.71423      119.4236 
1 1 1 -1  14 24 o 689.2909 25.01224 93.00002       6.695501      94.00873       8.932024      91.70621       10.11582  690.8954 33.28968 679.7609 38.47713 11.13458       50.87919 
1 1 1 -1  14 25 o 131.6893 58.33098 -1.396612      5.911736      4.592110       7.781281      -9.572389      9.091772  183.8653 73.00294 135.5858 64.29794 48.27951       97.28132 
1 1 1 -1  14 26 o 191.0577 71.76377 6.469183       7.218248      6.772860       11.74143      6.284682       9.151982  217.2490 88.47175 200.7936 79.34653 16.45540       118.8407 
1 1 1 -1  14 27 o 521.1690 32.92731 54.29478       6.630165      60.18141       9.075769      47.55780       9.709186  543.2224 43.38262 476.7058 53.36026 66.51654       68.77041 
1 1 1 -1  14 28 o 538.3449 31.90732 58.11797       6.641068      67.36990       8.942776      46.74213       9.916259  574.4268 40.34340 467.6843 55.69189 106.7424       68.76901 
1 1 1 -1  14 29 o 412.4738 41.08100 35.31035       6.493048      32.64499       8.900689      38.34226       9.493017  381.4456 62.23063 415.1997 60.66339 -33.75415      86.90626 
1 1 1 -1  14 30 o 501.6536 34.32011 51.56635       6.646057      64.64498       9.403796      38.51468       9.394097  552.7009 44.18045 411.4254 60.61030 141.2755       75.00347 
1 1 1 -1  14 31 o 309.9883 54.43319 21.76733       6.313878      30.31031       9.041952      13.63767       8.820509  353.2884 68.37447 226.9473 80.20508 126.3411       105.3941 
1 1 1 -1  15 1  o 1270.076 14.44245 313.9754       7.123584      327.7831       10.35866      301.5864       9.812086  1296.109 20.57946 1243.313 20.32137 52.79651       28.92183 
1 1 1 -1  15 2  o 163.9370 42.10918 5.525216       2.695041      8.738228       3.685220      1.831264       3.951416  205.5677 47.16313 130.0914 51.90555 75.47632       70.13235 
1 1 1 -1  15 3  o 192.2017 39.27795 7.557471       2.832786      6.245112       3.830269      9.142002       4.208753  175.2620 52.30046 209.6734 51.95266 -34.41141      73.71850 
1 1 1 -1  15 4  f 749.3472 17.65482 109.4342       5.137766      109.7743       6.121066      108.6234       9.451741  749.9396 21.01710 743.2617 32.74479 6.677917       38.90937 
1 1 1 -1  15 5  o 108.3389 42.66238 1.363799       2.637150      0.5250931      2.998622      4.227000       5.540420  105.5589 44.01396 165.7390 62.73521 -60.18015      76.63508 
1 1 1 -1  15 6  o 380.6436 21.19204 28.36846       3.120284      28.58964       3.555410      27.62714       6.509202  381.6700 24.11081 369.9206 46.32559 11.74939       52.22443 
1 1 1 -1  15 7  o 582.9048 16.76768 66.19033       3.795758      67.04176       4.369538      63.57197       7.662589  586.3496 19.18894 567.1796 34.95815 19.17004       39.87841 
1 1 1 -1  15 8  f 338.9295 30.88726 22.72169       4.020890      25.06827       5.210134      19.26580       6.322816  354.4330 38.46944 305.5813 55.31542 48.85175       67.37725 
1 1 1 -1  15 9  o 404.9857 28.73806 32.28064       4.490513      0.000000       0.000000      32.28064       4.490513  ?        ?        404.9857 28.73806 0.000000       28.73806 
1 1 1 -1  15 10 o 208.4653 55.55317 8.995715       4.578837      8.995715       4.578837      0.000000       0.000000  208.4653 55.55317 ?        ?        0.000000       55.55317 
1 1 1 -1  15 11 o 1007.421 14.88129 197.4575       5.822096      198.7416       8.355476      196.2455       8.117073  1009.650 21.30945 1003.379 20.83082 6.270874       29.79959 
1 1 1 -1  15 12 o 722.4980 16.40126 101.5823       4.601951      97.60027       6.688722      105.1616       6.341440  707.2685 24.35179 734.4472 22.23306 -27.17871      32.97451 
1 1 1 -1  15 13 o 610.8658 18.51417 72.64364       4.392160      82.44029       6.531818      64.55811       5.934028  649.9649 25.87714 575.0916 26.56957 74.87329       37.08865 
1 1 1 -1  15 14 o 780.6965 17.06238 118.5853       5.173087      124.1442       7.639356      113.8776       7.030243  797.9186 24.65302 764.3357 23.68417 33.58289       34.18642 
1 1 1 -1  15 15 o 1268.792 18.80611 313.3009       9.266540      318.1064       11.34824      303.6853       16.05267  1277.795 22.86860 1246.202 33.16888 31.59302       40.28830 
1 1 1 -1  15 16 o 466.6027 28.28757 42.64074       5.101700      49.41283       8.550155      38.89673       6.357418  499.4589 44.54810 444.1333 37.20132 55.32556       58.03853 
1 1 1 -1  15 17 o 493.4041 29.33681 47.69987       5.596063      53.66112       9.476759      44.50834       6.934103  519.8553 47.46417 475.0958 37.89742 44.75958       60.73765 
1 1 1 -1  15 18 o 399.9889 31.57753 31.47805       4.865278      27.65098       6.564908      36.14114       7.246571  371.7506 46.48895 426.2196 44.43275 -54.46902      64.30779 
1 1 1 -1  15 19 o 257.6834 70.60757 13.84862       7.275187      0.000000       0.000000      13.84862       7.275187  ?        ?        257.6834 70.60757 0.000000       70.60757 
1 1 1 -1  15 20 o 617.6255 24.37360 74.46735       5.846190      63.17641       7.833761      88.66016       8.782936  566.0433 35.82103 671.4509 33.79002 -105.4075      49.24340 
1 1 1 -1  15 21 o 374.6509 38.47808 27.92344       5.518938      23.46102       7.255479      34.05055       8.501754  338.0125 57.32004 409.5264 54.83278 -71.51382      79.32352 
1 1 1 -1  15 22 o 565.6323 37.29003 63.29784       8.145387      63.29784       8.145387      0.000000       0.000000  565.6323 37.29003 ?        ?        0.000000       37.29003 
1 1 1 -1  15 23 o 278.7370 57.05990 16.19661       5.968692      16.94275       7.948015      15.23162       9.038813  281.3931 72.33302 267.2480 80.47726 14.14511       108.2065 
1 1 1 -1  15 24 o 109.1294 51.80656 -6.795136      5.932993      4.559050       8.126941      -19.75183      8.681529  186.6986 74.45552 108.5150 53.85807 78.18353       91.89296 
1 1 1 -1  15 25 o 187.9211 71.30324 5.972273       7.168014      3.202016       11.42441      7.770894       9.205419  200.2085 84.83657 210.8922 80.61594 -10.68372      117.0307 
1 1 1 -1  15 26 o 610.7996 34.08789 74.49808       8.053620      67.56911       12.72709      79.12562       10.40089  566.5686 58.69407 624.4342 43.15473 -57.86560      72.85139 
1 1 1 -1  15 27 o 546.7045 31.80655 59.77714       6.723822      62.77101       9.078029      56.13872       10.00763  554.0480 42.51488 518.6195 50.32169 35.42847       65.87707 
1 1 1 -1  15 28 o 328.8945 49.97308 23.08573       6.182081      23.32106       8.421903      22.81077       9.103377  317.5066 70.16936 309.4626 76.24340 8.043976       103.6185 
1 1 1 -1  15 29 o 156.0288 63.14901 3.715000       5.939376      -3.164969      8.363669      10.71430       8.435889  141.7469 65.36586 213.4562 78.05031 -71.70923      101.8064 
1 1 1 -1  15 30 o 408.3851 40.48430 35.12381       6.336131      37.96892       8.911516      32.21509       9.010591  409.3522 57.65377 369.6399 65.14970 39.71234       86.99678 
1 1 1 -1  16 1  o 640.7664 21.72744 80.15391       5.406750      80.15391       5.406750      0.000000       0.000000  640.7664 21.72744 ?        ?        0.000000       21.72744 
1 1 1 -1  16 2  o 295.0988 26.83684 17.18505       3.041962      15.40706       4.074629      19.42378       4.572204  276.7267 38.99616 311.3850 38.63978 -34.65833      54.89748 
1 1 1 -1  16 3  o 847.1485 17.33890 139.8275       5.704388      138.6254       6.772077      142.7640       10.58432  842.8937 20.68812 852.5355 31.96850 -9.641846      38.07865 
1 1 1 -1  16 4  o 458.3150 20.10960 40.97164       3.579279      39.01154       4.870633      43.27292       5.277547  445.3620 28.30774 468.9784 29.12078 -23.61646      40.61216 
1 1 1 -1  16 5  o 748.0306 15.01152 108.9199       4.360859      114.4297       5.097027      93.87077       8.423710  766.4329 17.12438 691.5753 31.36433 74.85760       35.73465 
1 1 1 -1  16 6  o 659.9436 16.02392 84.79995       4.106800      82.24471       4.662469      93.64417       8.674208  649.6327 18.48077 690.6210 32.34164 -40.98828      37.24944 
1 1 1 -1  16 7  o 248.7214 38.96957 12.47544       3.640513      10.48612       4.429184      16.61808       6.391605  225.0449 51.75814 282.4543 60.11395 -57.40941      79.32586 
1 1 1 -1  16 8  f 556.7766 37.61695 61.27724       8.086072      0.000000       0.000000      61.27724       8.086072  ?        ?        556.7766 37.61695 0.000000       37.61695 
1 1 1 -1  16 9  o 337.6518 33.91637 22.58227       4.387278      0.000000       0.000000      22.58227       4.387278  ?        ?        337.6518 33.91637 0.000000       33.91637 
1 1 1 -1  16 10 o 596.4492 17.18011 69.24701       3.979488      66.62803       5.659393      71.80840       5.596821  584.2758 24.94158 606.7086 23.75381 -22.43280      34.44308 
1 1 1 -1  16 11 o 585.2588 17.90562 66.67400       4.069728      72.25877       5.981568      61.86050       5.553204  608.5355 25.31053 563.0411 25.39660 45.49432       35.85540 
1 1 1 -1  16 12 o 357.8663 26.85877 25.13465       3.705575      29.96014       5.490744      21.09858       5.021576  389.2459 36.75793 325.2824 40.63797 63.96347       54.79589 
1 1 1 -1  16 13 o 666.7742 21.64089 86.59688       5.603792      99.54398       7.115668      65.45461       9.092957  714.4363 25.64627 576.0001 40.91563 138.4362       48.28892 
1 1 1 -1  16 14 o 1030.314 15.93986 206.4554       6.377967      200.4897       8.999430      212.4755       9.040323  1014.473 22.84266 1044.438 22.28812 -29.96497      31.91469 
1 1 1 -1  16 15 o 1078.343 18.59849 226.2763       7.788653      241.4897       14.02104      219.4866       9.366787  1111.576 32.47979 1061.483 22.72216 50.09241       39.63878 
1 1 1 -1  16 16 o 349.9180 37.71782 24.26295       5.044539      19.78035       8.240803      26.94927       6.379453  308.4607 70.35112 367.3727 45.70238 -58.91202      83.89272 
1 1 1 -1  16 17 o 818.1182 35.79277 131.1461       11.37206      131.1461       11.37206      0.000000       0.000000  818.1182 35.79277 ?        ?        0.000000       35.79277 
1 1 1 -1  16 18 o 1158.631 17.70177 261.3217       7.965079      262.7303       11.15143      259.8546       11.38072  1160.367 24.74612 1153.849 25.39760 6.517822       35.45996 
1 1 1 -1  16 19 o 121.6336 53.29978 -0.9739559     4.813223      7.281471       6.687154      -9.848494      6.933371  199.3415 69.88859 112.8144 54.21726 86.52711       88.45296 
1 1 1 -1  16 20 o 827.4268 20.87000 133.4919       6.706255      139.9748       9.139991      125.9317       9.870200  845.9234 27.82190 801.4916 31.71020 44.43176       42.18524 
1 1 1 -1  16 21 o 741.2978 27.88987 107.5575       8.029106      104.9981       8.998772      117.5502       17.78112  731.5853 31.67308 761.6788 60.61327 -30.09351      68.38971 
1 1 1 -1  16 22 o 888.6719 24.24586 154.3948       8.367717      162.1790       10.20943      138.4644       14.60523  909.5023 28.90478 833.4376 45.29404 76.06464       53.73115 
1 1 1 -1  16 23 o 152.3341 61.95596 2.265530       5.748705      12.51909       7.728405      -10.43491      8.601255  243.0809 74.66931 128.7276 61.46540 114.3533       96.71350 
1 1 1 -1  16 24 o 323.7931 52.11936 21.74845       6.331422      17.39781       8.450691      27.31561       9.559435  280.9517 75.73248 354.7289 71.85455 -73.77725      104.3958 
1 1 1 -1  16 25 o 233.3563 72.05674 11.88957       7.186390      7.752093       11.87491      14.28051       9.027077  221.7010 89.44457 253.2649 81.11553 -31.56389      120.7479 
1 1 1 -1  16 26 f 163.3748 64.23599 4.033051       5.970042      9.030949       8.138945      -1.788065      8.783701  210.4606 76.70844 155.9457 69.95226 54.51489       103.8148 
1 1 1 -1  16 27 f 413.1810 39.34403 34.95507       6.236922      37.55749       8.327578      31.63046       9.412391  420.5894 52.09876 375.4728 67.00757 45.11658       84.87812 
1 1 1 -1  16 28 o 176.5430 65.63293 6.293120       6.007249      7.461910       8.469959      5.110107       8.521339  194.2759 76.47183 180.9510 74.71698 13.32489       106.9138 
1 1 1 -1  16 29 o 450.9060 35.87665 41.92199       6.230443      53.54154       8.842047      30.46330       8.780629  500.8794 45.96899 361.1767 64.99030 139.7027       79.60456 
1 1 1 -1  17 1  o 1056.185 20.38025 217.5278       8.359447      217.5278       8.359447      0.000000       0.000000  1056.185 20.38025 ?        ?        0.000000       20.38025 
1 1 1 -1  17 2  o 802.2347 21.22863 125.5389       6.613807      125.5389       6.613807      0.000000       0.000000  802.2347 21.22863 ?        ?        0.000000       21.22863 
1 1 1 -1  17 3  o 1149.624 15.12874 257.2146       6.754395      266.5918       9.576474      247.9320       9.528023  1169.141 21.09166 1127.322 21.76340 41.81921       30.30683 
1 1 1 -1  17 4  o 315.6369 27.34088 19.62778       3.318312      22.68152       4.534975      16.10857       4.868345  338.0202 35.05627 281.7093 46.09373 56.31091       57.91005 
1 1 1 -1  17 5  o 491.6591 22.19998 47.15580       4.238817      46.85897       5.190765      47.74997       7.343840  488.7574 27.45826 490.9531 38.83422 -2.195709      47.56104 
1 1 1 -1  17 6  o 425.2328 43.43674 36.05751       7.072478      0.000000       0.000000      36.05751       7.072478  ?        ?        425.2328 43.43674 0.000000       43.43674 
1 1 1 -1  17 7  o 102.1164 45.39869 -1.272082      3.613097      -0.4837649     4.399753      -2.904714      6.331727  119.0754 51.58341 131.0618 59.03926 -11.98645      78.39951 
1 1 1 -1  17 8  o 453.6644 21.54546 40.11259       3.795932      39.22929       4.334140      43.02128       7.865005  447.6633 25.03033 465.1065 44.06879 -17.44318      50.68111 
1 1 1 -1  17 9  o 844.0519 15.89791 138.6007       5.211194      134.6908       5.895921      152.5622       11.14113  831.8089 18.25156 882.8715 32.49404 -51.06262      37.26905 
1 1 1 -1  17 10 o 491.9545 19.67341 47.12407       3.758657      54.46994       5.432224      40.37712       5.206072  527.6511 26.59509 453.6261 29.71603 74.02502       39.87909 
1 1 1 -1  17 11 o 1100.330 15.36551 235.4667       6.565953      243.1575       9.445508      228.2755       9.133660  1117.267 21.76910 1082.544 21.72558 34.72314       30.75540 
1 1 1 -1  17 12 o 918.3634 19.02293 164.1423       6.784532      160.3781       8.128599      172.7865       12.31802  907.2844 23.06982 939.9327 33.74551 -32.64838      40.87758 
1 1 1 -1  17 13 o 504.7780 22.03572 49.62294       4.319721      46.63140       6.308052      52.26460       5.927690  487.2503 33.54042 516.5817 29.67190 -29.33139      44.78149 
1 1 1 -1  17 14 o 1056.293 18.55153 217.1118       7.610131      227.4432       13.61057      212.4128       9.179036  1078.786 32.48727 1044.262 22.63391 34.52332       39.59440 
1 1 1 -1  17 15 o 475.7493 27.60631 44.31211       5.078590      39.81343       8.686207      46.64870       6.260056  446.3206 51.03083 487.2915 33.27866 -40.97083      60.92303 
1 1 1 -1  17 16 o 444.5760 30.10496 38.80088       5.167074      33.24283       8.853769      41.67166       6.363077  405.1445 57.92022 459.7781 35.92145 -54.63354      68.15498 
1 1 1 -1  17 17 o 468.3559 31.54009 43.12201       5.703362      40.99679       9.397239      44.36134       7.176174  451.0523 54.77066 473.4731 39.38478 -22.42078      67.46100 
1 1 1 -1  17 18 o 362.5516 36.01842 26.05875       5.004208      35.41104       7.160060      17.12808       6.996800  421.1916 44.44437 286.4966 64.44651 134.6950       78.28572 
1 1 1 -1  17 19 o 425.4871 33.18841 35.72593       5.440675      36.62998       7.715556      34.83178       7.673172  427.4222 47.27314 416.3740 48.35326 11.04819       67.62239 
1 1 1 -1  17 20 o 662.1685 29.20907 85.87366       7.511283      78.51186       8.769080      106.1569       14.55563  630.7836 35.94576 727.8962 51.82981 -97.11261      63.07478 
1 1 1 -1  17 21 o 769.4021 30.54237 116.1618       9.126078      116.1618       9.126078      0.000000       0.000000  769.4021 30.54237 ?        ?        0.000000       30.54237 
1 1 1 -1  17 22 o 424.4055 39.05254 35.96575       6.364415      32.76565       7.834868      42.17392       10.91268  400.8363 51.52399 450.0869 64.25599 -49.25061      82.36233 
1 1 1 -1  17 23 o 362.8436 42.41986 26.62968       5.864633      35.02259       7.805780      15.75156       8.886630  413.9806 49.53594 267.9750 79.59455 146.0056       93.75021 
1 1 1 -1  17 24 o 357.7336 55.79445 26.85469       7.498458      28.80949       12.43022      25.73638       9.401791  351.7371 90.48093 341.5144 73.09538 10.22269       116.3174 
1 1 1 -1  17 25 o 386.7278 42.80472 30.59919       6.320922      29.72889       8.723073      31.56139       9.172090  370.7940 62.82011 381.4514 64.19557 -10.65738      89.81891 
1 1 1 -1  17 26 o 311.6886 51.35599 20.66675       5.999866      16.23922       8.317518      25.46996       8.663221  263.5559 76.65697 336.1989 68.67327 -72.64301      102.9190 
1 1 1 -1  17 27 o 286.8923 56.38313 18.16078       6.057965      22.33340       8.566709      13.98709       8.567803  307.4394 72.86398 240.9287 79.16863 66.51062       107.5957 
1 1 1 -1  17 28 o 465.2817 34.46605 44.29744       6.183519      48.47363       8.776017      40.18011       8.713945  475.6663 48.17233 428.1305 53.58314 47.53580       72.05363 
1 1 1 -1  17 29 o 238.8201 63.52619 13.65212       5.994513      32.60529       8.616542      -4.125362      8.345018  375.4456 61.20489 136.0220 63.59372 239.4235       88.26211 
1 1 1 -1  18 1  o 718.3167 18.74551 100.4901       5.229271      104.1510       6.228829      91.74923       9.624700  730.8817 21.94479 682.6129 36.43827 48.26880       42.53612 
1 1 1 -1  18 2  o 1149.692 17.17985 257.2974       7.670589      257.2333       9.403270      257.4250       13.26119  1148.831 21.07631 1147.142 29.76717 1.689575       36.47321 
1 1 1 -1  18 3  o 419.1329 25.20685 34.41292       4.083891      33.96972       5.049730      35.25084       6.943341  415.3855 31.53869 420.7538 43.10080 -5.368378      53.40756 
1 1 1 -1  18 4  o 255.3793 46.10979 13.25681       4.404777      12.15250       6.078771      14.47771       6.391585  241.8890 63.79454 263.7594 63.22140 -21.87047      89.81475 
1 1 1 -1  18 5  o 135.9354 56.11142 1.182392       4.803631      6.898585       7.929929      -2.130947      6.037385  204.3418 75.51882 131.3416 58.51951 73.00020       95.53860 
1 1 1 -1  18 6  f 120.2147 49.59098 0.8937542      3.748924      5.990814       4.655929      -8.503341      6.321837  176.9801 58.37078 109.5563 52.41693 67.42380       78.45178 
1 1 1 -1  18 7  o 755.1883 16.31102 110.9535       4.783706      106.6568       5.429058      125.8719       10.11624  740.1801 18.88683 802.0845 32.47662 -61.90442      37.56918 
1 1 1 -1  18 8  o 283.0854 32.31792 15.87253       3.489269      14.34479       3.974491      21.00845       7.287304  267.5916 39.42714 319.8816 60.88523 -52.29001      72.53627 
1 1 1 -1  18 9  o 126.1217 48.77759 2.041522       3.397484      -0.2866176     3.899226      9.381869       6.923604  113.5013 48.86486 219.0207 71.12920 -105.5195      86.29679 
1 1 1 -1  18 10 o 908.5009 18.30663 160.6053       6.458949      167.2777       7.872727      146.8671       11.29661  926.7657 21.87395 866.6338 33.56482 60.13196       40.06329 
1 1 1 -1  18 11 o 257.4143 37.54238 13.24161       3.642585      12.28381       5.264067      14.12158       5.045658  244.4142 56.57648 263.2682 51.19391 -18.85399      76.30016 
1 1 1 -1  18 12 o 490.3318 21.92745 46.82004       4.175478      39.89906       5.920963      53.66697       5.889200  450.4630 34.09851 523.5942 29.07675 -73.13126      44.81256 
1 1 1 -1  18 13 o 310.8009 37.61671 19.18917       4.447932      17.24102       7.631295      20.19150       5.473861  288.1888 69.08360 317.2947 45.74418 -29.10590      82.85574 
1 1 1 -1  18 14 o 322.7261 37.74736 20.68354       4.641572      26.79273       8.131752      17.73122       5.652928  362.7709 59.80395 295.6459 51.08238 67.12500       78.65063 
1 1 1 -1  18 15 o 805.1956 20.54692 126.2809       6.425043      127.9493       11.23317      125.4697       7.832799  807.9734 35.79953 801.9915 25.14891 5.981873       43.75013 
1 1 1 -1  18 16 o 81.27289 40.13591 -10.14302      4.605361      -10.21755      7.935732      -10.10517      5.655054  123.5794 59.01619 95.99847 46.79650 27.58089       75.31815 
1 1 1 -1  18 17 f 931.3771 18.51945 168.9485       6.698561      168.6938       9.626508      169.1876       9.326984  929.1774 26.67731 930.7222 25.80437 -1.544800      37.11528 
1 1 1 -1  18 18 o 106.4885 49.37535 -4.011537      4.869161      11.33732       6.991078      -18.47134      6.785585  234.6161 70.80489 91.19733 45.63088 143.4188       84.23486 
1 1 1 -1  18 19 o 397.2485 41.80276 31.50240       6.352268      21.22488       7.589834      55.53770       11.60681  319.1620 63.46849 523.1521 58.11094 -203.9901      86.05307 
1 1 1 -1  18 20 o 261.7761 63.78009 14.43447       6.424377      8.314751       7.557811      30.37204       12.19667  210.7001 74.26627 373.8569 85.82066 -163.1568      113.4930 
1 1 1 -1  18 21 o 545.0488 32.21727 58.66106       6.789196      61.15117       8.399238      53.96748       11.53143  554.3334 39.26999 512.7971 58.97815 41.53632       70.85587 
1 1 1 -1  18 22 o 430.9118 40.24763 37.26646       6.657316      33.86340       8.193447      43.87785       11.42029  405.6702 53.29737 456.0865 66.42755 -50.41632      85.16589 
1 1 1 -1  18 23 o 443.7103 45.59960 40.08336       7.745788      49.51868       12.40726      34.05743       9.915383  480.8447 68.36745 398.5897 66.39073 82.25504       95.29868 
1 1 1 -1  18 24 o 215.4165 71.82053 9.901711       7.041787      4.817748       11.77166      12.73474       8.787428  206.0477 86.64680 240.1740 80.23343 -34.12630      118.0892 
1 1 1 -1  18 25 o 149.8659 61.49553 2.475427       5.727029      4.046021       7.912412      0.7472090      8.299965  176.3308 72.31038 162.0621 70.52699 14.26871       101.0091 
1 1 1 -1  18 26 o 155.8091 62.23641 3.611946       5.686978      -0.2062433     8.322193      6.956915       7.789420  155.7235 69.08139 190.8018 73.83926 -35.07822      101.1161 
1 1 1 -1  18 27 o 300.0999 49.18075 19.48384       5.533165      18.28136       8.091011      20.54028       7.583751  273.4763 74.26546 295.6258 67.53526 -22.14951      100.3811 
1 1 1 -1  18 28 o 162.7604 62.88401 5.112510       5.642293      14.75562       8.360167      -2.954165      7.646343  239.4903 78.17963 134.8640 62.29962 104.6263       99.96648 
1 1 1 -1  19 1  o 862.6951 15.85868 144.7728       5.313152      145.2282       7.401859      144.2888       7.631254  863.3300 22.07679 860.4293 22.83772 2.900696       31.76392 
1 1 1 -1  19 2  o 830.9578 16.03462 134.3204       5.174467      139.8592       7.269391      128.6316       7.367191  847.2290 22.09374 812.3477 23.35242 34.88129       32.14761 
1 1 1 -1  19 3  f 152.6187 53.19116 4.142926       3.870798      -1.269605      5.942998      8.130719       5.101192  134.8486 59.15476 200.9677 60.44441 -66.11908      84.57430 
1 1 1 -1  19 4  o 300.8999 45.81595 18.22107       5.184825      18.79197       7.789351      17.76689       6.947542  300.6593 68.26947 293.2393 62.89325 7.419983       92.82393 
1 1 1 -1  19 5  o 318.1399 43.99794 20.26865       5.290489      28.47529       8.011438      13.92232       7.045126  374.9832 56.79148 259.1090 68.84249 115.8743       89.24439 
1 1 1 -1  19 6  o 382.3187 30.14251 28.72333       4.439110      27.79882       5.526606      30.40433       7.452233  374.6534 38.53334 389.4266 50.46227 -14.77322      63.49220 
1 1 1 -1  19 7  o 1275.528 18.34263 316.5859       9.086143      317.6930       11.15798      314.4066       15.65445  1277.080 22.49778 1268.466 31.77832 8.614136       38.93600 
1 1 1 -1  19 8  o 290.4261 41.10471 16.86311       4.506649      17.88753       5.692793      15.14333       7.376023  297.1459 51.17883 270.2774 69.78909 26.86853       86.54357 
1 1 1 -1  19 9  o 947.7357 33.18876 175.5487       12.21536      0.000000       0.000000      175.5487       12.21536  ?        ?        947.7357 33.18876 0.000000       33.18876 
1 1 1 -1  19 10 o 749.3147 21.43618 109.3215       6.237917      114.6314       7.887304      100.4530       10.19317  766.7492 26.48788 715.4674 36.80998 51.28180       45.34956 
1 1 1 -1  19 11 o 210.5156 61.57494 8.972008       5.353167      13.79661       7.359953      3.552872       7.800263  258.5251 71.09196 182.3131 72.86526 76.21199       101.8008 
1 1 1 -1  19 12 o 658.1181 21.69243 84.35223       5.544216      93.15191       9.917665      80.35223       6.686615  688.6312 37.22294 641.8206 26.82654 46.81061       45.88257 
1 1 1 -1  19 13 o 458.4435 27.82130 41.17604       4.929834      28.46575       8.353317      47.96886       6.106700  374.0762 59.49258 494.2796 31.98452 -120.2035      67.54536 
1 1 1 -1  19 14 o 1043.962 19.34831 212.2244       7.844331      228.3251       14.11474      205.0292       9.435697  1079.755 33.66042 1025.389 23.69502 54.36572       41.16404 
1 1 1 -1  19 15 o 381.5548 35.32313 28.79534       5.174743      25.64456       8.802893      30.45904       6.396681  351.7073 66.89352 390.8866 42.84002 -39.17929      79.43558 
1 1 1 -1  19 16 o 558.6626 24.62419 60.92823       5.342440      62.92599       7.967052      59.29596       7.201516  564.8107 36.51723 548.7942 33.95668 16.01648       49.86546 
1 1 1 -1  19 17 f 490.2245 28.30598 47.16653       5.365987      41.54372       7.777988      52.27333       7.412502  456.3151 44.45546 514.2032 37.37509 -57.88818      58.07913 
1 1 1 -1  19 18 o 425.8791 33.77933 35.83665       5.540983      32.69175       7.854098      38.95294       7.818290  402.0012 51.49191 440.8950 46.35555 -38.89377      69.28387 
1 1 1 -1  19 19 o 260.8756 62.69647 14.31380       6.273100      10.02648       7.653415      23.09046       10.95033  224.3735 74.87789 325.8455 85.47222 -101.4721      113.6319 
1 1 1 -1  19 20 o 183.9591 62.75233 6.496695       5.376507      19.77584       7.645190      -6.496890      7.562541  305.2458 66.38352 129.9457 60.68145 175.3001       89.93893 
1 1 1 -1  19 21 o 185.1172 68.31098 6.008577       6.483576      7.133460       8.141154      4.057949       10.72061  202.8015 76.20600 201.3740 83.53082 1.427444       113.0697 
1 1 1 -1  19 22 o 399.5323 46.09520 32.57632       7.020908      26.98762       8.862543      41.99412       11.50476  353.8997 66.93570 442.0341 69.29621 -88.13443      96.34496 
1 1 1 -1  19 23 o 332.4096 60.30901 23.69950       7.498731      6.047919       12.51488      33.58647       9.366268  215.8247 89.94766 395.4811 63.10469 -179.6564      109.8762 
1 1 1 -1  19 24 o 274.3612 58.48734 16.39178       6.041374      9.268445       8.281907      24.49321       8.832205  211.8881 77.35629 329.4855 71.10991 -117.5973      105.0743 
1 1 1 -1  19 25 o 166.9946 63.27272 5.070725       5.639268      3.188697       7.671488      7.283301       8.317936  167.9659 70.24819 195.8425 76.15955 -27.87657      103.6103 
1 1 1 -1  19 26 o 478.2484 32.34096 46.32844       5.971374      47.69364       8.779243      45.15312       8.145877  473.5075 48.42348 462.6106 45.94929 10.89691       66.75455 
1 1 1 -1  19 27 o 215.0998 61.54908 10.82212       5.401739      5.959642       8.178942      14.58393       7.193930  180.7587 73.75172 243.4232 71.43246 -62.66454      102.6738 
1 1 1 -1  20 1  o 187.1784 53.01154 7.101385       4.028416      15.08839       6.224770      1.345773       5.284174  270.5839 60.72802 143.1396 58.94163 127.4442       84.62865 
1 1 1 -1  20 2  o 329.5561 36.10590 21.50397       4.545360      20.16985       7.694159      22.21915       5.633454  312.7224 65.45461 333.4093 44.62753 -20.68689      79.22072 
1 1 1 -1  20 3  f 426.7480 28.74415 35.69684       4.736005      29.61552       7.966166      39.02129       5.889935  383.3535 55.09132 445.4109 34.31464 -62.05740      64.90414 
1 1 1 -1  20 4  o 926.4038 19.64400 167.0298       7.067376      156.1813       11.80597      173.0886       8.822885  893.7722 34.01316 942.5109 24.10439 -48.73871      41.68833 
1 1 1 -1  20 5  o 756.6272 26.41866 111.6179       7.762842      0.000000       0.000000      111.6179       7.762842  ?        ?        756.6272 26.41866 0.000000       26.41866 
1 1 1 -1  20 6  o 517.7281 24.79702 52.23342       4.985735      52.64261       6.271650      51.53079       8.218379  518.2761 31.30661 510.9149 41.78561 7.361145       52.21246 
1 1 1 -1  20 7  o 867.7034 19.24975 146.5120       6.486709      151.8969       8.106543      136.9266       10.81556  883.0245 23.63931 837.0573 33.27099 45.96729       40.81392 
1 1 1 -1  20 8  o 747.8734 20.63776 108.8765       5.994027      105.4741       7.392860      115.4044       10.24020  735.5724 25.87969 768.2849 34.32086 -32.71246      42.98465 
1 1 1 -1  20 9  o 394.8853 32.21202 30.66559       4.896849      30.84860       6.152155      30.34918       8.089235  394.5921 40.73275 388.1557 55.21967 6.436371       68.61755 
1 1 1 -1  20 10 o 423.0848 33.00513 35.20233       5.380070      31.79903       6.736967      41.19380       8.938828  399.9138 44.11207 454.0521 51.60984 -54.13824      67.89293 
1 1 1 -1  20 11 o 553.8406 46.53543 60.83345       9.916360      0.000000       0.000000      60.83345       9.916360  ?        ?        553.8406 46.53543 0.000000       46.53543 
1 1 1 -1  20 12 o 353.3172 44.50955 24.95910       5.971722      19.38779       7.877223      32.48799       9.157138  305.1905 68.18114 399.4781 60.95617 -94.28763      91.45667 
1 1 1 -1  20 13 o 850.8544 20.03966 141.0201       6.621761      146.3423       11.56719      138.4257       8.075985  864.0960 34.46974 842.3036 24.68874 21.79242       42.39925 
1 1 1 -1  20 14 o 736.9659 20.05065 105.8194       5.738574      109.5466       8.516065      102.7193       7.766735  748.3954 29.30083 724.9960 27.58512 23.39935       40.24273 
1 1 1 -1  20 15 o 451.9611 29.17383 40.12825       5.093277      29.43939       7.443820      49.53763       6.984104  381.6730 51.53791 500.9177 36.14459 -119.2447      62.94909 
1 1 1 -1  20 16 o 620.6131 23.51336 75.17844       5.667137      80.63063       8.244021      70.29371       7.803216  640.2293 33.27169 597.5516 33.76382 42.67773       47.40254 
1 1 1 -1  20 17 f 348.3989 40.26989 24.25948       5.348206      26.82706       7.889158      22.07604       7.275114  361.4518 58.17601 326.7592 59.52329 34.69254       83.23143 
1 1 1 -1  20 18 o 191.5430 66.35043 6.904931       6.018531      14.57605       7.550960      -6.457822      9.965998  262.0422 71.98770 155.2046 71.49301 106.8376       101.4568 
1 1 1 -1  20 19 o 182.6156 62.87004 6.347147       5.399677      9.631396       7.608274      3.014061       7.664633  219.9082 74.65057 174.6243 71.33871 45.28394       103.2566 
1 1 1 -1  20 20 o 384.0071 44.73601 29.88204       6.546469      29.45429       8.070890      30.70471       11.19287  376.4984 56.98055 373.9431 79.52088 2.555328       97.82819 
1 1 1 -1  20 21 o 423.4172 41.22939 36.20045       6.693588      40.34429       8.424128      29.10382       11.02427  443.4732 49.77282 360.4661 80.75498 83.00711       94.86148 
1 1 1 -1  20 22 o 336.6452 68.78755 24.90405       8.689338      37.41958       13.53624      16.13191       11.33251  400.2869 89.34074 266.4482 91.10408 133.8387       127.5998 
1 1 1 -1  20 23 o 366.8088 43.48321 27.69793       6.073654      23.72894       8.436970      31.96738       8.750494  325.8731 68.82496 384.9039 60.53899 -59.03079      91.66158 
1 1 1 -1  20 24 o 201.7148 64.23823 8.972122       5.667594      15.74221       8.068782      2.378961       7.962649  258.6494 75.58030 166.0596 70.61575 92.58977       103.4358 
1 1 1 -1  20 25 o 198.8307 64.02367 8.913030       5.617947      9.407792       8.130069      8.460891       7.771976  206.2916 76.42083 198.8880 74.51236 7.403580       106.7344 
1 1 1 -1  20 26 f 203.7438 61.69051 9.619251       5.300675      17.42345       7.483371      1.760941       7.509268  267.5031 70.89363 155.0215 67.27250 112.4817       97.73176 
1 1 1 -1  21 1  o 1162.999 18.47510 263.1427       8.344385      263.6525       13.73696      262.8447       10.50447  1162.215 30.43519 1161.685 23.28402 0.5303955      38.32031 
1 1 1 -1  21 2  o 942.0233 19.72952 172.6935       7.217822      161.7455       11.90668      179.0540       9.075453  909.7610 33.70041 958.6603 24.37674 -48.89929      41.59259 
1 1 1 -1  21 3  o 235.9791 52.45296 11.40191       4.682362      21.33652       8.076765      6.372736       5.746590  321.7965 66.81493 187.5443 64.84156 134.2522       93.10565 
1 1 1 -1  21 4  o 548.4906 26.22122 58.64621       5.585345      59.46547       9.310119      58.18557       6.981171  548.6459 44.06714 544.7050 33.15976 3.940918       55.14964 
1 1 1 -1  21 5  o 394.0811 30.97002 30.50709       4.701563      28.23231       5.777511      34.96684       8.089581  377.5030 40.01898 418.3026 50.84288 -40.79959      64.70330 
1 1 1 -1  21 6  o 736.9682 17.45187 105.6515       4.994806      103.8838       5.716045      111.3603       10.27218  730.5587 20.14710 754.5644 35.05406 -24.00568      40.43133 
1 1 1 -1  21 7  o 838.4404 17.00816 136.7435       5.538059      137.3513       6.379427      134.8841       11.15717  840.0643 19.55425 830.4337 34.59560 9.630615       39.73946 
1 1 1 -1  21 8  o 928.9702 16.65486 167.8683       6.008565      164.5899       6.878907      178.4206       12.34132  919.5803 19.26202 955.2055 33.26877 -35.62524      38.44264 
1 1 1 -1  21 9  o 840.9913 17.51636 137.6215       5.720885      134.1350       6.557271      148.7331       11.70621  829.9686 20.34386 871.6577 34.58139 -41.68909      40.12164 
1 1 1 -1  21 10 o 530.8875 22.70061 54.93201       4.680237      54.70102       5.410356      55.61881       9.329078  529.4308 26.31410 529.2788 45.83905 0.1520386      52.85500 
1 1 1 -1  21 11 o 551.9545 23.46360 59.40924       5.029513      60.48028       5.847668      56.36480       9.858999  556.5179 27.05675 531.9284 48.25068 24.58954       55.31903 
1 1 1 -1  21 12 o 586.4482 23.33032 67.08085       5.313472      66.46491       6.111812      68.98737       10.75278  583.3109 26.98000 588.8295 47.42427 -5.518616      54.56172 
1 1 1 -1  21 13 o 439.7695 27.65575 37.94864       4.699168      36.54424       6.833786      39.20836       6.472202  428.6996 41.56927 445.0616 37.80362 -16.36200      56.18824 
1 1 1 -1  21 14 o 1031.335 17.75264 207.1267       7.110347      224.5454       10.61671      192.9588       9.574894  1072.206 25.49670 994.0920 24.80158 78.11353       35.56965 
1 1 1 -1  21 15 o 800.9669 20.03495 125.0541       6.232048      124.4160       9.076816      125.6232       8.571748  797.1754 29.31917 801.4196 27.54111 -4.244202      40.22594 
1 1 1 -1  21 16 o 554.5715 26.38559 60.15379       5.682669      65.60981       8.399122      55.54783       7.717137  575.8203 37.76868 529.6348 37.76651 46.18555       53.41145 
1 1 1 -1  21 17 o 154.2440 63.00579 2.115893       5.977790      -6.952288      7.521034      17.67094       9.850382  128.2308 60.08484 286.3458 83.46140 -158.1150      102.8396 
1 1 1 -1  21 18 o 608.0261 26.29167 72.46198       6.208239      81.45023       9.114511      64.68269       8.479403  640.7883 36.78018 570.2067 38.51757 70.58154       53.25772 
1 1 1 -1  21 19 o 130.0929 56.68905 -0.5212482     5.377573      0.2344437      7.683441      -1.246863      7.528986  158.5452 68.42445 149.8895 66.13792 8.655746       95.16370 
1 1 1 -1  21 20 f 419.3879 41.21696 35.53232       6.626330      38.78352       8.291396      29.78513       11.02386  434.4694 50.05598 364.9631 79.98598 69.50626       94.35760 
1 1 1 -1  21 21 o 597.1337 39.19781 71.80803       9.039478      68.96742       13.67334      74.01342       12.04789  569.6014 62.85952 598.0231 52.40447 -28.42163      81.83855 
1 1 1 -1  21 22 o 506.6546 36.57892 51.76636       7.148934      52.89803       8.981567      49.80986       11.80950  506.7408 46.14489 478.4519 65.25950 28.28897       79.92593 
1 1 1 -1  21 23 o 235.9296 61.47412 12.45217       5.689246      12.98169       8.065820      11.92787       8.025947  236.5867 76.76955 228.3945 76.67644 8.192154       108.5027 
1 1 1 -1  21 24 o 320.0484 48.21162 21.87541       5.806386      18.26304       8.533224      24.99004       7.923566  273.7625 77.02189 331.9576 63.78017 -58.19501      100.0014 
1 1 1 -1  21 25 o 179.9313 72.14855 6.002810       7.674986      6.002810       7.674986      0.000000       0.000000  179.9313 72.14855 ?        ?        0.000000       72.14855 
1 1 1 -1  21 26 f 117.7255 53.51602 -1.679952      5.345224      2.648166       7.533144      -6.068682      7.585707  158.2418 68.02056 123.6051 58.64977 34.63676       89.81421 
1 1 1 -1  22 1  o 173.8959 65.18081 4.585789       5.948633      0.000000       0.000000      4.585789       5.948633  ?        ?        173.8959 65.18081 0.000000       65.18081 
1 1 1 -1  22 2  o 888.2054 25.30304 153.7802       8.727988      0.000000       0.000000      153.7802       8.727988  ?        ?        888.2054 25.30304 0.000000       25.30304 
1 1 1 -1  22 3  o 654.4729 26.35463 83.52760       6.698485      79.78555       9.046390      88.06955       9.966488  637.3438 36.70400 669.3437 38.50343 -31.99988      53.19490 
1 1 1 -1  22 4  o 800.6927 27.67632 125.0889       8.606018      0.000000       0.000000      125.0889       8.606018  ?        ?        800.6927 27.67632 0.000000       27.67632 
1 1 1 -1  22 5  o 707.1601 23.54524 97.45446       6.466196      93.56450       10.79678      99.63007       8.074434  689.3201 40.50962 714.3303 29.10617 -25.01025      49.88185 
1 1 1 -1  22 6  o 487.4890 27.89896 46.53839       5.259853      50.49637       6.681850      40.08992       8.528797  506.8302 34.14634 447.9890 49.86848 58.84122       60.43871 
1 1 1 -1  22 7  o 582.2355 20.79809 66.02817       4.702730      64.00543       5.432927      72.07249       9.391566  572.9155 24.41829 604.4738 40.23656 -31.55823      47.06627 
1 1 1 -1  22 8  o 389.3897 28.47057 29.77543       4.275503      30.14549       4.932754      28.65768       8.572796  391.1078 32.77847 374.5666 61.03603 16.54114       69.28077 
1 1 1 -1  22 9  o 839.2190 17.91613 137.1004       5.839120      135.2634       6.717164      142.7817       11.81258  833.2198 20.75862 853.2712 35.64754 -20.05133      41.25127 
1 1 1 -1  22 10 o 728.6889 23.36430 103.5674       6.611849      99.80574       8.154832      110.7848       11.29578  714.4058 29.39287 749.7172 38.93030 -35.31134      48.78021 
1 1 1 -1  22 11 o 574.1089 23.58563 64.30564       5.258595      67.09023       6.091805      56.16359       10.41677  586.0074 26.76794 529.5722 51.29289 56.43524       57.85744 
1 1 1 -1  22 12 o 930.0438 22.40434 168.7082       8.092141      159.7929       9.832896      187.4178       14.24446  904.0084 28.00793 976.3423 37.56781 -72.33392      46.85920 
1 1 1 -1  22 13 o 487.3360 31.99761 46.75061       6.022191      52.87600       7.368271      34.42591       10.45170  517.2898 36.92032 407.4089 68.48842 109.8809       77.80600 
1 1 1 -1  22 14 o 374.5434 33.82506 27.76720       4.866950      29.64075       6.979699      25.99409       6.790031  383.5659 47.90060 358.1906 50.19040 25.37531       69.37971 
1 1 1 -1  22 15 o 347.1030 37.93040 24.03066       5.029754      27.69388       7.485107      21.01476       6.791642  368.3336 53.92443 319.0536 56.89964 49.28009       78.39269 
1 1 1 -1  22 16 o 812.8639 23.93924 129.2123       7.557116      132.9873       9.597828      123.0541       12.25867  822.9916 30.02960 787.2503 40.23050 35.74127       50.20229 
1 1 1 -1  22 17 o 721.1136 25.95945 101.9469       7.269878      95.41593       9.006420      114.1592       12.31569  695.4771 33.34582 756.1347 42.10736 -60.65765      53.71195 
1 1 1 -1  22 18 o 350.7239 43.02191 24.94436       5.736931      33.84379       8.481910      17.43991       7.788820  404.1647 55.50444 282.8992 71.00470 121.2655       90.12441 
1 1 1 -1  22 19 o 252.2305 67.15269 13.88723       6.694648      12.50290       8.347317      16.38301       11.20803  240.2434 78.10463 270.5185 90.61152 -30.27507      119.6277 
1 1 1 -1  22 20 o 306.7442 70.18130 20.90290       8.179235      27.29262       12.34781      15.90724       10.91806  338.4191 91.67918 264.2105 89.42708 74.20862       128.0714 
1 1 1 -1  22 21 o 364.6206 59.68879 28.68204       8.159514      31.42915       12.00872      26.32610       11.12095  363.4339 86.35841 332.3380 85.63298 31.09592       121.6174 
1 1 1 -1  22 22 o 329.7200 45.15487 22.72997       5.630077      27.65262       7.914142      17.68608       8.011005  355.6890 59.38747 275.1295 73.55649 80.55951       94.53797 
1 1 1 -1  22 23 o 222.1148 62.21764 11.25832       5.580894      15.98355       8.152754      7.091567       7.655817  256.8145 76.22752 189.6270 73.25404 67.18747       105.7203 
1 1 1 -1  22 24 f 120.1302 54.29038 -1.517254      5.404697      6.614503       7.873411      -8.763620      7.432431  184.7649 73.41057 115.3892 55.62526 69.37578       92.10473 
1 1 1 -1  22 25 o 163.4536 61.68464 5.372190       5.346246      12.41930       7.682875      -1.243937      7.444237  222.9570 75.01894 139.8377 63.40878 83.11923       98.22685 
1 1 1 -1  23 1  o 1251.873 24.68209 305.6157       11.99969      298.1493       16.07579      315.0103       18.03252  1234.259 33.53806 1267.721 36.62729 -33.46155      49.66246 
1 1 1 -1  23 2  o 1248.114 19.49408 303.3046       9.448979      282.9615       10.71283      374.5840       20.05289  1204.915 22.89390 1382.069 37.36105 -177.1543      43.81756 
1 1 1 -1  23 3  o 329.9669 41.41621 21.72624       5.190311      20.23899       7.734217      22.94483       7.000868  312.4848 65.81132 335.8521 55.62211 -23.36731      86.16814 
1 1 1 -1  23 4  o 958.4365 20.38799 178.9196       7.588671      184.1673       12.39064      175.7697       9.599740  970.0104 32.89194 949.0433 26.04626 20.96704       41.95578 
1 1 1 -1  23 5  o 695.1631 23.61335 94.23373       6.374884      83.56030       9.679407      102.4099       8.471710  651.2532 38.44150 723.7341 30.14145 -72.48083      48.84932 
1 1 1 -1  23 6  o 784.2347 21.78116 119.8667       6.633689      121.0659       8.148925      117.5107       11.42193  787.4252 26.64790 773.5681 38.02009 13.85712       46.42884 
1 1 1 -1  23 7  o 390.2915 34.32135 30.08293       5.149249      33.13977       6.317348      24.03167       8.888362  408.5364 40.34472 339.5197 69.74424 69.01672       80.57267 
1 1 1 -1  23 8  o 499.8939 24.37277 48.76361       4.731628      49.18504       5.482646      47.53366       9.366385  500.8378 28.30393 487.2640 50.21660 13.57382       57.64390 
1 1 1 -1  23 9  o 315.7551 36.83638 19.84028       4.432149      19.80813       5.124416      19.93577       8.830212  314.1069 43.14841 307.3091 74.71407 6.797760       86.27849 
1 1 1 -1  23 10 o 756.8808 19.88117 111.6270       5.843826      110.5528       6.760830      114.8008       11.62107  752.7671 23.12658 762.7184 39.36747 -9.951355      45.65782 
1 1 1 -1  23 11 o 202.1465 56.78945 8.404004       4.642506      13.26810       5.433189      -4.755205      8.936520  252.9192 56.71476 151.9522 69.12188 100.9670       89.41140 
1 1 1 -1  23 12 o 539.4280 26.49390 56.89225       5.550183      56.51191       6.461201      57.96295       10.84078  536.0368 31.17239 536.7143 52.68962 -0.6774902     61.22021 
1 1 1 -1  23 13 o 725.5690 22.28702 102.7646       6.279985      102.9173       7.273361      102.3172       12.44841  725.4567 25.81640 716.9217 44.93811 8.535034       51.82586 
1 1 1 -1  23 14 o 328.9965 46.88409 21.95780       5.820790      23.48818       7.064673      18.72274       10.27151  337.6593 55.82557 294.0126 85.09219 43.64673       101.7702 
1 1 1 -1  23 15 o 466.5882 34.39683 43.16335       6.188807      38.15487       7.726068      52.13130       10.33837  434.7854 46.47679 506.0953 53.40729 -71.30988      70.79852 
1 1 1 -1  23 16 o 422.2916 38.96946 35.70826       6.318847      47.48066       8.170579      18.18916       9.967265  485.6318 43.79409 286.8416 84.05528 198.7902       94.77982 
1 1 1 -1  23 17 o 406.0715 36.34116 32.99524       5.670390      33.85319       8.236377      32.22218       7.818237  404.5133 53.76106 395.1789 52.22260 9.334351       74.94966 
1 1 1 -1  23 18 o 992.4075 22.94334 193.2399       8.842491      196.1672       10.86205      187.4883       15.22561  997.3491 28.04379 966.9606 40.54507 30.38849       49.29865 
1 1 1 -1  23 19 f 729.3055 35.40621 106.2210       10.02806      123.5370       15.10781      92.58322       13.40758  774.1279 50.53001 668.5904 52.04729 105.5375       72.54104 
1 1 1 -1  23 20 o 440.7523 50.48740 40.64924       8.485955      32.47153       12.08723      48.59757       11.91650  369.1822 85.91820 470.1859 67.16973 -101.0037      109.0583 
1 1 1 -1  23 21 o 359.0635 47.11205 27.08366       6.410941      31.02884       7.825440      19.03160       11.17968  380.0171 54.59222 275.7746 90.42534 104.2426       105.6270 
1 1 1 -1  23 22 f 136.9187 57.65707 1.568187       5.224166      -1.827023      7.359105      5.017412       7.417413  139.4793 63.16381 175.0708 70.67031 -35.59149      94.78374 
1 1 1 -1  23 23 o 244.3720 58.28732 13.62094       5.454099      20.81970       7.797130      6.723797       7.632041  295.4787 69.17018 184.5273 72.60469 110.9514       100.2794 
1 1 1 -1  23 24 f 296.6299 48.69427 19.22536       5.414752      10.59932       7.469185      28.78030       7.861066  209.2966 73.82330 355.6501 58.98219 -146.3535      94.49222 
1 1 1 -1  24 1  o 794.4772 19.08531 122.9189       5.888555      119.5843       7.804226      127.3269       8.972887  782.7110 25.67441 807.1404 28.62563 -24.42944      38.45259 
1 1 1 -1  24 2  o 495.2053 25.25546 47.98403       4.840865      44.60243       6.328017      52.75495       7.516367  475.7933 34.48086 516.9663 37.69827 -41.17300      51.08904 
1 1 1 -1  24 3  o 1334.073 19.87576 346.6948       10.29749      334.3310       11.92828      382.8658       20.40244  1309.247 23.46001 1396.188 37.62793 -86.94019      44.34222 
1 1 1 -1  24 4  o 504.2495 26.17911 49.78267       5.108950      52.88116       6.828056      45.84160       7.700691  518.2906 34.11378 480.7359 41.65910 37.55472       53.84450 
1 1 1 -1  24 5  o 444.6953 33.26033 38.96441       5.702441      42.32176       8.917578      36.64182       7.417099  459.2990 50.84771 428.4873 45.25743 30.81171       68.07146 
1 1 1 -1  24 6  o 915.4966 25.04940 163.6160       8.905987      148.3610       11.83901      183.5020       13.51709  869.5611 35.05801 966.8028 36.00121 -97.24170      50.25089 
1 1 1 -1  24 7  o 595.8610 25.03265 69.31985       5.792683      64.43423       6.902868      80.95124       10.65089  572.8009 31.14824 639.1089 43.16543 -66.30804      53.23032 
1 1 1 -1  24 8  o 914.1464 20.74959 162.8969       7.366366      166.1489       8.945479      156.0461       12.98371  922.4265 24.97146 890.8119 37.53054 31.61456       45.07898 
1 1 1 -1  24 9  o 607.2294 26.55305 72.07440       6.261742      73.31694       7.736814      69.71497       10.66128  610.5424 32.74957 591.3792 46.80347 19.16315       57.12354 
1 1 1 -1  24 10 o 231.1245 52.95596 11.06816       4.651302      7.323578       5.373622      22.25591       9.288305  192.8180 62.66575 323.5405 75.33028 -130.7225      97.98800 
1 1 1 -1  24 11 o 538.6235 25.41291 56.72332       5.315787      60.25233       6.232482      47.30340       10.18258  553.7966 29.08072 482.8971 55.29354 70.89957       62.47451 
1 1 1 -1  24 12 o 685.9822 22.86354 91.93507       6.090940      91.59198       7.103202      92.88811       11.83863  683.9333 26.74314 682.2261 44.93485 1.707214       52.29088 
1 1 1 -1  24 13 o 698.5313 25.20226 95.53504       6.836807      100.2723       8.403456      86.26093       11.75788  714.3334 30.29207 655.8096 46.46696 58.52374       55.46880 
1 1 1 -1  24 14 o 335.2287 50.90403 23.09830       6.418731      23.09830       6.418731      0.000000       0.000000  335.2287 50.90403 ?        ?        0.000000       50.90403 
1 1 1 -1  24 15 f 239.8513 72.34953 12.36854       7.300738      12.36854       7.300738      0.000000       0.000000  239.8513 72.34953 ?        ?        0.000000       72.34953 
1 1 1 -1  24 16 o 479.2715 36.06971 45.92021       6.664325      48.58335       8.160770      40.58873       11.54671  489.9991 43.33194 433.1655 71.10802 56.83368       83.27069 
1 1 1 -1  24 17 o 234.0876 66.64342 11.98628       6.349483      15.04155       7.921264      6.494829       10.61973  259.3824 74.62632 208.8397 84.46964 50.54268       112.7129 
1 1 1 -1  24 18 o 102.8676 50.74546 -14.49890      7.293199      -2.177829      10.30632      -26.85747      10.32198  167.2298 75.32850 110.7865 55.55446 56.44324       93.59851 
1 1 1 -1  24 19 o 164.2358 68.57309 2.754631       7.292661      1.266479       10.47840      4.152595       10.15592  179.8284 78.72538 190.4462 80.30427 -10.61778      112.4565 
1 1 1 -1  24 20 o 247.3999 61.71532 13.77931       5.909886      13.39853       7.084802      14.65040       10.71570  240.1681 71.00581 246.7416 88.27354 -6.573486      113.2874 
1 1 1 -1  24 21 f 161.3535 60.64256 4.920852       5.155870      6.501503       7.094459      3.151531       7.505929  182.8274 70.54811 164.4430 69.17201 18.38438       98.80183 
1 1 1 -1  24 22 o 145.6503 58.75284 3.124163       5.122773      5.961116       7.328270      0.4130356      7.163915  178.2427 70.82218 146.2184 64.51650 32.02425       95.80271 
1 1 1 -1  25 1  o 530.0236 25.01526 54.84438       5.149064      46.19921       6.640770      67.87722       8.153634  483.8652 35.58976 586.9039 35.94629 -103.0387      50.58425 
1 1 1 -1  25 2  o 293.1534 41.34917 17.25322       4.576756      17.45348       5.976701      16.96930       7.116498  291.5840 54.79173 284.9377 65.66054 6.646332       85.51865 
1 1 1 -1  25 3  o 750.2350 20.18317 109.6866       5.880506      107.1481       7.782892      113.0637       8.976913  740.4434 27.06582 759.9661 30.41619 -19.52271      40.71490 
1 1 1 -1  25 4  o 188.5172 58.22115 7.123610       4.691395      11.19643       6.051909      0.9908134      7.426324  232.2465 64.69620 162.7146 68.64350 69.53186       94.32671 
1 1 1 -1  25 5  o 606.4835 27.20764 71.91143       6.408226      71.62001       7.316382      72.87155       13.28017  603.8017 31.30886 600.9559 57.60871 2.845764       65.56683 
1 1 1 -1  25 6  o 615.2534 26.31088 73.98937       6.286622      69.31024       7.629796      83.88266       11.09431  593.4210 33.24091 649.7938 44.22710 -56.37286      55.32625 
1 1 1 -1  25 7  o 642.3143 24.70008 80.59766       6.161324      75.33218       7.350087      93.04250       11.29974  619.9926 30.52657 684.7717 42.70358 -64.77911      52.49254 
1 1 1 -1  25 8  f 94.58295 45.47023 -7.039140      4.886093      -7.994332      5.756667      -4.577897      9.240660  103.4137 49.62038 155.1245 70.45808 -51.71077      86.17728 
1 1 1 -1  25 9  o 459.7379 31.75934 41.69680       5.635582      46.65038       6.717996      29.93128       10.35346  485.3768 35.89417 375.8065 73.57368 109.5703       81.86255 
1 1 1 -1  25 10 o 436.6035 42.87910 38.18185       7.176639      48.00330       10.16538      28.42228       10.13330  485.6210 54.86317 364.9651 74.02616 120.6559       92.14033 
1 1 1 -1  25 11 o 355.1281 51.50946 25.82036       6.896646      41.33208       9.752496      10.30333       9.754164  448.4824 57.30420 232.7448 84.10598 215.7376       101.7722 
1 1 1 -1  25 12 o 312.2204 48.42790 19.99012       5.681784      26.41461       7.021876      7.807390       9.669549  358.5134 51.94700 215.7450 82.58706 142.7685       97.56594 
1 1 1 -1  25 13 o 590.0787 34.86992 69.17307       7.955287      69.17307       7.955287      0.000000       0.000000  590.0787 34.86992 ?        ?        0.000000       34.86992 
1 1 1 -1  25 14 f 234.0215 72.75992 11.79341       7.313115      11.79341       7.313115      0.000000       0.000000  234.0215 72.75992 ?        ?        0.000000       72.75992 
1 1 1 -1  25 15 o 254.3176 61.40615 13.99580       5.996119      12.46975       7.241915      17.32270       10.69272  238.5905 72.07732 275.6315 88.28285 -37.04105      113.9693 
1 1 1 -1  25 16 o 415.1566 40.58434 34.99772       6.459639      46.65028       7.971413      12.71068       11.02430  478.4068 43.37684 243.7767 89.21132 234.6301       99.19783 
1 1 1 -1  25 17 o 146.5908 62.07135 1.349352       6.108640      -0.6400874     7.509555      5.240596       10.50251  149.3009 65.95647 198.8188 82.59081 -49.51787      105.6953 
1 1 1 -1  25 18 o 135.8992 60.81671 -1.401900      6.597858      -2.754191      8.371767      0.8149378      10.71887  146.9736 66.87452 178.6683 78.87149 -31.69467      103.4065 
1 1 1 -1  25 19 o 319.6512 47.39117 21.66457       5.704841      21.69883       6.731719      21.57728       10.74632  314.1175 57.29417 291.7094 87.72906 22.40811       104.7808 
1 1 1 -1  25 20 o 394.8478 35.20279 31.89308       5.341406      32.80786       7.489003      30.94590       7.620491  390.4359 50.57956 376.9075 53.56944 13.52844       73.67480 
1 1 1 -1  25 21 o 271.4676 49.05579 16.07863       4.981393      15.41651       7.111759      16.71637       6.979609  252.2661 70.08302 264.5844 67.66007 -12.31828      97.41413 
1 1 1 -1  26 1  o 219.9573 54.59633 10.04708       4.641872      10.10280       6.016771      9.965150       7.295758  221.2594 65.44085 223.3147 73.03990 -2.055328      98.06799 
1 1 1 -1  26 2  o 913.4568 18.70513 162.6016       6.635548      162.8492       8.976566      162.3034       9.852665  912.7980 25.32256 910.6434 27.85976 2.154602       37.64835 
1 1 1 -1  26 3  o 611.7234 22.84124 73.05813       5.426288      74.79503       7.199820      70.77426       8.256011  617.7376 30.01163 598.7375 35.66804 19.00006       46.61445 
1 1 1 -1  26 4  o 447.7436 29.98160 39.47412       5.183175      37.17873       6.676185      42.95689       8.223603  432.0537 40.25224 462.8787 46.37113 -30.82495      61.40459 
1 1 1 -1  26 5  o 181.1447 58.52649 6.481030       4.691623      5.236085       6.120054      8.255401       7.306379  178.4255 66.26339 209.0651 73.06651 -30.63959      98.63849 
1 1 1 -1  26 6  o 673.5015 24.89933 88.72004       6.512599      84.32543       7.689610      99.87049       12.24871  655.4941 30.20700 707.5653 44.80680 -52.07123      54.03806 
1 1 1 -1  26 7  o 585.3647 27.35608 67.15231       6.218826      67.15231       6.218826      0.000000       0.000000  585.3647 27.35608 ?        ?        0.000000       27.35608 
1 1 1 -1  26 8  o 287.6372 43.84442 16.81822       4.742759      13.43803       5.428382      27.72128       9.749309  253.1105 56.63925 360.2135 72.20688 -107.1030      91.77057 
1 1 1 -1  26 9  o 283.9786 44.33638 16.44479       4.729823      15.66153       5.418783      18.95086       9.692739  274.4617 52.75492 293.7562 81.89185 -19.29443      97.41332 
1 1 1 -1  26 10 f 680.9109 24.37263 90.84975       6.444968      94.01005       7.697870      83.44152       11.78594  691.4551 28.66676 642.8867 47.54373 48.56842       55.51747 
1 1 1 -1  26 11 o 822.1538 22.95218 132.4054       7.328329      133.2645       8.812672      130.4798       13.19411  823.2314 27.56498 806.7909 42.25755 16.44049       50.45324 
1 1 1 -1  26 12 o 250.3411 82.38091 13.61137       9.275949      13.61137       9.275949      0.000000       0.000000  250.3411 82.38091 ?        ?        0.000000       82.38091 
1 1 1 -1  26 13 o 519.0380 38.49950 54.12855       7.705056      54.12855       7.705056      0.000000       0.000000  519.0380 38.49950 ?        ?        0.000000       38.49950 
1 1 1 -1  26 14 f 196.8210 65.12233 8.080657       5.793591      2.393039       7.012943      20.30611       10.28176  161.9439 67.39904 295.3971 85.03118 -133.4532      108.5031 
1 1 1 -1  26 15 o 533.5752 31.81462 56.84117       6.562531      54.95879       7.950399      60.86599       11.62542  520.7414 39.61023 536.8829 56.61063 -16.14154      69.09222 
1 1 1 -1  26 16 o 199.4497 66.35051 8.563098       6.011205      16.86018       7.285209      -9.135668      10.64023  272.4603 68.82858 146.7363 69.57777 125.7239       97.86951 
1 1 1 -1  26 17 o 473.5668 41.10872 46.12864       7.485365      31.46629       9.449651      70.82538       12.26404  373.1222 67.70693 574.8997 55.62593 -201.7776      87.62689 
1 1 1 -1  26 18 o 131.3100 55.11864 1.415672       4.749606      -0.2510241     6.378547      3.489836       7.115660  137.7269 60.81810 164.2498 68.08554 -26.52287      91.29339 
1 1 1 -1  26 19 o 195.6160 67.06196 8.645403       6.140646      8.645403       6.140646      0.000000       0.000000  195.6160 67.06196 ?        ?        0.000000       67.06196 
1 1 1 -1  26 20 o 290.5819 45.33073 18.11926       4.948550      20.42612       6.962088      15.76376       7.035095  297.1379 62.32249 255.3386 69.21261 41.79926       93.13688 
1 1 1 -1  27 1  f 361.9085 35.62861 26.08309       4.942629      30.92898       6.506315      19.47045       7.600386  392.1581 43.45178 302.8971 66.43946 89.26105       79.38677 
1 1 1 -1  27 2  o 179.3433 58.87059 6.337815       4.738071      7.445333       6.230996      4.819555       7.295502  196.5347 67.54367 183.1632 71.29849 13.37157       98.21214 
1 1 1 -1  27 3  o 294.0520 44.39236 17.58158       4.911595      21.55190       6.469139      12.17827       7.546815  323.2926 53.38931 240.3827 73.77795 82.90993       91.06923 
1 1 1 -1  27 4  f 90.09932 43.54647 -7.156044      4.627289      -7.711658      5.888107      -6.258722      7.482786  105.5946 50.53866 129.7061 60.49939 -24.11153      78.83104 
1 1 1 -1  27 5  o 469.9299 29.14568 43.56055       5.292826      43.01874       6.909096      44.33019       8.234509  464.2563 38.67266 468.8100 45.81412 -4.553741      59.95422 
1 1 1 -1  27 6  o 413.5363 35.74820 34.07463       5.684656      28.37752       6.837372      46.82922       10.23045  373.0854 48.32584 477.1419 56.29416 -104.0565      74.19177 
1 1 1 -1  27 7  o 439.4869 28.86877 38.15190       4.899818      35.65987       5.585955      46.46767       10.20404  423.3484 34.26995 474.6396 56.46601 -51.29123      66.05180 
1 1 1 -1  27 8  o 104.8265 49.14635 -4.735486      5.044141      -4.735486      5.044141      0.000000       0.000000  104.8265 49.14635 ?        ?        0.000000       49.14635 
1 1 1 -1  27 9  o 526.6962 26.06298 54.51699       5.331044      53.07341       6.021153      59.75381       11.46814  517.8268 30.07055 537.6904 55.72951 -19.86359      63.32469 
1 1 1 -1  27 10 o 410.3145 31.90423 33.51239       5.043881      34.11405       5.767344      31.55540       10.40148  412.5092 36.37331 379.3939 73.24806 33.11536       81.78201 
1 1 1 -1  27 11 o 115.0479 52.96958 -3.508169      5.461726      -3.508169      5.461726      0.000000       0.000000  115.0479 52.96958 ?        ?        0.000000       52.96958 
1 1 1 -1  27 12 o 154.2521 61.89253 3.020907       5.652121      3.020907       5.652121      0.000000       0.000000  154.2521 61.89253 ?        ?        0.000000       61.89253 
1 1 1 -1  27 13 o 327.0288 42.73571 22.01097       5.297755      22.09750       6.241899      21.78806       10.01828  323.7979 51.35186 304.6058 82.60479 19.19208       97.26543 
1 1 1 -1  27 14 o 295.7711 56.55739 18.93349       6.259643      11.89969       7.819989      31.47866       10.44358  229.7284 75.64185 370.6838 75.11965 -140.9554      106.6051 
1 1 1 -1  27 15 o 177.9789 62.74929 6.483021       5.395824      1.511433       6.295805      20.23935       10.47261  147.8211 62.82393 286.0475 86.73491 -138.2264      107.0971 
1 1 1 -1  27 16 o 164.4324 64.44601 4.576716       5.991873      1.341992       7.585441      9.944292       9.771276  156.5526 67.77470 215.0663 82.84885 -58.51369      107.0390 
1 1 1 -1  27 17 o 196.5123 60.37199 8.704732       5.051973      14.30550       5.853401      -7.650805      10.00269  250.4044 60.80053 142.0713 67.39342 108.3331       90.76662 
1 1 1 -1  27 18 o 147.0940 59.96508 3.007034       5.401129      6.783447       6.311620      -7.323295      10.43898  180.1917 67.21861 145.1407 68.84884 35.05106       96.22112 
1 1 1 -1  28 1  o 571.1492 24.52133 63.96316       5.439031      59.55617       7.060944      70.39371       8.529350  547.9169 33.34192 594.3781 37.13700 -46.46124      49.90832 
1 1 1 -1  28 2  o 677.7040 22.38310 89.91927       5.890989      88.05387       7.788111      92.41385       9.006250  668.4590 30.00056 683.4130 33.93383 -14.95398      45.29391 
1 1 1 -1  28 3  o 146.1761 57.61024 2.775620       4.812634      8.819922       6.302134      -5.680501      7.454184  207.0975 67.89142 130.6481 60.75277 76.44936       91.10513 
1 1 1 -1  28 4  o 341.7448 38.45775 23.52533       5.015352      22.90610       6.375502      24.53065       8.123523  332.7729 50.95547 339.0514 64.04230 -6.278534      81.84055 
1 1 1 -1  28 5  o 476.6023 29.51164 44.95676       5.435452      38.55572       6.933827      55.16045       8.754398  437.2097 41.32719 522.5830 43.53233 -85.37326      60.02500 
1 1 1 -1  28 6  o 256.0594 52.39362 13.80731       5.034549      10.32573       6.541626      18.86552       7.884896  220.1339 68.87639 293.2773 70.16924 -73.14340      98.32436 
1 1 1 -1  28 7  o 171.0609 57.72156 5.792492       4.548522      3.526025       5.169011      13.56927       9.574860  154.7245 60.07404 249.3230 83.74884 -94.59854      103.0668 
1 1 1 -1  28 8  o 373.3275 34.70815 27.95546       4.974483      26.00187       5.638799      34.81203       10.56385  357.5431 41.37410 399.0137 70.76317 -41.47061      81.97098 
1 1 1 -1  28 9  o 337.0710 37.94308 23.01667       4.880499      22.96112       5.608800      23.18986       9.903882  334.2083 44.30622 318.0595 80.19801 16.14880       91.62294 
1 1 1 -1  28 10 o 457.3482 32.55109 41.82587       5.743762      41.82587       5.743762      0.000000       0.000000  457.3482 32.55109 ?        ?        0.000000       32.55109 
1 1 1 -1  28 11 o 461.1632 34.40759 42.76020       6.117850      42.76020       6.117850      0.000000       0.000000  461.1632 34.40759 ?        ?        0.000000       34.40759 
1 1 1 -1  28 12 o 239.7772 54.64939 12.50187       4.975605      11.29972       5.743765      16.11618       9.959370  225.1897 63.13311 260.1678 85.34955 -34.97804      106.1618 
1 1 1 -1  28 13 o 231.4520 56.96758 11.83803       5.085994      13.46651       5.915915      7.224530       9.957393  244.7858 62.12593 202.6775 81.85762 42.10825       102.7633 
1 1 1 -1  28 14 f 277.0804 50.73368 16.57085       5.258033      17.64726       6.072330      13.34536       10.51152  282.4644 57.31491 236.9446 87.05103 45.51971       104.2251 
1 1 1 -1  28 15 o 362.4709 47.70723 27.96877       6.552454      22.67857       7.927705      39.37455       11.64056  312.7594 67.26677 405.6685 76.69810 -92.90915      102.0168 
1 1 1 -1  28 16 o 604.8008 53.39882 79.36034       12.41334      0.000000       0.000000      79.36034       12.41334  ?        ?        604.8008 53.39882 0.000000       53.39882 
1 1 1 -1  29 1  o 474.6672 28.19171 44.60496       5.173507      31.63589       6.812558      62.27386       7.951713  393.1889 45.45278 557.5096 36.93579 -164.3208      58.56798 
1 1 1 -1  29 2  o 300.1409 42.44178 18.45303       4.809093      19.06526       6.433528      17.67773       7.239815  299.1724 57.46176 283.9461 66.77527 15.22629       88.09534 
1 1 1 -1  29 3  f 115.8133 51.64196 -1.387777      4.711755      -0.5857899E-01 6.330379      -3.038811      7.055259  142.0665 61.70866 135.5181 61.55759 6.548386       87.16247 
1 1 1 -1  29 4  o 176.4039 57.59731 6.367592       4.537577      9.759084       5.933753      1.591239       7.041778  212.9002 65.43262 157.7776 66.71690 55.12262       93.44823 
1 1 1 -1  29 5  o 380.8542 33.58519 29.07980       4.916599      31.93113       6.442966      25.10463       7.607473  395.5720 42.61292 342.5330 59.33824 53.03900       73.05401 
1 1 1 -1  29 6  o 125.6821 53.75039 0.3956606      4.661160      -1.870444      6.095647      3.586373       7.233087  129.7039 58.22091 170.3299 69.41045 -40.62599      90.59517 
1 1 1 -1  29 7  o 500.4318 25.29880 49.51016       4.900733      50.79861       5.625444      45.45363       9.981597  505.6089 28.76823 463.3448 56.65116 42.26410       63.53712 
1 1 1 -1  29 8  o 370.7883 33.15968 27.65502       4.724504      27.55724       5.433851      27.95791       9.563637  367.8997 38.60767 351.6732 72.43683 16.22647       82.08317 
1 1 1 -1  29 9  o 346.3308 41.82141 24.71135       5.511054      24.71135       5.511054      0.000000       0.000000  346.3308 41.82141 ?        ?        0.000000       41.82141 
1 1 1 -1  29 10 o 483.3755 31.06285 46.84448       5.800269      46.84448       5.800269      0.000000       0.000000  483.3755 31.06285 ?        ?        0.000000       31.06285 
1 1 1 -1  29 11 o 264.4136 48.81311 14.96733       4.827775      15.99208       5.514142      11.60256       9.991865  270.7198 54.33677 226.9488 84.59198 43.77097       100.5400 
1 1 1 -1  29 12 o 227.0238 62.73300 11.74771       5.714771      11.74771       5.714771      0.000000       0.000000  227.0238 62.73300 ?        ?        0.000000       62.73300 
1 1 1 -1  29 13 o 324.0458 41.78865 21.97335       5.136334      14.84075       5.848999      46.00902       10.73707  255.8687 59.91671 452.7841 62.74802 -196.9153      86.76016 
1 1 1 -1  29 14 o 126.0539 56.56761 -1.145651      5.750360      -1.556604      7.063525      -0.3380758     9.901855  137.0234 61.98223 163.8379 73.81487 -26.81454      96.38688 
1 1 1 -1  30 1  o 91.77868 43.90041 -5.555897      4.428284      -6.697564      5.855132      -4.030107      6.768844  106.7896 50.91338 127.2134 58.71301 -20.42387      77.71351 
1 1 1 -1  30 2  o 423.8318 29.93380 35.85852       4.895327      36.20013       6.433501      35.38875       7.544559  421.5423 39.76867 412.4476 47.99950 9.094696       62.33377 
1 1 1 -1  30 3  o 552.1559 24.60720 60.15152       5.276572      60.13869       6.990315      60.16852       8.044677  547.7385 33.01643 544.9864 38.25209 2.752136       50.53026 
1 1 1 -1  30 4  o 179.2435 58.00812 6.775489       4.607443      7.110147       6.055196      6.315274       7.100822  187.0579 66.41656 185.6609 70.84315 1.397003       97.10773 
1 1 1 -1  30 5  o 240.6965 52.61249 12.52374       4.780727      18.94043       6.323723      3.964478       7.303580  295.0281 57.25780 171.0690 69.73385 123.9591       90.22896 
1 1 1 -1  30 6  o 102.1255 47.61256 -3.637893      4.625903      -1.650520      6.043195      -6.450347      7.189019  128.7828 57.87668 122.1670 57.70771 6.615784       81.73060 
1 1 1 -1  30 7  o 639.0478 21.73793 80.45239       5.394851      84.13656       6.271958      69.97404       10.57743  652.1241 24.76537 579.0200 47.45603 73.10419       53.52942 
1 1 1 -1  30 8  o 301.3023 46.71159 19.20952       5.288880      19.20952       5.288880      0.000000       0.000000  301.3023 46.71159 ?        ?        0.000000       46.71159 
1 1 1 -1  30 9  o 153.9131 60.23202 3.868813       5.227851      3.868813       5.227851      0.000000       0.000000  153.9131 60.23202 ?        ?        0.000000       60.23202 
1 1 1 -1  30 10 o 223.1879 53.50302 11.02782       4.577174      10.39954       5.256625      12.99784       9.308177  214.0948 60.52847 232.3402 82.36221 -18.24539      102.2117 
1 1 1 -1  30 11 o 155.6616 57.11290 4.705868       4.522528      3.779861       5.224779      7.472809       9.031517  152.2538 60.01975 195.9916 78.37947 -43.73788      98.72037 
1 1 1 -1  30 12 o 184.6027 60.00853 7.595731       4.927471      6.307081       5.661596      11.62063       10.00574  174.4719 63.91883 221.4272 84.18886 -46.95531      105.7042 
1 1 1 -1  31 1  o 313.8749 40.07678 20.38282       4.773633      12.37808       6.298028      31.19058       7.318104  232.5079 66.43505 383.0099 50.42531 -150.5019      83.40460 
1 1 1 -1  31 2  o 110.6465 50.04272 -1.749960      4.602238      -0.5846179     6.047943      -3.353038      7.093463  133.4414 59.05837 131.6366 60.51769 1.804764       84.55934 
1 1 1 -1  31 3  o 98.78966 46.27211 -3.755037      4.453296      -1.081021      5.792785      -7.618973      6.963385  128.1114 57.18324 115.3424 55.13805 12.76903       79.43630 
1 1 1 -1  31 4  o 225.8430 53.71137 11.23676       4.642113      14.73391       6.158467      6.635284       7.064224  254.6396 62.69410 184.8930 70.63411 69.74666       94.44431 
1 1 1 -1  31 5  o 153.9139 56.85958 4.456073       4.494492      5.826017       5.855060      2.490802       7.012795  173.0048 64.70155 157.9974 66.68198 15.00737       92.91274 
1 1 1 -1  31 6  o 203.3346 56.78354 9.240954       4.656007      12.30945       6.184821      5.227332       7.073466  230.5883 65.81750 174.6130 69.51690 55.97536       95.73161 
1 1 1 -1  31 7  o 163.5133 59.99457 5.271514       4.990442      5.271514       4.990442      0.000000       0.000000  163.5133 59.99457 ?        ?        0.000000       59.99457 
1 1 1 -1  31 8  o 229.4582 58.13860 11.92186       5.187016      11.92186       5.187016      0.000000       0.000000  229.4582 58.13860 ?        ?        0.000000       58.13860 
1 1 1 0   0  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   0  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   0  3  f 673.4586 19.65125 88.52769       5.129695      88.52769       5.129695      88.52769       5.129695  673.4586 19.65125 673.4586 19.65125 0.000000       0.000000 
1 1 1 0   0  4  o 1159.027 16.69888 261.4467       7.512868      261.4467       7.512868      261.4467       7.512868  1159.027 16.69888 1159.027 16.69888 0.000000       0.000000 
1 1 1 0   0  5  o 128.8694 32.20255 3.781532       1.394274      3.781532       1.394274      3.781532       1.394274  128.8694 32.20255 128.8694 32.20255 0.000000       0.000000 
1 1 1 0   0  6  o 394.3847 16.46632 30.39203       2.512001      30.39203       2.512001      30.39203       2.512001  394.3847 16.46632 394.3847 16.46632 0.000000       0.000000 
1 1 1 0   0  7  o 187.7774 29.29199 7.343070       1.981203      7.343070       1.981203      7.343070       1.981203  187.7774 29.29199 187.7774 29.29199 0.000000       0.000000 
1 1 1 0   0  8  o 807.7717 16.50407 126.9448       5.172474      126.9448       5.172474      126.9448       5.172474  807.7717 16.50407 807.7717 16.50407 0.000000       0.000000 
1 1 1 0   0  9  o 1372.718 19.29357 366.4293       10.28083      366.4293       10.28083      366.4293       10.28083  1372.718 19.29357 1372.718 19.29357 0.000000       0.000000 
1 1 1 0   0  10 o 478.0853 20.01963 44.65630       3.702154      44.65630       3.702154      44.65630       3.702154  478.0853 20.01963 478.0853 20.01963 0.000000       0.000000 
1 1 1 0   0  11 o 922.1247 18.35466 165.4503       6.567128      165.4503       6.567128      165.4503       6.567128  922.1247 18.35466 922.1247 18.35466 0.000000       0.000000 
1 1 1 0   0  12 o 315.6464 30.02039 19.91603       3.603505      19.91603       3.603505      19.91603       3.603505  315.6464 30.02039 315.6464 30.02039 0.000000       0.000000 
1 1 1 0   0  13 o 814.2415 19.53892 129.1338       6.170444      129.1338       6.170444      129.1338       6.170444  814.2415 19.53892 814.2415 19.53892 0.000000       0.000000 
1 1 1 0   0  14 o 1002.740 19.96872 195.8210       7.769231      195.8210       7.769231      195.8210       7.769231  1002.740 19.96872 1002.740 19.96872 0.000000       0.000000 
1 1 1 0   0  15 o 165.3870 78.26173 8.016555       5.698024      8.016555       5.698024      8.016555       5.698024  165.3870 78.26173 165.3870 78.26173 0.000000       0.000000 
1 1 1 0   0  16 o 293.7198 41.43136 17.88984       4.455307      17.88984       4.455307      17.88984       4.455307  293.7198 41.43136 293.7198 41.43136 0.000000       0.000000 
1 1 1 0   0  17 o 127.1813 67.44672 4.689095       4.481747      4.689095       4.481747      4.689095       4.481747  127.1813 67.44672 127.1813 67.44672 0.000000       0.000000 
1 1 1 0   0  18 o 213.6523 68.62331 11.43200       5.024045      11.43200       5.024045      11.43200       5.024045  213.6523 68.62331 213.6523 68.62331 0.000000       0.000000 
1 1 1 0   0  19 o 406.4697 50.00991 33.92498       7.573786      33.92498       7.573786      33.92498       7.573786  406.4697 50.00991 406.4697 50.00991 0.000000       0.000000 
1 1 1 0   0  20 o 330.3115 47.68711 22.67399       5.746582      22.67399       5.746582      22.67399       5.746582  330.3115 47.68711 330.3115 47.68711 0.000000       0.000000 
1 1 1 0   0  21 o 698.9984 26.87820 95.58220       7.271833      95.58220       7.271833      95.58220       7.271833  698.9984 26.87820 698.9984 26.87820 0.000000       0.000000 
1 1 1 0   0  22 o 1077.741 23.75312 226.3503       9.930848      226.3503       9.930848      226.3503       9.930848  1077.741 23.75312 1077.741 23.75312 0.000000       0.000000 
1 1 1 0   0  23 o 1287.436 24.04727 322.8858       12.01373      322.8858       12.01373      322.8858       12.01373  1287.436 24.04727 1287.436 24.04727 0.000000       0.000000 
1 1 1 0   0  24 o 99.68345 65.57825 -1.028573      6.443796      -1.028573      6.443796      -1.028573      6.443796  99.68345 65.57825 99.68345 65.57825 0.000000       0.000000 
1 1 1 0   0  25 o 369.2038 53.03235 28.39486       7.148527      28.39486       7.148527      28.39486       7.148527  369.2038 53.03235 369.2038 53.03235 0.000000       0.000000 
1 1 1 0   0  26 o 363.7339 57.62564 27.97619       7.528471      27.97619       7.528471      27.97619       7.528471  363.7339 57.62564 363.7339 57.62564 0.000000       0.000000 
1 1 1 0   0  27 o 959.7711 28.70250 180.3009       10.67666      180.3009       10.67666      180.3009       10.67666  959.7711 28.70250 959.7711 28.70250 0.000000       0.000000 
1 1 1 0   0  28 o 1097.418 27.89158 235.7086       11.86968      235.7086       11.86968      235.7086       11.86968  1097.418 27.89158 1097.418 27.89158 0.000000       0.000000 
1 1 1 0   0  29 o 97.19650 66.66294 -4.738600      8.085328      -4.738600      8.085328      -4.738600      8.085328  97.19650 66.66294 97.19650 66.66294 0.000000       0.000000 
1 1 1 0   0  30 o 431.6943 86.53367 43.00158       12.86736      43.00158       12.86736      43.00158       12.86736  431.6943 86.53367 431.6943 86.53367 0.000000       0.000000 
1 1 1 0   0  31 f 98.97314 70.51446 -14.27730      11.91491      -14.27730      11.91491      -14.27730      11.91491  98.97314 70.51446 98.97314 70.51446 0.000000       0.000000 
1 1 1 0   0  32 o 625.4512 43.11337 79.95517       10.35783      79.95517       10.35783      79.95517       10.35783  625.4512 43.11337 625.4512 43.11337 0.000000       0.000000 
1 1 1 0   0  33 o 303.5001 88.89301 24.82537       9.100849      24.82537       9.100849      24.82537       9.100849  303.5001 88.89301 303.5001 88.89301 0.000000       0.000000 
1 1 1 0   0  34 o 260.0132 119.9848 26.76285       13.33382      26.76285       13.33382      26.76285       13.33382  260.0132 119.9848 260.0132 119.9848 0.000000       0.000000 
1 1 1 0   1  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   1  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   1  3  o 963.5618 15.30748 180.8581       5.728110      180.8581       5.728110      0.000000       0.000000  963.5618 15.30748 ?        ?        0.000000       15.30748 
1 1 1 0   1  4  o 739.7212 10.27716 106.3828       2.952358      107.3501       4.204611      105.4420       4.146525  742.6121 14.57927 735.9917 14.50719 6.620422       20.56730 
1 1 1 0   1  5  f 1397.327 13.07181 379.7576       7.093524      376.1098       9.922362      383.5708       10.14485  1389.486 18.38793 1403.144 18.61725 -13.65710      26.16712 
1 1 1 0   1  6  o 874.4838 11.19188 148.6344       3.800869      148.1342       5.360184      149.1402       5.390426  872.5928 15.81758 875.5469 15.85315 -2.954041      22.39460 
1 1 1 0   1  7  o 390.7943 12.54874 29.68190       1.904480      30.56892       2.699059      28.80236       2.687660  396.4181 17.53198 384.7752 17.98619 11.64288       25.11719 
1 1 1 0   1  8  o 708.2084 11.72561 97.45639       3.224962      101.4279       4.641842      93.75066       4.483832  722.2555 16.54899 694.3790 16.62742 27.87653       23.45933 
1 1 1 0   1  9  o 1005.503 12.40111 196.4554       4.842527      199.0038       6.917546      194.0065       6.781224  1011.650 17.60734 998.8773 17.48107 12.77283       24.81141 
1 1 1 0   1  10 o 1061.381 12.76342 218.9073       5.260976      221.1747       7.483345      216.6915       7.397682  1066.470 18.06837 1055.608 18.04533 10.86206       25.53625 
1 1 1 0   1  11 o 581.8585 13.71739 65.80203       3.099679      64.40909       4.324202      67.27425       4.445533  575.4003 19.35120 588.0526 19.46613 -12.65222      27.44812 
1 1 1 0   1  12 o 622.2231 14.02839 75.26234       3.389861      76.19392       4.773423      74.31452       4.814820  625.7250 19.64348 617.9304 20.06377 7.794617       28.07883 
1 1 1 0   1  13 o 320.9280 21.95583 20.15756       2.720001      16.36422       3.816462      24.07339       3.877590  287.0468 34.95771 349.9573 28.78637 -62.91046      45.28462 
1 1 1 0   1  14 o 483.0883 35.32413 46.02911       6.581188      0.000000       0.000000      46.02911       6.581188  ?        ?        483.0883 35.32413 0.000000       35.32413 
1 1 1 0   1  15 o 474.5657 25.82904 44.16323       4.742358      43.97972       6.740654      44.34308       6.673268  471.1327 37.14218 473.2225 36.59605 -2.089813      52.14223 
1 1 1 0   1  16 o 358.6413 26.90682 25.32979       3.720263      27.17284       6.429643      24.40221       4.561361  366.7809 46.16154 350.5236 33.93279 16.25732       57.29156 
1 1 1 0   1  17 o 662.0824 16.91752 85.41727       4.349874      88.39302       6.244467      82.61210       6.062856  672.3419 23.91537 649.9648 24.01925 22.37708       33.89497 
1 1 1 0   1  18 o 258.4628 40.42128 13.51093       3.924377      18.23750       6.768825      11.11772       4.816494  295.3008 61.04012 230.9467 54.56831 64.35406       81.87550 
1 1 1 0   1  19 o 649.2879 21.44619 82.23367       5.407735      86.29761       6.672184      74.45307       9.232107  664.4540 25.85682 613.4346 38.95494 51.01935       46.75535 
1 1 1 0   1  20 o 1189.690 16.07416 275.4243       7.426598      257.0713       10.01170      297.8790       11.07406  1148.192 22.45253 1235.824 23.07396 -87.63196      32.19509 
1 1 1 0   1  21 o 678.8954 19.17600 89.73538       5.055788      88.58443       7.130001      90.89931       7.170095  673.6117 27.25536 682.3830 27.05632 -8.771301      38.40442 
1 1 1 0   1  22 o 808.0076 18.30552 127.0478       5.744145      140.8764       8.351637      114.6336       7.912995  850.0120 25.29989 766.6007 26.57931 83.41132       36.69529 
1 1 1 0   1  23 o 422.8904 28.96560 35.07256       4.728399      40.33596       6.729608      29.94048       6.645124  452.0087 38.71019 387.6850 44.97165 64.32370       59.33741 
1 1 1 0   1  24 o 797.1081 28.02002 124.0625       8.673883      0.000000       0.000000      124.0625       8.673883  ?        ?        797.1081 28.02002 0.000000       28.02002 
1 1 1 0   1  25 o 486.7234 28.68921 46.47440       5.398885      39.22058       7.683498      53.54856       7.587755  443.4656 45.24784 520.7234 37.77842 -77.25778      58.94554 
1 1 1 0   1  26 o 1075.861 26.97661 226.2915       11.27124      226.2915       11.27124      0.000000       0.000000  1075.861 26.97661 ?        ?        0.000000       26.97661 
1 1 1 0   1  27 o 428.8672 35.17781 36.40127       5.807361      44.36712       8.246135      28.56275       8.179963  470.9182 45.66350 373.0672 58.37299 97.85095       74.11182 
1 1 1 0   1  28 o 347.3944 43.97163 24.33058       5.799479      18.04811       8.290735      30.35026       8.115478  290.1465 73.49550 384.6136 55.97477 -94.46710      92.38378 
1 1 1 0   1  29 o 348.8509 53.51485 25.14900       7.018632      40.54415       12.21306      17.55738       8.576289  433.8848 75.20595 283.3172 76.26084 150.5676       107.1058 
1 1 1 0   1  30 o 366.2777 51.36942 27.81785       7.106119      30.98679       8.584367      20.91869       12.66628  382.9270 59.66929 299.4382 96.10391 83.48877       113.1211 
1 1 1 0   1  31 o 463.9837 52.37906 45.01289       9.272971      46.44019       12.77558      43.42367       13.48074  455.5579 74.80945 433.7618 83.05128 21.79611       111.7764 
1 1 1 0   1  32 o 608.5548 43.83903 76.43391       10.29129      89.70686       14.36292      62.43005       14.75309  645.7631 57.88636 521.5355 74.99754 124.2276       94.73891 
1 1 1 0   1  33 o 330.4819 51.70745 23.75607       6.418801      31.25899       9.305679      16.94628       8.865427  366.9079 67.80514 259.7744 80.00301 107.1335       104.8714 
1 1 1 0   1  34 o 178.8897 75.31873 5.243091       8.912533      -7.850015      12.33202      19.55955       12.89528  154.1845 73.61443 258.0905 96.11928 -103.9061      121.0702 
1 1 1 0   2  0  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   2  1  o 33.32603 13.64170 0.7179281E-01  0.2809704     0.7179281E-01  0.2809704     0.000000       0.000000  33.32603 13.64170 ?        ?        0.000000       13.64170 
1 1 1 0   2  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   2  3  o 982.7234 15.49909 188.0913       5.915148      188.0913       5.915148      0.000000       0.000000  982.7234 15.49909 ?        ?        0.000000       15.49909 
1 1 1 0   2  4  o 576.0762 10.09169 64.51209       2.257730      67.82024       3.256173      61.44911       3.133200  590.3401 14.20290 561.9142 14.35788 28.42590       20.19582 
1 1 1 0   2  5  o 1124.328 11.88319 245.7694       5.188646      232.6822       6.984489      261.8864       7.750922  1093.356 16.44921 1159.812 17.20830 -66.45520      23.80550 
1 1 1 0   2  6  o 1185.073 12.28796 272.9915       5.655262      268.8075       7.886539      277.4200       8.113799  1175.348 17.27794 1193.996 17.49820 -18.64832      24.59094 
1 1 1 0   2  7  o 698.7824 11.32146 94.88317       3.072363      93.57670       4.317043      96.22402       4.373463  693.7088 16.02438 703.4540 16.00891 -9.745178      22.65096 
1 1 1 0   2  8  o 1323.190 13.21772 340.2508       6.792141      334.9030       9.456937      345.9485       9.761372  1312.228 18.55724 1333.658 18.84684 -21.42993      26.44947 
1 1 1 0   2  9  o 978.6180 12.35045 186.0883       4.693793      190.0077       6.726542      182.3685       6.552915  988.5310 17.52159 968.4630 17.42302 20.06805       24.70967 
1 1 1 0   2  10 o 1540.371 14.55359 461.1769       8.706098      454.2631       12.11992      468.5478       12.51411  1528.067 20.42345 1551.857 20.76443 -23.79016      29.12523 
1 1 1 0   2  11 o 935.0406 12.88737 169.9126       4.679752      171.5772       6.672024      168.3006       6.565598  939.2078 18.29228 930.2068 18.17468 9.000977       25.78617 
1 1 1 0   2  12 o 1487.307 14.67995 430.0759       8.479168      433.6883       12.10006      426.5905       11.88553  1492.582 20.87475 1480.354 20.67402 12.22852       29.37976 
1 1 1 0   2  13 o 649.8452 14.62636 82.12295       3.691256      84.45860       5.227403      79.80008       5.213076  658.5547 20.43931 640.0861 20.97141 18.46863       29.28422 
1 1 1 0   2  14 o 522.1020 19.18556 53.10031       3.890075      52.98721       4.802042      53.31623       6.634855  521.1053 23.72862 520.5245 32.99239 0.5808716      40.63921 
1 1 1 0   2  15 o 179.0684 41.92353 6.590724       2.864015      9.435463       4.127112      3.948261       3.977677  213.4168 50.57008 150.6620 53.79436 62.75482       73.83201 
1 1 1 0   2  16 f 447.5026 22.70656 39.22607       3.933233      41.79788       6.627719      37.82789       4.886796  458.6231 37.54071 438.2539 28.87421 20.36920       47.36058 
1 1 1 0   2  17 o 610.0624 19.94045 72.61964       4.724299      76.97855       8.051921      70.33133       5.834030  624.5505 33.31775 599.5341 25.05687 25.01642       41.68836 
1 1 1 0   2  18 o 186.6200 51.83846 7.178625       3.891232      5.274953       6.662202      8.164316       4.793935  182.5256 68.86465 199.1620 58.27449 -16.63640      90.21230 
1 1 1 0   2  19 o 539.5130 20.36832 56.74875       4.267615      50.75025       5.789588      63.88597       6.315254  508.2551 29.45808 571.3392 28.46222 -63.08405      40.96189 
1 1 1 0   2  20 o 237.3785 47.66466 11.52610       4.241422      8.559496       5.150535      17.77650       7.476127  205.0493 60.51901 291.6636 67.36243 -86.61435      90.55522 
1 1 1 0   2  21 o 1088.608 16.43613 230.5592       6.948627      231.5916       9.850975      229.5368       9.802886  1089.982 23.27189 1085.138 23.26167 4.844238       32.90420 
1 1 1 0   2  22 o 215.2154 50.33483 9.498788       4.131948      14.27210       5.781188      4.514141       5.907782  263.3257 58.09106 172.8332 64.92246 90.49251       87.11772 
1 1 1 0   2  23 o 465.3765 27.33021 42.39832       4.917737      44.46215       6.946776      40.32500       6.962713  474.8531 37.98809 451.6685 40.11197 23.18457       55.24549 
1 1 1 0   2  24 o 535.7587 25.61153 55.99836       5.328841      48.24966       7.372333      64.47605       7.711329  494.3647 38.70901 572.7165 34.83612 -78.35181      52.07632 
1 1 1 0   2  25 o 685.3478 22.39984 91.59097       5.961890      92.75903       8.309466      90.35175       8.558835  688.3640 31.08329 679.1264 32.45160 9.237610       44.93637 
1 1 1 0   2  26 o 1031.573 18.95057 207.3322       7.591890      196.4195       10.57325      218.9461       10.90767  1002.274 27.16400 1058.355 26.53828 -56.08063      37.97583 
1 1 1 0   2  27 o 870.9879 31.12571 148.7840       10.52833      148.7840       10.52833      0.000000       0.000000  870.9879 31.12571 ?        ?        0.000000       31.12571 
1 1 1 0   2  28 o 744.5427 27.36727 108.6253       7.913143      138.0213       14.50495      96.16914       9.441992  831.7042 45.07586 698.6038 34.80204 133.1005       56.94748 
1 1 1 0   2  29 o 300.9245 52.38479 18.79005       5.899561      18.18769       8.156992      19.45074       8.542857  289.0704 72.72407 298.5599 74.04150 -9.489502      103.7831 
1 1 1 0   2  30 o 400.8602 46.57494 32.90041       7.115443      41.12387       8.627887      15.41470       12.58109  446.7131 50.62732 265.7504 95.58784 180.9627       108.1673 
1 1 1 0   2  31 o 167.1754 65.15498 4.415425       6.098181      5.775967       8.493821      2.968067       8.760627  191.1426 76.15224 177.4265 74.68688 13.71605       106.6644 
1 1 1 0   2  32 o 346.6738 58.90761 26.30696       7.647079      22.05142       13.51688      28.31016       9.273888  289.8715 99.48989 351.8720 70.32468 -62.00058      121.8351 
1 1 1 0   2  33 o 264.1311 95.23177 19.02250       12.49516      19.02250       12.49516      0.000000       0.000000  264.1311 95.23177 ?        ?        0.000000       95.23177 
1 1 1 0   2  34 o 102.2302 50.46470 -13.08893      7.254703      6.233364       12.32603      -23.33006      8.973619  196.0230 85.61078 100.5094 50.58846 95.51357       99.44042 
1 1 1 0   3  1  o 448.6291 18.96955 39.26717       3.305008      39.26717       3.305008      0.000000       0.000000  448.6291 18.96955 ?        ?        0.000000       18.96955 
1 1 1 0   3  2  o 304.0568 11.52129 17.98095       1.360454      20.77471       1.679259      12.64516       2.320720  326.7408 13.23385 253.2062 23.88257 73.53458       27.30407 
1 1 1 0   3  3  o 703.1364 11.81638 96.15280       3.226651      94.31850       3.882655      100.2477       5.801147  696.1356 14.36174 716.7621 20.84063 -20.62646      25.30991 
1 1 1 0   3  4  o 970.3187 11.15398 183.0375       4.203124      177.3174       5.802831      189.3508       6.096250  954.4898 15.65455 986.3073 15.91558 -31.81744      22.32422 
1 1 1 0   3  5  o 292.8488 12.52200 16.67318       1.424115      15.85766       2.003677      17.50574       2.024490  284.8256 18.20953 299.3888 17.48820 -14.56320      25.24726 
1 1 1 0   3  6  o 549.4540 11.13334 58.66676       2.375663      56.84933       3.314137      60.58767       3.407183  540.6680 15.78381 558.1653 15.71827 -17.49731      22.27538 
1 1 1 0   3  7  o 289.9290 14.79584 16.38309       1.660394      18.95784       2.365014      13.88049       2.331646  311.5381 19.64831 266.0424 22.78744 45.49576       30.08859 
1 1 1 0   3  8  o 1089.874 12.41135 230.8111       5.253191      220.8260       7.153143      242.5009       7.739753  1065.686 17.28382 1116.712 17.84670 -51.02612      24.84422 
1 1 1 0   3  9  o 1339.046 13.55523 348.4522       7.049049      347.3983       9.914278      349.5296       10.02435  1336.483 19.10160 1340.559 19.25496 -4.075928      27.12240 
1 1 1 0   3  10 o 418.1603 15.26532 33.99028       2.479001      33.02083       3.505744      34.95984       3.505931  411.3279 22.02638 423.3231 21.39509 -11.99518      30.70686 
1 1 1 0   3  11 o 885.0966 12.91792 152.2505       4.440289      149.4505       6.210573      155.1784       6.350810  876.5393 18.24451 893.1731 18.30904 -16.63379      25.84730 
1 1 1 0   3  12 o 376.4891 18.27506 27.57924       2.672017      26.50531       3.828587      28.59908       3.730911  367.6695 27.00236 382.2077 25.27823 -14.53821      36.98806 
1 1 1 0   3  13 o 310.9214 25.61538 18.98747       3.065470      16.43607       3.795964      23.77093       5.197607  287.6551 34.67917 345.7696 39.41109 -58.11453      52.49647 
1 1 1 0   3  14 o 304.7375 24.39619 18.24481       2.862987      19.68946       4.079036      16.84210       4.019373  315.0230 33.87391 290.5630 36.41981 24.46008       49.73775 
1 1 1 0   3  15 o 360.8075 21.96822 25.50498       3.063553      27.74141       4.463657      23.51334       4.212297  374.7733 30.94541 344.6523 31.83056 30.12103       44.39372 
1 1 1 0   3  16 o 314.0316 30.80711 19.54894       3.708719      22.15000       6.498415      18.29252       4.516490  328.5417 52.71425 301.6611 39.50174 26.88062       65.87245 
1 1 1 0   3  17 o 558.2371 21.18969 60.84011       4.593791      54.55580       7.835229      64.13185       5.670686  523.9488 38.78205 572.4451 25.50784 -48.49634      46.41872 
1 1 1 0   3  18 o 359.5609 25.83580 25.41687       3.583583      21.58564       4.979434      29.53317       5.161365  328.2562 39.87973 385.9062 34.81419 -57.65005      52.93789 
1 1 1 0   3  19 o 508.3322 20.82913 50.38165       4.111939      54.51003       5.748090      46.05481       5.884634  527.1202 28.18136 483.7486 31.49531 43.37167       42.26279 
1 1 1 0   3  20 o 413.5828 30.22996 33.63374       4.821795      32.59492       5.860043      35.81149       8.484690  405.7190 37.61976 421.6179 52.98955 -15.89886      64.98568 
1 1 1 0   3  21 o 603.4761 20.69380 70.92931       4.849850      70.09855       6.898041      71.74141       6.820071  598.9839 29.65396 606.0463 28.97711 -7.062439      41.46119 
1 1 1 0   3  22 o 1203.460 16.75990 281.7325       7.833051      283.7982       11.12798      279.7038       11.02791  1206.780 23.74435 1198.050 23.70229 8.729126       33.54985 
1 1 1 0   3  23 o 909.2676 18.09418 160.8774       6.389380      168.8921       9.241869      153.5393       8.843206  930.6670 25.57040 887.3459 25.66190 43.32104       36.22677 
1 1 1 0   3  24 o 998.8265 18.04037 194.1832       6.997832      200.5091       9.900371      187.8673       9.892491  1013.830 25.14538 981.2007 25.96091 32.62939       36.14220 
1 1 1 0   3  25 o 238.5601 54.72425 11.76695       4.962185      12.58593       6.995365      10.93748       7.040027  246.0948 69.91238 231.6686 71.28339 14.42613       99.84518 
1 1 1 0   3  26 o 318.2249 52.22643 20.65668       6.230375      16.43455       10.56825      22.90578       7.713330  280.0898 87.52966 332.5910 61.99865 -52.50122      107.2626 
1 1 1 0   3  27 o 107.5509 50.41744 -5.164996      5.305653      -6.105238      7.405630      -4.173448      7.604993  130.2003 60.54786 139.7824 63.65498 -9.582169      87.85215 
1 1 1 0   3  28 o 536.1622 30.27483 56.63080       6.278074      63.04322       8.934311      50.37604       8.823795  562.4712 41.18730 500.8907 45.87063 61.58044       61.64827 
1 1 1 0   3  29 o 309.6746 60.04230 20.24935       6.960251      25.45970       8.355788      8.439919       12.57964  346.2560 64.51231 232.7290 92.68973 113.5270       112.9302 
1 1 1 0   3  30 o 181.4298 69.61901 5.434281       6.881593      8.606910       8.242252      -1.866775      12.50343  210.6975 77.13297 186.5387 83.58263 24.15880       113.7346 
1 1 1 0   3  31 o 258.5760 67.90316 14.98476       6.906207      17.06631       8.563686      11.11280       11.67972  272.0087 77.38093 234.1310 90.47044 37.87770       119.0492 
1 1 1 0   3  32 o 148.0014 65.47095 -0.3300357     7.423936      23.74657       13.49261      -10.78399      8.890750  299.1134 99.40098 126.1206 60.80856 172.9927       116.5257 
1 1 1 0   3  33 o 115.1154 56.70354 -15.33789      8.994083      0.000000       0.000000      -15.33789      8.994083  ?        ?        115.1154 56.70354 0.000000       56.70354 
1 1 1 0   3  34 o 166.7776 66.63358 5.142669       6.520676      6.470733       9.446665      3.934024       9.011944  186.7770 78.02048 172.6196 74.30226 14.15732       107.7405 
1 1 1 0   4  0  o 1355.668 17.96810 357.5264       9.459831      348.8414       12.98188      367.3594       13.81323  1337.947 24.98450 1372.815 25.90927 -34.86816      35.99327 
1 1 1 0   4  1  o 765.1343 14.56418 113.9484       4.327645      113.9484       4.327645      0.000000       0.000000  765.1343 14.56418 ?        ?        0.000000       14.56418 
1 1 1 0   4  2  o 919.9886 10.81717 164.5442       3.864774      172.2496       5.640213      157.7242       5.306289  940.7000 15.43890 900.1995 15.17833 40.50043       21.65044 
1 1 1 0   4  3  o 252.1289 16.49529 12.42706       1.606238      12.42706       1.606238      0.000000       0.000000  252.1289 16.49529 ?        ?        0.000000       16.49529 
1 1 1 0   4  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 0   4  5  o 474.2047 11.10989 43.69986       2.045991      43.83557       2.902686      43.56587       2.884340  474.7474 15.74379 473.2872 15.69255 1.460205       22.22889 
1 1 1 0   4  6  o 605.6992 11.21538 71.28666       2.638148      70.43739       3.703602      72.16144       3.758819  601.8760 15.84489 609.1951 15.88792 -7.319092      22.43851 
1 1 1 0   4  7  o 338.6007 14.14107 22.28360       1.859508      19.93732       2.569793      24.86234       2.694092  319.4269 20.82964 356.9741 19.50721 -37.54718      28.53778 
1 1 1 0   4  8  o 492.8118 12.82185 47.19307       2.453916      41.40221       3.354708      53.85751       3.598863  461.3961 18.72203 526.2891 17.60812 -64.89304      25.70136 
1 1 1 0   4  9  o 1095.650 12.72930 233.2690       5.416322      226.6505       7.448157      240.6973       7.890653  1079.624 17.76431 1112.532 18.26302 -32.90747      25.47761 
1 1 1 0   4  10 o 231.0850 23.56606 10.50432       2.085289      7.313800       2.856054      14.14705       3.051751  189.8244 40.00402 267.7012 29.86318 -77.87677      49.92125 
1 1 1 0   4  11 o 752.6318 13.17719 110.0975       3.851531      108.7334       5.430479      111.4781       5.463445  747.5934 18.70444 756.9795 18.58465 -9.386047      26.36750 
1 1 1 0   4  12 o 635.3229 16.11353 78.50720       3.975696      85.53829       5.076890      67.35880       6.392823  662.8884 19.72102 587.4998 28.01928 75.38855       34.26366 
1 1 1 0   4  13 o 90.19301 39.98526 -0.9388107     2.783790      0.3752602      3.455206      -3.369810      4.699558  111.7306 46.96167 107.2493 49.28848 4.481323       68.07902 
1 1 1 0   4  14 o 120.9664 43.81880 2.412997       2.649948      2.240826       3.767418      2.581590       3.728077  131.9613 51.27256 134.7695 51.35379 -2.808151      72.56781 
1 1 1 0   4  15 o 722.3788 15.04010 101.5886       4.219333      99.67747       5.884116      103.6113       6.053568  714.6467 21.20127 728.5782 21.39475 -13.93146      30.12024 
1 1 1 0   4  16 o 664.9353 22.99522 86.41000       5.938066      0.000000       0.000000      86.41000       5.938066  ?        ?        664.9353 22.99522 0.000000       22.99522 
1 1 1 0   4  17 o 492.8824 28.49472 47.78296       5.430991      0.000000       0.000000      47.78296       5.430991  ?        ?        492.8824 28.49472 0.000000       28.49472 
1 1 1 0   4  18 o 761.1100 16.45183 112.8098       4.862836      109.1008       6.765840      116.7731       6.994011  747.4090 23.30963 773.2463 23.29059 -25.83734      32.95133 
1 1 1 0   4  19 o 524.7266 21.05389 53.68019       4.290358      51.30571       5.968959      56.21817       6.171052  511.0328 30.21037 535.0968 29.81450 -24.06400      42.44491 
1 1 1 0   4  20 o 555.3536 24.38773 60.16581       5.259797      64.32409       6.450522      51.91549       9.086021  572.9424 29.08591 510.8218 46.30439 62.12067       54.68169 
1 1 1 0   4  21 o 135.4732 55.17734 1.472660       4.567829      2.794100       5.502417      -1.456931      8.192816  155.7587 61.53260 158.9584 69.59983 -3.199661      92.89993 
1 1 1 0   4  22 o 765.2664 19.08965 113.9776       5.673336      121.8188       8.052494      106.2490       7.994439  790.3480 26.23518 737.9062 27.89709 52.44177       38.29533 
1 1 1 0   4  23 o 376.8373 32.44584 27.96435       4.702035      28.82973       6.590676      27.06728       6.710300  380.1577 45.54837 367.6032 48.16261 12.55450       66.28945 
1 1 1 0   4  24 o 714.1008 21.59777 99.36578       5.989582      91.31785       8.281713      108.1920       8.672919  683.2742 31.21024 743.9314 30.01957 -60.65723      43.30420 
1 1 1 0   4  25 o 663.9484 26.69259 86.12975       6.882607      75.79650       11.12350      92.53987       8.761044  617.2640 46.74951 687.1260 32.83155 -69.86206      57.12642 
1 1 1 0   4  26 o 127.0722 55.73187 -1.053345      5.272724      4.558989       7.098292      -7.962269      7.875666  181.4471 70.41233 129.3960 60.90144 52.05103       93.09608 
1 1 1 0   4  27 o 463.4670 33.78315 42.43361       6.038737      46.07567       8.196212      38.10909       8.931172  480.1543 44.45916 433.1935 54.28000 46.96088       70.16363 
1 1 1 0   4  28 o 151.9691 61.78533 2.217041       5.714491      0.6878869      7.547897      4.270688       8.747086  160.7761 68.56946 190.5069 76.79900 -29.73073      102.9556 
1 1 1 0   4  29 f 146.1642 63.91309 -0.6429029     6.888409      -0.4423970E-01 8.112145      -2.190383      13.04238  160.9856 69.89079 191.7906 85.69071 -30.80499      110.5786 
1 1 1 0   4  30 o 413.7166 44.52859 34.93475       7.041669      40.37601       8.603003      23.88918       12.25729  441.8422 51.07810 317.7178 93.24373 124.1243       106.3173 
1 1 1 0   4  31 o 366.2829 45.26431 27.75785       6.301732      39.03723       8.689121      15.24213       9.152947  430.5887 53.08606 256.3960 81.63283 174.1927       97.37581 
1 1 1 0   4  32 o 128.9501 59.63248 -3.897761      7.033802      -18.99864      11.62019      4.834757       8.836535  131.7312 64.80366 183.5278 75.95823 -51.79655      99.84571 
1 1 1 0   4  33 o 382.7139 68.15274 34.24658       9.758118      0.000000       0.000000      34.24658       9.758118  ?        ?        382.7139 68.15274 0.000000       68.15274 
1 1 1 0   4  34 o 291.0869 60.48457 19.73023       6.614175      16.53991       9.715899      22.48570       9.029487  246.8035 84.35621 295.1499 77.70803 -48.34641      114.6931 
1 1 1 0   5  1  o 1683.822 14.53157 551.5593       9.502474      539.0286       13.02145      565.8345       13.89843  1663.168 20.16022 1703.763 21.00530 -40.59460      29.11455 
1 1 1 0   5  2  o 534.3918 12.24936 55.51907       2.542151      55.78752       3.124514      54.99336       4.372433  535.5192 15.02379 531.2167 21.19451 4.302490       25.97925 
1 1 1 0   5  3  o 793.7155 15.09103 122.5364       4.651699      122.5364       4.651699      0.000000       0.000000  793.7155 15.09103 ?        ?        0.000000       15.09103 
1 1 1 0   5  4  o 698.7693 10.65666 94.88127       2.891896      95.27209       4.108098      94.49735       4.071664  699.9506 15.11282 697.1037 15.03996 2.846924       21.32129 
1 1 1 0   5  5  o 372.2254 12.26873 26.92571       1.773510      28.21475       2.545636      25.70995       2.472218  380.8798 17.20998 363.5700 17.50938 17.30975       24.55121 
1 1 1 0   5  6  o 553.7310 11.60728 59.57701       2.496072      58.34431       3.520856      60.82258       3.539173  547.7881 16.55037 559.3126 16.29368 -11.52454      23.22496 
1 1 1 0   5  7  o 1121.794 12.47617 244.5281       5.435287      240.2886       7.564449      249.0531       7.814984  1111.648 17.52193 1131.717 17.78125 -20.06873      24.96379 
1 1 1 0   5  8  o 1170.053 12.81348 266.0262       5.822383      269.4034       8.272627      262.7113       8.196094  1177.032 18.09786 1162.315 18.15746 14.71643       25.63642 
1 1 1 0   5  9  o 827.0609 12.41986 132.9176       3.989167      130.7140       5.548452      135.2756       5.739465  819.8935 17.42555 834.0569 17.71935 -14.16339      24.85206 
1 1 1 0   5  10 o 458.3531 15.14168 40.84231       2.695270      42.54625       3.816430      39.14680       3.806962  467.5614 21.01796 448.4520 21.85922 19.10944       30.32458 
1 1 1 0   5  11 o 592.8836 14.05130 68.33427       3.235295      72.18613       4.624209      64.64086       4.528101  609.0353 19.55091 576.2817 20.23268 32.75366       28.13537 
1 1 1 0   5  12 o 1026.572 15.33348 204.9646       6.113051      209.9589       7.676375      196.3069       10.10687  1038.550 19.03272 1003.148 25.94320 35.40179       32.17598 
1 1 1 0   5  13 o 777.2352 14.07824 117.4979       4.249411      115.1656       5.949760      119.9263       6.071229  768.8378 19.92677 784.5680 19.92590 -15.73022      28.18009 
1 1 1 0   5  14 o 186.0134 38.85165 7.069502       2.716070      7.593291       3.819436      6.533656       3.863144  191.7981 50.56032 179.0943 52.28633 12.70384       72.73380 
1 1 1 0   5  15 o 164.0284 45.11439 5.517710       2.963594      3.955332       4.230897      7.022732       4.152512  152.5607 55.35189 185.1137 54.25661 -32.55302      77.50879 
1 1 1 0   5  16 o 454.9863 23.11261 40.56203       4.070488      39.83235       7.049745      40.92696       4.985504  446.5500 41.11312 456.0179 28.29097 -9.467865      49.90659 
1 1 1 0   5  17 o 229.3970 43.94920 10.77556       3.772771      6.978496       6.480640      12.72215       4.640131  194.5146 68.74803 248.2844 49.85481 -53.76985      84.92228 
1 1 1 0   5  18 f 577.1258 18.91635 64.91135       4.239707      66.55700       6.057250      63.33078       5.936282  583.3384 26.73788 569.0053 26.86397 14.33313       37.90234 
1 1 1 0   5  19 o 491.0863 22.17082 47.02934       4.228316      47.66982       6.038176      46.41306       5.922973  492.3226 31.75043 485.7985 31.56584 6.524109       44.77155 
1 1 1 0   5  20 o 687.1594 18.60067 91.92621       4.963799      95.31096       7.029343      88.55963       7.010438  698.8464 25.90031 673.5210 26.80193 25.32544       37.27156 
1 1 1 0   5  21 o 965.5383 19.53757 181.4836       7.326020      190.3273       9.047585      164.6451       12.48438  988.2139 23.57511 917.0846 35.05334 71.12933       42.24361 
1 1 1 0   5  22 o 869.3741 18.22049 147.0671       6.151695      142.4271       8.576803      151.9832       8.828265  854.6514 25.84095 882.8704 25.74841 -28.21893      36.47924 
1 1 1 0   5  23 o 868.2701 21.64197 146.8442       7.297591      153.3627       12.70011      143.6311       8.916590  884.7057 36.96415 858.0148 26.75938 26.69086       45.63346 
1 1 1 0   5  24 o 811.5029 20.22758 128.2793       6.374733      121.9071       8.777957      135.3903       9.272856  789.8383 28.61721 832.3591 28.68632 -42.52081      40.51974 
1 1 1 0   5  25 o 325.3952 41.18524 21.18582       5.088002      28.38461       7.085231      13.52068       7.311129  375.1372 49.86931 254.3485 71.19987 120.7887       86.92738 
1 1 1 0   5  26 o 543.3611 28.79882 57.94973       6.055337      53.78954       8.217374      62.89306       8.957495  520.5499 40.97971 563.0400 41.25278 -42.49017      58.14747 
1 1 1 0   5  27 o 675.8530 25.16871 89.31236       6.606039      78.73887       8.910356      102.2176       9.843954  631.1794 36.50670 720.6679 35.17276 -89.48846      50.69381 
1 1 1 0   5  28 o 443.5739 49.34036 39.87970       8.355528      39.87970       8.355528      0.000000       0.000000  443.5739 49.34036 ?        ?        0.000000       49.34036 
1 1 1 0   5  29 o 443.2825 37.33157 39.31588       6.366828      44.05721       8.533156      33.36150       9.562641  465.1541 47.92342 396.7873 64.25414 68.36673       80.15764 
1 1 1 0   5  30 o 380.8306 42.41659 29.55586       6.166709      42.16028       8.512601      15.63661       8.945588  452.1568 49.27586 262.9479 80.25892 189.2089       94.17858 
1 1 1 0   5  31 f 166.2462 64.66092 4.482487       5.996621      -3.240296      8.166903      13.51689       8.833244  144.0866 65.75031 242.9143 80.41295 -98.82774      103.8718 
1 1 1 0   5  32 o 500.5885 39.82302 51.50645       7.677812      60.87852       12.71658      46.13024       9.631419  523.0232 63.93805 462.5981 54.66836 60.42505       84.12315 
1 1 1 0   5  33 o 284.1858 70.72898 19.53149       7.775009      39.15947       14.76568      12.00156       9.145580  370.3688 100.2206 221.4600 81.22305 148.9088       129.0013 
1 1 1 0   6  0  o 1245.397 17.63051 301.4876       8.527085      303.5067       12.12377      299.5110       11.99549  1248.899 24.99669 1240.661 24.89643 8.237915       35.27983 
1 1 1 0   6  1  o 954.3030 11.37848 176.9871       4.216951      177.5748       5.966534      176.4005       5.960809  955.4795 16.07951 952.3112 16.11753 3.168335       22.76676 
1 1 1 0   6  2  o 730.1326 15.40745 103.6674       4.368784      103.6674       4.368784      0.000000       0.000000  730.1326 15.40745 ?        ?        0.000000       15.40745 
1 1 1 0   6  3  o 950.4248 11.36362 175.5308       4.194330      169.2459       5.755285      182.6498       6.125351  932.9273 15.88514 969.1317 16.27497 -36.20441      22.74230 
1 1 1 0   6  4  o 440.1976 11.31467 37.65153       1.934272      33.10073       2.661412      42.74665       2.816084  412.5801 16.61024 468.9019 15.46449 -56.32178      22.69472 
1 1 1 0   6  5  o 738.5455 11.17289 105.9766       3.204579      97.64433       4.355969      115.8060       4.731162  708.7063 15.82670 771.8087 15.78448 -63.10242      22.35250 
1 1 1 0   6  6  o 1178.238 12.56402 269.7568       5.748964      269.0430       8.090019      270.4850       8.171114  1176.266 17.70989 1179.402 17.83986 -3.135864      25.13764 
1 1 1 0   6  7  o 831.4379 11.94737 134.3170       3.857714      134.7970       5.463751      133.8398       5.447548  832.6606 16.89643 829.6983 16.90647 2.962341       23.90226 
1 1 1 0   6  8  o 1043.970 12.56710 211.7802       5.095081      221.4132       7.429656      203.2278       7.000542  1067.054 17.92892 1022.319 17.63263 44.73486       25.14669 
1 1 1 0   6  9  o 345.5188 17.12898 23.21516       2.298430      25.17276       3.237771      21.22655       3.263321  358.8134 23.36275 329.0937 25.73858 29.71964       34.76051 
1 1 1 0   6  10 o 905.5544 12.89340 159.3774       4.534296      155.9527       6.266365      163.1412       6.569281  895.3799 18.02106 915.7416 18.47213 -20.36163      25.80655 
1 1 1 0   6  11 o 1342.094 16.14739 350.3371       8.416143      342.5371       10.17925      367.1886       14.96190  1326.521 19.75940 1371.685 28.08694 -45.16418      34.34109 
1 1 1 0   6  12 o 669.0921 14.58954 87.07075       3.791015      92.95332       5.339110      81.08933       5.383780  690.8447 19.90034 645.0918 21.49007 45.75293       29.28901 
1 1 1 0   6  13 o 440.0925 18.22446 37.72517       3.114775      41.35313       4.432406      34.18571       4.378011  459.4846 24.93271 417.2861 27.16364 42.19846       36.87144 
1 1 1 0   6  14 o 390.8793 20.17616 29.87940       3.052289      29.12953       4.275046      30.65913       4.359365  384.5039 28.83947 394.5618 28.64517 -10.05783      40.64801 
1 1 1 0   6  15 o 575.8536 19.08583 64.67404       4.268262      61.13293       6.973116      66.79572       5.397544  556.6702 32.39536 584.5162 23.77780 -27.84601      40.18511 
1 1 1 0   6  16 o 374.0522 24.08084 27.46902       3.479508      25.36766       4.969075      29.49061       4.873841  356.8516 36.36396 385.8695 32.83611 -29.01797      48.99538 
1 1 1 0   6  17 o 559.1636 21.71446 61.03050       4.715371      59.06168       8.091550      62.04294       5.802465  545.7644 38.42189 563.0585 26.53573 -17.29413      46.69461 
1 1 1 0   6  18 o 197.7542 52.34704 8.071370       4.083175      10.06483       6.929274      7.010971       5.053808  223.2446 71.02247 188.5307 60.72589 34.71382       93.44423 
1 1 1 0   6  19 f 429.2142 24.61646 36.06689       4.086102      40.68941       5.756159      31.37152       5.801346  454.6027 32.82486 397.8414 38.01090 56.76135       50.22251 
1 1 1 0   6  20 o 478.1342 23.72269 44.57169       4.404958      43.70676       6.136199      45.49134       6.327298  471.3209 33.74724 480.8279 34.10575 -9.506989      47.97998 
1 1 1 0   6  21 o 665.2514 23.21721 86.23289       5.998241      94.33568       7.491483      71.76022       10.01210  695.2907 27.74428 602.8521 43.04786 92.43860       51.21389 
1 1 1 0   6  22 o 421.3233 41.92627 35.18187       6.768975      48.56416       9.485801      21.29726       9.662190  493.7916 50.16191 318.9448 78.52995 174.8468       93.18353 
1 1 1 0   6  23 o 756.0125 20.09155 111.2905       5.898892      111.3278       8.131246      111.2492       8.570676  755.1956 27.72488 754.7062 29.24214 0.4894409      40.29605 
1 1 1 0   6  24 o 636.8009 22.93416 79.07587       5.671716      68.22552       7.573965      92.92847       8.557897  589.2213 33.23481 688.9548 31.98514 -99.73352      46.12594 
1 1 1 0   6  25 o 574.0353 35.06143 64.93456       7.778734      64.93456       7.778734      0.000000       0.000000  574.0353 35.06143 ?        ?        0.000000       35.06143 
1 1 1 0   6  26 o 596.1218 26.26184 69.47536       6.079783      66.36456       8.093754      73.50360       9.210270  579.7909 36.12554 609.4449 39.12103 -29.65405      53.24950 
1 1 1 0   6  27 o 215.7392 66.66746 9.546225       6.150294      7.437399       7.090056      15.95707       12.36195  201.5347 71.83495 278.2767 95.15206 -76.74207      119.2232 
1 1 1 0   6  28 o 308.7196 58.40153 19.94850       6.745437      20.30791       7.867325      18.95096       13.10679  308.3058 67.57275 294.2283 97.97868 14.07755       119.0206 
1 1 1 0   6  29 o 190.3454 65.96127 7.105237       5.948417      12.57776       8.153685      0.8787150      8.697267  241.4750 77.06555 169.8373 73.04859 71.63768       106.1847 
1 1 1 0   6  30 o 503.3605 32.85429 50.57470       6.387205      62.84460       8.747038      36.55882       9.348692  557.4301 40.68673 414.5548 59.79782 142.8752       72.32696 
1 1 1 0   6  31 o 199.9432 71.15148 8.343939       6.953076      6.977858       10.92753      9.273272       9.012999  207.7390 85.05965 213.0053 80.15486 -5.266373      116.8758 
1 1 1 0   6  32 o 493.1539 36.92643 49.71125       7.020755      39.84311       10.06299      59.07021       9.799931  421.5459 63.43418 528.7554 48.25605 -107.2095      79.70284 
1 1 1 0   6  33 o 161.3087 68.48055 3.087457       7.466075      -26.91789      14.76039      13.40386       8.654913  137.5978 68.60710 230.4668 79.58160 -92.86900      105.0722 
1 1 1 0   7  1  o 307.7330 19.32948 18.49642       2.298320      18.49642       2.298320      0.000000       0.000000  307.7330 19.32948 ?        ?        0.000000       19.32948 
1 1 1 0   7  2  o 220.3024 17.78185 9.500096       1.508369      10.60314       2.095197      8.313334       2.173255  232.1722 23.56386 204.6233 28.08920 27.54895       36.66413 
1 1 1 0   7  3  o 727.2119 11.31749 102.7508       3.196237      105.7407       3.709982      94.14217       6.295307  737.6464 12.95077 695.3935 23.31086 42.25293       26.66681 
1 1 1 0   7  4  o 671.3450 11.17587 87.56629       2.913770      85.67551       4.051042      89.59293       4.194066  663.8728 15.71281 678.8710 15.90816 -14.99823      22.35983 
1 1 1 0   7  5  o 1598.482 14.38901 496.6055       8.932368      498.0616       12.65818      495.1613       12.60653  1600.088 20.37039 1595.426 20.34656 4.662109       28.79124 
1 1 1 0   7  6  o 1293.050 13.12241 324.9057       6.589569      309.2728       8.867007      344.1896       9.848137  1261.129 18.10463 1330.312 19.06219 -69.18323      26.28963 
1 1 1 0   7  7  o 1492.057 14.11258 432.6727       8.177485      431.0682       11.49208      434.3185       11.63873  1488.629 19.87852 1494.207 20.05704 -5.577637      28.23899 
1 1 1 0   7  8  o 871.1879 12.44699 147.4854       4.211184      148.6513       5.989553      146.3457       5.922048  874.2924 17.64046 867.4904 17.57840 6.802002       24.90353 
1 1 1 0   7  9  o 772.1339 12.78921 115.8686       3.834992      121.1984       5.551516      111.0035       5.303946  789.3438 18.10996 755.4180 18.07939 33.92578       25.58974 
1 1 1 0   7  10 o 420.0815 18.52046 34.33799       3.021436      36.31543       3.775110      30.81380       5.039729  431.1987 22.62261 395.6783 33.10130 35.52042       40.09338 
1 1 1 0   7  11 o 453.5952 18.61375 40.04995       3.278917      40.73434       4.072127      38.78804       5.529467  456.5817 23.03981 444.1537 32.27756 12.42798       39.65695 
1 1 1 0   7  12 o 614.4326 14.87989 73.44672       3.550601      72.26492       4.899042      74.75434       5.153213  608.9266 20.71659 619.2466 21.42824 -10.32001      29.80514 
1 1 1 0   7  13 f 656.5688 15.11845 83.90287       3.854920      87.69090       5.454422      80.12244       5.448943  670.5049 20.94685 640.7838 21.89640 29.72113       30.30220 
1 1 1 0   7  14 f 473.1124 20.96052 43.68613       3.851184      45.06638       6.359654      42.88689       4.839411  477.2539 34.54641 467.2664 26.78025 9.987549       43.71083 
1 1 1 0   7  15 o 114.1391 46.47100 1.085549       3.238552      9.123614       5.296290      -3.714742      4.092887  209.6757 61.22343 95.86429 44.72430 113.8114       75.81934 
1 1 1 0   7  16 o 519.7702 18.77422 52.67476       3.789669      55.31886       5.232238      49.75703       5.496310  531.7626 25.33621 503.0996 28.24552 28.66299       37.94381 
1 1 1 0   7  17 o 1114.102 17.74510 241.8094       7.677707      243.6803       13.50796      240.9166       9.331609  1114.590 31.20662 1111.161 21.62477 3.428711       37.96687 
1 1 1 0   7  18 o 954.1085 18.45760 177.3040       6.839133      175.1398       11.84053      178.3875       8.378032  945.3159 32.25270 956.3004 22.55899 -10.98444      39.35918 
1 1 1 0   7  19 o 971.2523 16.14965 183.5442       6.091483      193.3958       8.754242      174.2969       8.481544  996.0073 22.63227 945.4706 23.09930 50.53662       32.33879 
1 1 1 0   7  20 o 422.7708 29.93773 35.09085       4.883533      44.14400       8.405124      30.47717       6.000235  471.1283 46.54721 392.0724 39.96587 79.05597       61.35074 
1 1 1 0   7  21 o 467.6646 29.21067 42.85937       5.278666      47.04855       6.378074      33.75100       9.404716  489.3501 33.76819 407.9489 61.25459 81.40118       69.94580 
1 1 1 0   7  22 o 937.7809 20.65626 171.2303       7.522828      173.8765       9.094997      165.4981       13.38588  944.4346 24.79720 919.0921 37.50248 25.34247       44.95928 
1 1 1 0   7  23 f 502.9575 26.45942 49.50318       5.150033      38.04551       6.992272      63.08847       7.613856  438.0139 41.60522 566.4927 34.77665 -128.4789      54.22554 
1 1 1 0   7  24 o 399.1823 33.33396 31.44101       5.120288      29.61250       6.821838      33.80017       7.748769  384.3589 46.65876 410.1930 49.65384 -25.83411      68.13621 
1 1 1 0   7  25 o 562.2383 29.99964 62.06889       6.526679      66.52908       7.899498      52.47546       11.58536  580.9622 35.17837 508.2853 59.83738 72.67691       69.41203 
1 1 1 0   7  26 o 653.9276 25.84166 83.60016       6.562633      85.61356       8.706440      80.95112       9.986642  659.2485 34.12350 639.1450 40.44241 20.10345       52.91504 
1 1 1 0   7  27 o 347.7091 52.34421 24.72246       6.849136      28.04971       7.898243      14.63408       13.75304  369.2220 56.91135 273.7437 99.72357 95.47824       114.8203 
1 1 1 0   7  28 o 361.1193 43.19418 26.36434       5.937431      17.60402       7.613604      39.96080       9.485128  285.6913 69.32620 440.0387 56.83210 -154.3474      89.64380 
1 1 1 0   7  29 f 697.9927 25.21313 95.73318       6.834482      109.6129       9.263209      79.15072       10.12502  744.1752 32.05223 626.9619 41.82407 117.2133       52.69344 
1 1 1 0   7  30 f 437.9270 57.08685 40.58170       9.477927      0.000000       0.000000      40.58170       9.477927  ?        ?        437.9270 57.08685 0.000000       57.08685 
1 1 1 0   7  31 o 247.3409 69.85007 14.03069       7.004410      10.70218       11.21551      16.15908       8.968495  226.7244 88.36121 260.6721 80.49776 -33.94768      119.5307 
1 1 1 0   7  32 o 165.7897 66.37498 4.482559       6.484755      4.513303       9.190196      4.452073       9.151582  181.4321 76.44106 180.9241 76.25651 0.5079651      107.9736 
1 1 1 0   7  33 o 386.3347 45.78382 31.97152       6.735509      42.08298       9.806869      22.94280       9.266942  429.9995 60.39148 299.5385 78.65579 130.4610       99.16585 
1 1 1 0   8  0  f 513.6731 16.94359 51.26880       3.380027      47.71955       4.695676      55.08523       4.869207  495.4014 24.40692 532.2879 23.55503 -36.88654      33.91956 
1 1 1 0   8  1  o 308.9420 14.71889 18.55135       1.765957      17.43278       2.484829      19.69292       2.510247  298.5432 21.57724 317.5052 20.46715 -18.96198      29.74023 
1 1 1 0   8  2  o 1124.308 12.46810 245.6231       5.443941      236.9418       7.447773      255.5826       7.977262  1103.901 17.37274 1146.453 17.91718 -42.55212      24.95671 
1 1 1 0   8  3  f 1200.800 14.83665 280.2586       6.918858      283.2910       8.522904      274.3979       11.84855  1206.987 18.18265 1187.032 25.70246 19.95459       31.48373 
1 1 1 0   8  4  o 617.6969 13.69340 74.14893       3.284843      71.82658       3.880111      80.02422       6.171574  607.8370 16.43724 641.1047 24.78786 -33.26770      29.74258 
1 1 1 0   8  5  o 1422.626 13.72364 393.3148       7.582073      391.9571       10.63887      394.7162       10.80849  1419.592 19.29763 1424.550 19.53706 -4.958374      27.46079 
1 1 1 0   8  6  o 889.7604 11.99391 153.8261       4.144403      152.8312       5.811325      154.8559       5.912114  886.5922 16.87809 892.4332 17.05843 -5.841003      23.99708 
1 1 1 0   8  7  o 597.2650 12.71666 69.32307       2.949633      69.68465       4.223334      68.97873       4.121357  598.5726 18.16814 595.5515 17.81939 3.021118       25.44823 
1 1 1 0   8  8  o 721.6315 12.68695 101.2056       3.555500      110.3114       5.221018      93.33069       4.855344  753.0771 17.85203 692.6808 18.04924 60.39630       25.38641 
1 1 1 0   8  9  o 563.6148 15.84621 61.77565       3.468454      58.05474       4.301142      68.69460       5.865153  546.1150 20.28017 593.6355 25.44084 -47.52051      32.53493 
1 1 1 0   8  10 o 847.8342 15.13270 139.7989       4.982592      136.8094       6.122385      145.6625       8.574406  838.3612 18.80449 864.1749 25.54903 -25.81372      31.72320 
1 1 1 0   8  11 o 851.4254 13.58684 140.9761       4.492553      140.4217       6.266408      141.5623       6.444179  849.1390 19.00255 852.5189 19.46416 -3.379883      27.20203 
1 1 1 0   8  12 o 290.8602 24.74310 16.64269       2.768349      12.53751       3.719511      21.74091       4.145041  249.2379 39.76402 331.3419 32.63618 -82.10394      51.44217 
1 1 1 0   8  13 o 596.9305 15.96026 69.38792       3.699916      68.69154       5.149719      70.13095       5.319345  593.1157 22.35714 599.2220 22.85822 -6.106384      31.97405 
1 1 1 0   8  14 o 229.2959 39.83231 10.68687       3.418284      21.01030       5.759293      5.072390       4.247288  321.4089 47.57803 163.9416 55.77522 157.4674       73.31127 
1 1 1 0   8  15 o 363.5869 23.47613 25.94347       3.297133      25.93407       4.491304      25.95446       4.855687  361.8267 32.30240 361.3418 35.04277 0.4849548      47.65963 
1 1 1 0   8  16 o 852.6925 15.45259 141.5557       5.117074      147.6076       7.302649      135.7178       7.172382  869.6334 21.62301 833.7678 22.15085 35.86566       30.95504 
1 1 1 0   8  17 o 597.8304 18.23246 69.62348       4.233030      70.10545       5.851615      69.09439       6.130966  599.0248 25.15376 594.4813 26.55601 4.543579       36.57777 
1 1 1 0   8  18 o 259.2525 46.04198 13.65690       4.465781      12.96774       7.851923      13.98642       5.429451  250.5887 74.90572 260.3964 55.39280 -9.807693      93.16238 
1 1 1 0   8  19 o 708.4885 21.30092 97.79160       5.860829      92.15456       9.948279      100.7881       7.253158  684.3820 37.57394 718.6812 25.98740 -34.29919      45.68529 
1 1 1 0   8  20 o 757.0786 18.32718 111.5395       5.388460      111.9660       7.539474      111.0941       7.704056  757.7363 25.62093 754.6956 26.28571 3.040710       36.70655 
1 1 1 0   8  21 o 1376.542 16.66508 368.5747       8.908913      366.8555       12.35180      370.4388       12.86188  1372.224 23.17808 1378.739 24.02119 -6.515503      33.38025 
1 1 1 0   8  22 o 1794.866 20.84101 627.3362       14.52709      628.5687       17.65737      624.7545       25.55581  1795.410 25.32412 1785.770 36.84990 9.640137       44.71270 
1 1 1 0   8  23 o 279.8427 46.20749 15.84185       4.846462      23.64329       6.508209      6.130382       7.261335  342.1747 50.49356 194.6226 72.19785 147.5521       88.10295 
1 1 1 0   8  24 o 271.6740 56.58918 15.24514       5.776624      12.38604       6.946409      21.65548       10.40126  244.1605 69.77326 318.6159 83.16969 -74.45537      108.5611 
1 1 1 0   8  25 o 600.0671 26.19505 70.37711       6.104457      80.54192       8.406258      59.03649       8.879152  639.6563 33.96150 545.2122 42.26543 94.44403       54.21946 
1 1 1 0   8  26 o 318.7561 52.85773 20.80303       6.314023      20.99833       7.207207      20.15833       13.09468  317.9459 60.58142 306.4078 97.64991 11.53809       114.9157 
1 1 1 0   8  27 o 430.3079 42.12022 37.08935       6.948534      31.16034       7.932208      56.64594       14.40620  390.2523 53.76588 518.5146 73.60841 -128.2623      91.15354 
1 1 1 0   8  28 o 339.9596 46.63702 23.60454       5.994975      22.03682       7.911335      25.71879       9.187400  321.0004 65.67578 345.0692 70.92847 -24.06882      96.66517 
1 1 1 0   8  29 o 244.3778 62.04782 12.94398       5.899341      6.892952       7.780839      21.12561       9.047571  196.7318 74.37436 306.8834 76.25242 -110.1516      106.5175 
1 1 1 0   8  30 o 277.6408 66.49186 17.17020       7.074690      26.72333       10.85115      10.10708       9.330416  337.2523 83.33292 221.3649 81.89529 115.8873       116.8384 
1 1 1 0   8  31 o 127.8819 58.11440 -2.363752      6.296868      2.812567       8.822672      -7.738177      8.989915  173.8401 74.13741 135.3072 64.09939 38.53288       98.00555 
1 1 1 0   8  32 o 175.3646 67.39348 5.980719       6.454700      13.33215       9.201101      -1.142639      9.057246  232.4269 81.94128 155.0443 70.15551 77.38269       107.8711 
1 1 1 0   8  33 o 200.1820 67.80732 9.501271       6.277168      7.189857       9.298815      11.43638       8.508280  190.5385 78.29264 214.7767 78.40705 -24.23817      110.8034 
1 1 1 0   9  1  o 494.5627 12.84063 47.52838       2.466242      48.24952       3.468766      46.79120       3.507135  498.1304 17.93098 490.5262 18.41036 7.604279       25.69944 
1 1 1 0   9  2  o 224.1689 20.84148 9.860305       1.793618      11.78116       2.495038      7.806041       2.580224  244.4938 26.71194 197.0755 34.99482 47.41829       44.02459 
1 1 1 0   9  3  o 1163.757 12.88159 263.1737       5.821836      254.7439       7.962558      272.8564       8.533725  1144.574 17.91351 1184.505 18.55128 -39.93042      25.78844 
1 1 1 0   9  4  o 1241.797 13.18427 299.6696       6.358207      294.5669       7.180224      318.2057       13.68510  1231.035 15.01896 1277.924 27.57495 -46.88977      31.39979 
1 1 1 0   9  5  o 898.0497 12.04872 156.7110       4.202129      161.2379       6.015306      152.3962       5.872677  910.6156 17.00962 885.2910 17.08135 25.32465       24.10601 
1 1 1 0   9  6  o 533.1080 12.88854 55.23253       2.668375      55.51158       3.743075      54.94418       3.804992  534.2368 18.04126 531.4800 18.43481 2.756714       25.79398 
1 1 1 0   9  7  o 288.7188 18.43528 16.28224       2.056270      17.23564       2.932876      15.36050       2.883756  296.2838 25.74522 279.4244 26.90719 16.85941       37.23994 
1 1 1 0   9  8  o 674.5079 18.37858 88.52515       4.814230      88.52515       4.814230      0.000000       0.000000  674.5079 18.37858 ?        ?        0.000000       18.37858 
1 1 1 0   9  9  o 1220.117 15.47211 289.5453       7.331265      285.4592       8.986424      297.6765       12.67700  1210.953 19.10872 1235.182 26.42760 -24.22852      32.61228 
1 1 1 0   9  10 o 118.7226 41.58973 2.463444       2.367875      1.680456       3.350116      3.245091       3.347248  121.7826 48.04387 138.0848 49.34291 -16.30215      68.86898 
1 1 1 0   9  11 o 593.3960 15.05085 68.52020       3.468435      70.15685       4.966740      66.96233       4.845716  599.7944 21.32264 585.9833 21.29338 13.81116       30.13409 
1 1 1 0   9  12 o 807.2821 14.18968 126.8241       4.448626      123.4342       6.167183      130.5014       6.423240  795.5667 19.96100 817.9784 20.22015 -22.41174      28.41295 
1 1 1 0   9  13 o 787.1185 16.82158 120.7072       5.142034      117.0473       8.397334      122.9027       6.504016  772.8146 27.97938 793.4830 21.10649 -20.66846      35.04753 
1 1 1 0   9  14 o 637.7269 16.44807 79.22777       4.073593      79.65540       5.635821      78.75993       5.894759  638.5052 22.72818 634.6964 23.91509 3.808899       32.99245 
1 1 1 0   9  15 o 481.9528 19.64823 45.30128       3.677528      44.25764       5.071197      46.45887       5.340898  474.5712 27.63535 486.1059 28.41516 -11.53467      39.63753 
1 1 1 0   9  16 f 1018.557 15.19420 201.9242       6.010228      199.0212       8.265838      205.1807       8.754706  1010.115 21.07113 1025.423 21.98419 -15.30780      30.45156 
1 1 1 0   9  17 f 581.9948 22.51009 66.06568       5.087733      66.26560       8.441761      65.95164       6.375779  579.3644 37.72489 580.7459 28.26957 -1.381470      47.14165 
1 1 1 0   9  18 o 602.3867 22.90599 70.74553       5.358614      80.49873       9.488761      66.17847       6.493134  639.1341 38.40695 581.9481 28.73043 57.18597       47.96385 
1 1 1 0   9  19 o 1257.318 16.19336 307.5141       7.906969      300.4928       10.86717      315.4129       11.52619  1241.843 22.53316 1272.141 23.33042 -30.29846      32.43534 
1 1 1 0   9  20 f 596.2388 21.08955 69.22188       4.883323      68.85162       6.632509      69.66022       7.216517  593.9357 28.75481 596.3309 31.27005 -2.395203      42.48123 
1 1 1 0   9  21 o 1284.192 17.01002 320.8076       8.483259      315.9818       11.67587      326.2038       12.34647  1273.429 23.60949 1293.675 24.57479 -20.24585      34.07826 
1 1 1 0   9  22 o 961.0883 20.73462 179.8950       7.739045      188.0531       9.489070      163.6886       13.37427  981.9963 24.88203 913.6475 37.69324 68.34875       45.16521 
1 1 1 0   9  23 o 457.5898 33.18696 41.23034       5.857454      39.24744       6.981317      45.94535       10.76535  444.7809 40.87427 476.2859 59.49924 -31.50504      72.18633 
1 1 1 0   9  24 o 445.7975 31.84206 39.13696       5.476455      39.69032       7.327112      38.43655       8.243354  446.4766 42.78154 437.5130 49.37995 8.963654       65.33482 
1 1 1 0   9  25 o 503.1645 29.76767 49.75739       5.790906      54.55043       7.924034      44.26332       8.483744  524.6945 39.17006 470.1543 47.09765 54.54022       61.25751 
1 1 1 0   9  26 o 281.2575 61.38087 16.57504       6.516157      18.76307       7.556072      10.22649       12.87085  298.0645 66.91651 247.8959 95.19031 50.16858       116.3573 
1 1 1 0   9  27 o 510.3996 31.29109 51.45021       6.172455      52.34777       8.166949      50.25453       9.426183  511.6432 41.45863 498.2556 49.36379 13.38760       64.46396 
1 1 1 0   9  28 o 171.3259 63.46394 5.069540       5.606758      9.532853       7.330407      -1.222522      8.703540  215.9096 73.27480 160.6362 70.98313 55.27347       102.0186 
1 1 1 0   9  29 o 148.0722 64.52713 -0.1081515     6.968269      3.279842       10.87377      -2.469013      9.077041  194.6509 82.64016 157.1283 70.74381 37.52264       108.7846 
1 1 1 0   9  30 f 264.4779 68.19190 15.79063       7.049043      20.19925       11.38571      13.05050       8.976223  287.6476 90.98991 239.5867 81.08553 48.06090       121.8771 
1 1 1 0   9  31 o 318.7298 72.90636 23.85255       8.828499      23.85255       8.828499      0.000000       0.000000  318.7298 72.90636 ?        ?        0.000000       72.90636 
1 1 1 0   9  32 o 318.0443 54.31165 22.39424       6.467394      30.77562       9.345337      14.69080       8.959418  361.1720 69.14579 240.7238 81.01184 120.4482       106.5085 
1 1 1 0   9  33 o 122.8132 56.22098 -2.103793      6.033121      -8.490350      9.055720      2.993202       8.089968  129.2416 62.07207 162.9536 70.26939 -33.71201      93.75889 
1 1 1 0   10 0  f 904.3655 17.45978 158.9261       6.132123      157.4831       8.530199      160.4694       8.821395  899.9450 24.40704 908.4063 25.00513 -8.461243      34.94225 
1 1 1 0   10 1  o 1327.370 13.54376 342.4178       6.981670      345.3926       9.919578      339.4975       9.828201  1332.548 19.16824 1321.129 19.15582 11.41943       27.09921 
1 1 1 0   10 2  o 756.1554 12.41784 111.1065       3.646575      108.9982       5.067944      113.3699       5.250998  748.6799 17.43041 763.5283 17.70878 -14.84839      24.84794 
1 1 1 0   10 3  o 569.5877 13.40143 63.05264       2.964420      63.65576       4.129132      62.41114       4.258506  572.0720 18.58575 566.4108 19.35966 5.661194       26.83704 
1 1 1 0   10 4  o 590.3379 14.89483 67.74740       3.414793      74.80997       4.186975      53.71742       5.901298  620.2187 17.38311 524.0306 29.11235 96.18805       33.90725 
1 1 1 0   10 5  o 714.6053 12.70944 99.24518       3.527123      102.5236       4.062537      89.20852       7.108243  726.2221 14.40455 676.4672 27.05749 49.75488       30.65288 
1 1 1 0   10 6  o 1056.034 12.77896 216.7530       5.240845      217.0104       7.391368      216.4928       7.432148  1056.167 18.02040 1054.893 18.14170 1.273682       25.57061 
1 1 1 0   10 7  o 317.4501 18.05296 19.67184       2.216429      19.47423       3.104242      19.87735       3.165669  315.0035 25.59674 318.2367 25.83767 -3.233185      36.37002 
1 1 1 0   10 8  o 497.3220 16.25769 48.11621       3.139963      46.80517       3.985430      50.26186       5.098553  490.1964 20.93520 506.8924 25.98758 -16.69598      33.37120 
1 1 1 0   10 9  o 446.8038 16.41818 38.84977       2.848853      39.76011       4.040179      37.94954       4.017687  450.9333 23.14870 440.4619 23.57315 10.47141       33.03870 
1 1 1 0   10 10 f 1232.117 14.00175 295.3307       6.699807      290.5024       9.327155      300.4777       9.630017  1220.900 19.67166 1241.615 19.97156 -20.71497      28.03279 
1 1 1 0   10 11 o 624.5729 21.26007 76.11668       5.156749      0.000000       0.000000      76.11668       5.156749  ?        ?        624.5729 21.26007 0.000000       21.26007 
1 1 1 0   10 12 o 175.1954 45.34947 6.329438       3.109480      -1.651647      5.344772      10.41289       3.823069  124.2583 55.23065 225.0778 45.30536 -100.8195      71.43529 
1 1 1 0   10 13 o 837.3192 16.73570 136.5955       5.442055      138.9896       9.214590      135.3132       6.743805  842.0427 28.17824 832.6093 20.85623 9.433472       35.05703 
1 1 1 0   10 14 o 540.1979 17.90921 56.87324       3.757141      60.28393       5.302840      53.43525       5.324023  555.2543 24.59170 521.8463 26.35585 33.40808       36.04695 
1 1 1 0   10 15 o 402.9260 23.00549 31.80188       3.584923      33.51048       5.089970      30.12005       5.049960  411.9916 32.06516 390.1286 33.66085 21.86295       46.48900 
1 1 1 0   10 16 o 315.3312 34.92194 19.75481       4.204743      15.02257       6.900313      22.54976       5.303012  267.6248 66.64542 335.6858 41.56699 -68.06100      78.54569 
1 1 1 0   10 17 o 488.6072 22.04756 46.53778       4.183583      50.57268       5.684289      41.76897       6.179665  507.8286 28.94230 460.2888 34.82838 47.53983       45.28436 
1 1 1 0   10 18 o 468.5449 26.85656 42.98684       4.866472      38.01276       8.043560      45.85884       6.112012  436.3009 48.28088 483.0336 32.77605 -46.73276      58.35506 
1 1 1 0   10 19 o 841.6291 20.61983 137.9185       6.739594      129.0563       11.07298      143.1335       8.494177  812.0447 35.11207 856.7726 25.52864 -44.72797      43.41162 
1 1 1 0   10 20 o 682.3837 20.39246 90.64944       5.404135      102.5598       7.511893      77.87248       7.780377  725.1720 26.67352 630.5157 31.87784 94.65631       41.56529 
1 1 1 0   10 21 o 961.0155 20.20460 179.8074       7.540649      184.2688       9.159493      170.4241       13.28365  972.2981 24.25739 932.7816 36.66988 39.51654       43.96705 
1 1 1 0   10 22 o 658.5378 24.76126 84.59553       6.332590      82.29692       7.592975      89.84735       11.47718  648.8170 30.13435 673.9628 44.09324 -25.14581      53.40686 
1 1 1 0   10 23 o 1057.603 21.07902 218.0157       8.657672      228.6309       10.73786      198.2949       14.63581  1082.085 25.55221 1004.530 37.51682 77.55505       45.39193 
1 1 1 0   10 24 o 382.2261 37.36501 29.00118       5.475492      30.50881       7.443286      27.22315       8.083277  388.7636 50.49269 364.3071 59.16340 24.45654       77.78059 
1 1 1 0   10 25 o 384.9171 44.31833 29.71023       6.503928      31.86874       7.466406      22.91967       13.24306  397.3422 49.45616 324.4347 97.34739 72.90750       109.1899 
1 1 1 0   10 26 o 543.6873 29.20477 58.14898       6.143804      55.63961       8.140545      61.46989       9.364826  528.8243 39.93266 554.6540 43.83318 -25.82965      59.29557 
1 1 1 0   10 27 o 161.4938 63.24355 3.569713       5.766829      12.34679       7.955965      -6.146763      8.370901  241.2308 76.03429 139.2188 64.61783 102.0120       99.78316 
1 1 1 0   10 28 o 151.9185 62.32734 2.222059       5.881776      -10.83475      7.756778      19.88586       9.022041  117.5624 56.71165 298.2961 77.26279 -180.7337      95.84232 
1 1 1 0   10 29 o 284.4596 63.78785 17.74478       6.872834      31.36088       10.82676      8.554419       8.894845  371.9495 77.46859 211.0178 79.58171 160.9317       111.0614 
1 1 1 0   10 30 o 199.5219 66.25493 8.622345       5.994884      5.335715       8.033917      12.75156       9.005041  183.7507 73.76817 235.8780 81.19099 -52.12732      109.6983 
1 1 1 0   10 31 f 387.2440 43.46563 31.38419       6.423838      39.81765       9.256511      23.54912       8.922073  425.9849 57.41581 313.7351 74.36244 112.2498       93.94865 
1 1 1 0   10 32 o 285.6916 57.83870 18.55158       6.197036      22.20122       9.331092      15.67158       8.289028  294.3646 79.67707 248.4504 77.49833 45.91415       111.1505 
1 1 1 0   11 1  o 617.8317 13.21990 74.19026       3.171950      70.45378       4.334215      78.49942       4.654524  601.7988 18.54518 635.2115 18.86813 -33.41272      26.45620 
1 1 1 0   11 2  o 1282.401 13.63757 319.6600       6.791860      324.4445       9.701983      315.0619       9.511140  1291.296 19.34670 1272.501 19.24627 18.79504       27.28944 
1 1 1 0   11 3  o 507.1969 14.68235 50.01285       2.892012      50.68052       4.014663      49.29266       4.169579  510.2898 20.25836 503.1905 21.33692 7.099304       29.42219 
1 1 1 0   11 4  o 419.8661 18.76041 34.30278       3.059012      33.10357       3.746520      36.70114       5.298335  411.5486 23.53886 432.3055 31.78164 -20.75687      39.54934 
1 1 1 0   11 5  o 279.0976 21.00041 15.25303       2.259524      15.63540       2.557223      13.89160       4.825253  282.2968 23.54038 261.3384 49.35218 20.95834       54.67895 
1 1 1 0   11 6  o 197.5602 38.05762 7.907016       2.813995      7.907016       2.813995      0.000000       0.000000  197.5602 38.05762 ?        ?        0.000000       38.05762 
1 1 1 0   11 7  o 186.3124 31.93649 6.980351       2.227613      8.617828       2.885660      4.565450       3.504348  206.4837 37.36119 154.6515 50.62262 51.83217       62.91668 
1 1 1 0   11 8  o 427.0070 17.94548 35.50422       2.975898      35.92366       3.809044      34.84710       4.767609  428.5344 22.97135 421.0580 29.33953 7.476318       37.26246 
1 1 1 0   11 9  o 110.5052 40.41828 1.955038       2.262474      5.970396       3.386634      -1.281519      3.040520  171.1492 48.65246 92.23624 41.28053 78.91300       63.80552 
1 1 1 0   11 10 o 270.7411 25.15318 14.45216       2.614461      14.03518       3.799531      14.82715       3.603098  264.1761 38.13923 272.4054 34.85856 -8.229340      51.66933 
1 1 1 0   11 11 o 818.1989 16.05810 130.3835       5.102477      140.8322       9.017174      125.4620       6.188572  847.9241 27.38328 801.9684 19.87034 45.95569       33.83303 
1 1 1 0   11 12 o 669.1088 17.57124 87.25449       4.565907      87.83692       7.945374      86.96731       5.579128  668.8516 30.58839 667.3940 21.52564 1.457520       37.40324 
1 1 1 0   11 13 o 542.7266 17.75007 57.40363       3.741184      59.62526       5.323336      55.23544       5.258919  552.1720 24.82456 531.3557 25.48491 20.81628       35.57723 
1 1 1 0   11 14 o 535.8950 21.05394 56.02897       4.381683      49.45247       7.443484      59.51630       5.420323  499.2443 38.69376 551.7432 25.29648 -52.49893      46.22898 
1 1 1 0   11 15 o 498.1932 19.83993 48.37380       3.838539      42.57546       5.301726      54.76199       5.564857  465.4293 29.48390 528.5204 27.20444 -63.09119      40.11711 
1 1 1 0   11 16 o 213.6022 44.10966 9.321796       3.537860      8.909825       4.892798      9.773202       5.121621  208.2566 58.22779 217.6088 59.08353 -9.352249      82.95383 
1 1 1 0   11 17 o 1023.724 15.97862 203.8796       6.352580      204.5361       8.836368      203.1773       9.139086  1024.482 22.20963 1020.932 23.05037 3.550171       32.00918 
1 1 1 0   11 18 o 346.7801 37.00920 23.82154       4.907169      21.28749       7.840206      25.45361       6.292009  321.2279 65.07730 356.6397 46.53818 -35.41187      80.00536 
1 1 1 0   11 19 o 320.1015 49.35509 20.64182       5.938241      22.28081       7.925459      18.54401       8.966437  329.2815 64.28363 298.1267 76.92935 31.15472       100.2522 
1 1 1 0   11 20 o 996.5398 19.78563 193.3071       7.657244      191.6713       9.150530      197.1284       13.98596  991.7803 23.75761 1003.543 35.88625 -11.76306      43.03774 
1 1 1 0   11 21 o 552.6799 23.96879 59.54955       5.144554      64.70768       6.914749      53.15448       7.699320  574.5130 31.10783 519.1566 38.46152 55.35638       49.46702 
1 1 1 0   11 22 o 1009.929 24.64878 199.0198       9.667503      199.0198       9.667503      0.000000       0.000000  1009.929 24.64878 ?        ?        0.000000       24.64878 
1 1 1 0   11 23 o 935.8383 21.70663 170.7766       7.888986      169.6612       9.522057      173.2179       14.08760  931.8589 26.31192 938.2308 38.66334 -6.371887      46.76720 
1 1 1 0   11 24 o 539.8539 33.60237 57.42236       7.009956      62.62770       8.201161      43.30570       13.50569  562.8403 37.73844 453.0378 79.67203 109.8025       88.15794 
1 1 1 0   11 25 o 431.8874 41.26169 37.20789       6.836420      26.46510       7.860641      70.56213       13.85080  358.4281 58.48883 587.9675 61.57191 -229.5394      84.92374 
1 1 1 0   11 26 o 485.0910 32.63683 46.53518       6.112597      57.55964       8.175695      32.56158       9.204503  537.6016 39.43453 395.5830 61.94813 142.0186       73.43468 
1 1 1 0   11 27 o 480.5694 32.47850 45.82251       6.025919      37.50107       7.983790      56.83871       9.185987  428.6662 48.82947 530.5096 45.01135 -101.8434      66.41038 
1 1 1 0   11 28 o 170.3883 68.10240 3.908602       6.814202      3.491094       10.32389      4.230904       9.070744  192.7981 81.11307 188.2732 77.34007 4.524887       112.0750 
1 1 1 0   11 29 o 110.8105 52.34150 -5.786174      5.913271      -18.48231      7.987816      9.607973       8.795693  102.1525 50.85892 216.2997 79.60519 -114.1471      94.46490 
1 1 1 0   11 30 o 167.8098 65.19470 4.827082       6.090668      1.427933       8.244354      8.911396       9.037142  163.0456 70.62129 208.5782 79.84141 -45.53261      106.5928 
1 1 1 0   11 31 o 116.5435 54.49723 -4.306835      6.133356      7.791699       8.713634      -16.18704      8.634654  196.2058 77.45811 110.4216 54.61050 85.78423       94.77375 
1 1 1 0   11 32 o 149.8068 62.06987 3.044005       5.909885      3.289438       8.875294      2.848490       7.921478  169.6951 73.38771 162.0308 69.70344 7.664307       101.2143 
1 1 1 0   12 0  o 944.6584 18.38646 173.4663       6.745294      162.9537       9.101217      186.2784       10.04738  915.1240 25.60893 978.3607 26.44393 -63.23663      36.81167 
1 1 1 0   12 1  o 901.2048 12.98850 157.8756       4.545802      157.8699       6.335307      157.8816       6.526422  900.7289 18.11113 900.7042 18.65800 0.2478027E-01  26.00257 
1 1 1 0   12 2  o 870.7141 13.03662 147.3778       4.408274      146.5576       6.113979      148.2658       6.361891  867.8365 18.14087 872.8132 18.76882 -4.976685      26.10287 
1 1 1 0   12 3  o 814.2906 13.32305 128.9085       4.213189      137.5029       5.976549      120.4180       5.940315  840.5463 18.30884 786.4806 19.44883 54.06573       26.71087 
1 1 1 0   12 4  o 632.4702 14.19522 77.78730       3.486666      77.68712       4.834572      77.89589       5.033205  631.6378 19.70888 632.4142 20.49344 -0.7764282     28.43275 
1 1 1 0   12 5  o 715.2736 13.39113 99.48260       3.719782      102.5781       4.288168      90.07245       7.476645  726.1703 15.20566 678.9606 28.35530 47.20978       32.17507 
1 1 1 0   12 6  o 289.1167 24.64732 16.43157       2.740967      16.43157       2.740967      0.000000       0.000000  289.1167 24.64732 ?        ?        0.000000       24.64732 
1 1 1 0   12 7  o 352.1239 19.79028 24.24018       2.695323      23.52150       3.405954      25.44436       4.408768  346.0643 25.52289 358.8954 31.96626 -12.83115      40.90550 
1 1 1 0   12 8  o 294.9731 21.36138 17.06223       2.430464      13.98429       3.509248      19.89973       3.369406  264.4800 35.02775 317.7166 27.58138 -53.23666      44.58336 
1 1 1 0   12 9  o 536.7245 15.40295 56.08552       3.210579      56.87706       4.610534      55.34034       4.473455  539.7578 21.99502 532.4628 21.63345 7.294922       30.85105 
1 1 1 0   12 10 o 554.8396 17.71803 59.99706       3.817780      56.24744       6.586364      61.89439       4.685162  534.1114 31.89880 563.0668 21.42578 -28.95544      38.42653 
1 1 1 0   12 11 o 569.8688 18.15203 63.30500       4.017243      69.23006       7.089839      60.50315       4.875418  592.9832 30.89379 556.5269 22.55785 36.45630       38.25288 
1 1 1 0   12 12 o 306.4442 30.27938 18.59949       3.556382      19.66507       6.696378      18.18085       4.197236  307.7806 58.15469 301.5844 36.58548 6.196167       68.70564 
1 1 1 0   12 13 o 648.6050 19.23233 82.00959       4.844402      85.06750       8.697762      80.63435       5.832891  656.9482 34.20996 642.5428 23.37511 14.40540       41.43329 
1 1 1 0   12 14 o 549.6960 19.03507 58.87622       4.063545      63.28611       5.762738      54.51502       5.730836  569.0533 26.07641 527.1462 28.09497 41.90717       38.33154 
1 1 1 0   12 15 o 653.8533 17.66241 83.23151       4.484957      76.03125       6.158279      91.36378       6.544719  624.0656 25.40979 684.2132 24.63041 -60.14764      35.38805 
1 1 1 0   12 16 o 644.8414 25.99730 81.14840       6.510422      81.14840       6.510422      0.000000       0.000000  644.8414 25.99730 ?        ?        0.000000       25.99730 
1 1 1 0   12 17 o 609.4829 26.71587 72.47540       6.323520      72.47540       6.323520      0.000000       0.000000  609.4829 26.71587 ?        ?        0.000000       26.71587 
1 1 1 0   12 18 o 577.4434 30.18782 65.28474       6.746182      73.21552       9.579011      57.48009       9.502532  609.6299 40.69387 538.7241 45.85605 70.90582       61.30879 
1 1 1 0   12 19 o 348.9738 38.10812 24.13283       5.080668      14.14301       7.868480      31.27605       6.653641  261.8821 74.06003 396.6617 43.93042 -134.7797      86.10905 
1 1 1 0   12 20 o 130.9768 53.64473 1.233168       4.347980      -0.2406658     5.808737      3.111152       6.556976  139.0692 59.75322 168.2196 66.94364 -29.15044      89.73237 
1 1 1 0   12 21 o 657.0361 22.08493 84.13603       5.635252      86.74104       7.637741      81.02362       8.348504  666.1635 29.52270 642.3608 33.58247 23.80267       44.71434 
1 1 1 0   12 22 o 320.7566 41.74844 20.59984       5.077236      25.65656       6.804348      14.24758       7.626343  356.3082 50.59486 260.9908 72.59821 95.31744       88.48920 
1 1 1 0   12 23 f 226.8769 63.62615 10.67312       5.832871      13.27996       7.049846      5.016079       10.38526  251.8888 69.70577 208.4022 83.79846 43.48668       109.0004 
1 1 1 0   12 24 o 647.9401 29.34804 82.23636       7.384856      89.77390       8.578874      60.67045       14.51108  676.2811 32.66442 541.5040 70.68996 134.7772       77.87192 
1 1 1 0   12 25 o 578.3326 28.54010 65.57526       6.410046      74.47788       8.653155      54.74913       9.542273  613.4475 36.48652 522.0233 47.59193 91.42426       59.96881 
1 1 1 0   12 26 o 743.4385 24.26833 108.2521       7.006689      118.0411       9.618712      97.18555       10.22716  773.8704 32.00521 699.1859 37.80518 74.68457       49.53347 
1 1 1 0   12 27 o 510.5741 37.09472 52.13609       7.305033      60.64236       11.70263      46.70559       9.350473  540.9216 56.54419 476.8168 51.30300 64.10477       76.34948 
1 1 1 0   12 28 o 208.4273 72.22430 9.007795       7.131616      13.31123       11.09627      5.979142       9.308809  247.7364 89.67776 198.1294 79.45341 49.60698       119.8121 
1 1 1 0   12 29 f 645.8258 28.18292 82.75322       7.068535      93.48312       9.767219      70.95354       10.24255  680.2275 37.11359 586.7516 45.30035 93.47595       58.56228 
1 1 1 0   12 30 o 174.3727 66.29426 5.768269       6.204047      12.11800       8.707567      -0.7785439     8.841665  227.2538 79.74634 156.6909 70.24188 70.56287       106.2704 
1 1 1 0   12 31 f 172.9949 65.96870 5.966038       6.154862      -4.909947      8.756758      16.58521       8.652755  138.7078 64.94277 255.5771 79.09185 -116.8693      102.3381 
1 1 1 0   13 1  o 733.4257 13.61015 104.6056       3.876564      110.5832       5.503468      98.71906       5.461352  753.5823 18.80519 711.9067 19.75373 41.67566       27.27352 
1 1 1 0   13 2  o 524.0538 22.43764 53.54870       4.566475      0.000000       0.000000      53.54870       4.566475  ?        ?        524.0538 22.43764 0.000000       22.43764 
1 1 1 0   13 3  o 685.3093 14.15021 91.35233       3.765975      96.16330       5.257432      86.28233       5.397099  702.6070 19.26785 665.3460 20.88742 37.26099       28.41715 
1 1 1 0   13 4  o 793.4753 13.81648 122.4660       4.257540      123.1425       5.906398      121.7342       6.142693  795.0347 19.12972 790.3522 20.01291 4.682495       27.68506 
1 1 1 0   13 5  o 536.6421 17.07584 56.07689       3.558728      56.07689       3.558728      0.000000       0.000000  536.6421 17.07584 ?        ?        0.000000       17.07584 
1 1 1 0   13 6  o 377.9940 24.53572 28.03111       3.582256      28.03111       3.582256      0.000000       0.000000  377.9940 24.53572 ?        ?        0.000000       24.53572 
1 1 1 0   13 7  o 315.3352 24.49961 19.55019       2.976711      20.01375       3.446506      18.18900       5.905891  318.4503 28.15843 297.4108 53.08007 21.03952       60.08653 
1 1 1 0   13 8  o 415.9807 24.28601 33.94117       3.906302      33.94117       3.906302      0.000000       0.000000  415.9807 24.28601 ?        ?        0.000000       24.28601 
1 1 1 0   13 9  o 388.0599 18.71086 29.36178       2.819814      29.80384       4.065493      28.95196       3.914434  389.1831 27.06713 383.6719 26.43253 5.511200       37.83263 
1 1 1 0   13 10 o 476.4613 19.90618 44.28510       3.683355      42.09573       6.382430      45.37841       4.510227  460.8096 35.94891 481.1811 24.21322 -20.37152      43.34286 
1 1 1 0   13 11 o 358.2282 25.86012 25.23215       3.573461      27.75640       6.850604      24.28857       4.188434  370.2363 48.83747 350.4472 31.09831 19.78912       57.89821 
1 1 1 0   13 12 o 186.2834 42.57272 7.130922       3.012614      6.723113       4.446044      7.477106       4.096364  182.9701 56.70644 190.6242 53.27148 -7.654068      77.80405 
1 1 1 0   13 13 o 583.1046 17.67168 66.21550       4.001771      61.79911       5.682973      70.55924       5.636037  562.3660 26.02127 601.1677 24.14072 -38.80176      35.49480 
1 1 1 0   13 14 f 840.6698 15.78402 137.5134       5.153130      138.6274       7.336404      136.4286       7.239809  843.1866 22.40431 836.4909 22.28629 6.695740       31.60114 
1 1 1 0   13 15 o 912.9586 16.02192 162.1545       5.680594      163.2422       7.965960      161.0290       8.102938  915.1812 22.41316 908.8727 22.95680 6.308411       32.08371 
1 1 1 0   13 16 o 1631.001 19.29465 517.8379       12.22135      511.8290       14.59426      531.9426       22.35970  1620.610 23.18867 1648.376 34.92864 -27.76660      41.92522 
1 1 1 0   13 17 o 558.6298 22.10032 60.77893       4.794581      56.89020       6.360768      65.89554       7.296203  538.8818 30.51936 579.7574 32.53730 -40.87561      44.61062 
1 1 1 0   13 18 f 719.9681 22.49981 100.9604       6.291007      112.1257       10.75379      95.15130       7.756803  756.8397 36.58726 698.2923 28.60339 58.54736       46.44117 
1 1 1 0   13 19 o 1318.081 19.53930 338.1709       10.00182      316.8373       16.26385      351.1462       12.68383  1272.999 32.89782 1342.233 24.33293 -69.23401      40.91892 
1 1 1 0   13 20 o 1576.559 17.37242 483.6881       10.63650      474.4167       14.51216      494.4499       15.63508  1559.845 23.95646 1592.062 25.28786 -32.21741      34.83372 
1 1 1 0   13 21 o 621.3022 23.12459 75.28461       5.579624      73.82240       7.429080      77.17668       8.450858  613.3470 31.29305 626.3763 34.87895 -13.02924      46.85932 
1 1 1 0   13 22 o 177.1676 60.69249 5.840932       5.029542      4.769176       6.680908      7.242893       7.641093  179.9343 68.70261 204.3902 74.35131 -24.45593      101.2332 
1 1 1 0   13 23 o 545.1510 38.30730 58.80385       8.058600      58.80385       8.058600      0.000000       0.000000  545.1510 38.30730 ?        ?        0.000000       38.30730 
1 1 1 0   13 24 o 241.6917 60.67107 12.24601       5.686106      23.21426       7.660166      -1.214042      8.485805  334.2681 61.26639 161.2719 70.71747 172.9962       93.56565 
1 1 1 0   13 25 o 873.0609 21.77455 148.9436       7.382809      171.7254       10.33604      125.2135       10.54896  935.3810 28.45362 796.8759 34.08717 138.5052       44.40206 
1 1 1 0   13 26 o 466.3787 34.40359 43.27855       6.187190      41.46199       8.322774      45.52271       9.250603  451.2473 48.23996 471.6373 51.33395 -20.39008      70.44337 
1 1 1 0   13 27 o 233.5050 69.77217 11.89539       6.813534      1.156711       10.57707      19.51239       8.908043  184.3000 79.90906 294.4320 77.02264 -110.1320      110.9862 
1 1 1 0   13 28 o 312.1704 53.68849 20.70696       6.274122      13.94724       8.245241      30.00463       9.669992  247.7336 77.29641 367.0602 70.39729 -119.3267      104.5491 
1 1 1 0   13 29 o 342.2430 47.49931 24.65326       6.142995      21.55013       8.244929      28.52534       9.209975  305.8531 70.81092 354.2296 69.43155 -48.37650      99.17120 
1 1 1 0   13 30 o 289.7324 57.25246 18.73088       6.213554      17.99993       8.731785      19.48072       8.843873  269.3634 78.59931 280.5944 78.22414 -11.23102      110.8912 
1 1 1 0   13 31 o 158.4975 63.51145 4.246657       5.943029      4.560113       8.563118      3.955367       8.254785  174.8267 73.72944 170.1050 72.09907 4.721634       103.1228 
1 1 1 0   14 0  o 611.6561 20.99228 72.80521       4.986490      75.90879       6.935347      69.48373       7.174664  623.9720 28.62036 595.9622 31.10739 28.00983       42.27050 
1 1 1 0   14 1  o 179.4203 36.45941 6.556705       2.453817      9.016916       3.266960      3.372254       3.716849  210.1749 41.49808 142.5590 51.85637 67.61589       66.41667 
1 1 1 0   14 2  o 579.1812 15.26339 65.29124       3.433155      68.65762       4.767262      61.66445       4.948222  593.3375 20.68899 562.0643 22.66915 31.27319       30.69079 
1 1 1 0   14 3  o 308.7308 23.79462 18.72615       2.830906      16.51546       3.791845      21.50999       4.255091  287.8500 34.61402 329.2079 33.75967 -41.35797      48.35127 
1 1 1 0   14 4  o 737.9384 16.86059 106.0644       4.831933      107.7165       5.795817      102.2990       8.749887  743.1875 20.08113 722.0460 31.20395 21.14154       37.10712 
1 1 1 0   14 5  f 805.7350 15.76117 126.4111       4.931836      126.4111       4.931836      0.000000       0.000000  805.7350 15.76117 ?        ?        0.000000       15.76117 
1 1 1 0   14 6  o 274.6737 24.95511 14.87344       2.632931      14.20232       2.982465      17.24375       5.605053  267.6022 29.17093 289.5906 51.73731 -21.98840      59.39438 
1 1 1 0   14 7  o 723.9022 14.64726 102.0106       4.117790      101.1398       4.677167      105.0121       8.683161  720.5333 16.71479 731.4112 30.56949 -10.87793      34.84076 
1 1 1 0   14 8  o 1045.122 13.76330 212.5631       5.586211      202.7527       7.667544      223.6610       8.155177  1019.622 19.36374 1070.845 19.61005 -51.22351      27.55919 
1 1 1 0   14 9  o 269.5530 35.67400 14.54973       3.642675      0.000000       0.000000      14.54973       3.642675  ?        ?        269.5530 35.67400 0.000000       35.67400 
1 1 1 0   14 10 o 593.5477 16.13579 68.60074       3.719408      71.82707       5.554762      65.97855       5.007740  606.3788 23.58813 581.3687 22.18004 25.01013       32.37829 
1 1 1 0   14 11 o 750.1431 15.23144 109.5184       4.437241      119.3259       6.658767      101.6847       5.951106  782.0470 21.92467 722.0352 21.22322 60.01178       30.51419 
1 1 1 0   14 12 o 748.5677 15.57267 109.0460       4.527120      110.8500       6.521550      107.3682       6.289390  753.8733 22.27534 742.0052 21.82597 11.86804       31.18596 
1 1 1 0   14 13 o 354.4544 25.56656 24.65043       3.495712      11.97092       4.954569      37.21912       4.932868  240.8546 54.27020 435.3245 29.34950 -194.4699      61.69804 
1 1 1 0   14 14 o 930.2530 15.73374 168.3398       5.684090      179.6453       8.318361      158.4373       7.785140  960.1052 22.30956 901.6646 22.23276 58.44061       31.49622 
1 1 1 0   14 15 o 313.4834 37.96406 19.53853       4.527613      15.58450       5.400545      28.89105       8.305814  276.4672 52.21351 377.2934 58.58613 -100.8261      78.47665 
1 1 1 0   14 16 o 1080.621 16.28615 227.1189       6.834705      228.9439       9.550156      225.2028       9.785611  1084.124 22.68315 1075.115 23.43715 9.008667       32.61634 
1 1 1 0   14 17 o 771.6805 18.37385 115.8647       5.506374      109.2040       7.364111      124.3111       8.292708  748.4906 25.33413 798.4116 26.74494 -49.92096      36.83897 
1 1 1 0   14 18 o 1531.223 19.82697 456.3928       11.79024      425.6424       18.89206      476.0100       15.08944  1475.556 32.96823 1562.691 24.86407 -87.13452      41.29317 
1 1 1 0   14 19 o 1419.461 19.95666 392.3315       11.00118      400.1374       19.09814      388.4551       13.45832  1429.603 34.39915 1411.424 24.55305 18.17859       42.26291 
1 1 1 0   14 20 o 646.8474 22.47968 81.57182       5.647028      92.42796       7.713253      69.03110       8.290125  687.6534 28.88285 592.0919 36.22748 95.56152       46.33195 
1 1 1 0   14 21 o 355.8708 37.74198 25.16600       5.136478      23.45515       6.750504      27.51867       7.916087  339.6955 52.89175 367.2029 57.38885 -27.50745      78.04498 
1 1 1 0   14 22 o 307.7500 54.26240 19.40956       6.248227      21.89168       7.131628      11.21119       12.96107  326.0771 58.46492 255.5153 96.12648 70.56180       112.5098 
1 1 1 0   14 23 o 294.7468 67.95427 18.32804       7.619253      18.32804       7.619253      0.000000       0.000000  294.7468 67.95427 ?        ?        0.000000       67.95427 
1 1 1 0   14 24 o 160.5525 64.66642 2.766616       6.195752      2.581298       7.556065      3.146898       10.82406  171.5839 70.54826 200.0684 83.53888 -28.48444      109.3426 
1 1 1 0   14 25 o 444.7076 35.67427 39.37349       6.109228      42.91676       8.153691      34.83835       9.224582  460.6943 46.19594 409.0946 59.83098 51.59973       75.58975 
1 1 1 0   14 26 o 321.3520 58.15754 21.83553       6.990773      31.36770       10.86564      15.10279       9.131772  376.6865 76.87801 261.1427 81.32381 115.5438       111.9097 
1 1 1 0   14 27 o 179.6918 65.63324 6.045547       5.962945      1.985804       8.298535      10.37924       8.573962  169.9517 72.17606 222.6920 79.03593 -52.74033      107.0330 
1 1 1 0   14 28 f 178.4103 64.50486 6.245335       5.738559      4.047806       7.582206      9.192018       8.780007  173.8470 70.97995 211.9725 79.23985 -38.12553      106.3819 
1 1 1 0   14 29 o 430.0595 40.13546 38.13583       6.625775      49.34158       9.364878      26.90427       9.375653  481.5327 50.84712 338.2308 73.47897 143.3019       89.35653 
1 1 1 0   14 30 o 156.8080 63.06968 3.910570       5.884579      6.240949       8.391325      1.655587       8.254466  184.7245 74.95631 160.2933 70.03101 24.43117       102.5807 
1 1 1 0   15 1  o 812.3071 14.11521 128.4167       4.452826      122.9440       6.062586      134.8270       6.561450  793.9664 19.66200 831.3272 20.32356 -37.36078      28.27794 
1 1 1 0   15 2  o 619.7922 15.59642 74.79916       3.754040      80.97997       5.254699      68.35601       5.365051  644.1646 21.00502 591.4782 23.35646 52.68634       31.41234 
1 1 1 0   15 3  o 433.6147 22.38378 36.81643       3.756484      36.08199       4.406932      38.76820       7.184155  428.5170 26.61292 440.3399 42.54047 -11.82288      50.17907 
1 1 1 0   15 4  o 549.6099 19.67394 58.91862       4.199272      55.31668       4.870984      69.34377       8.286847  532.0270 23.57518 592.0468 36.21584 -60.01971      43.21315 
1 1 1 0   15 5  o 125.6134 47.41063 2.337898       3.158512      2.001206       3.928013      2.953862       5.312932  131.3101 51.95284 153.7571 60.55209 -22.44701      79.78504 
1 1 1 0   15 6  o 624.9528 15.59143 76.05062       3.784087      76.53326       4.296953      74.38310       7.987051  626.6866 17.65559 614.0698 33.61965 12.61676       37.97368 
1 1 1 0   15 7  o 451.8604 19.12105 39.80946       3.355397      36.47408       3.791026      51.87170       7.209385  431.5698 22.69899 511.7931 36.51191 -80.22324      42.99260 
1 1 1 0   15 8  o 906.6943 30.80712 161.2661       10.84776      0.000000       0.000000      161.2661       10.84776  ?        ?        906.6943 30.80712 0.000000       30.80712 
1 1 1 0   15 9  o 590.5712 15.97021 67.89929       3.662779      70.42299       5.227627      65.46561       5.133558  600.6955 22.40899 579.1118 22.82591 21.58374       31.98726 
1 1 1 0   15 10 o 406.9168 20.62555 32.36258       3.248760      28.53777       4.682945      35.91130       4.510770  380.2287 32.01147 427.7011 27.29947 -47.47235      42.07131 
1 1 1 0   15 11 o 633.8569 16.50434 78.19663       4.062725      80.93918       5.923691      75.76083       5.582590  644.0867 23.68209 623.2186 23.06574 20.86810       33.05858 
1 1 1 0   15 12 o 196.0869 42.04924 7.850626       3.106018      8.136002       4.742366      7.636252       4.110275  199.8661 57.81154 193.1681 53.13067 6.697998       78.51778 
1 1 1 0   15 13 o 310.6527 36.84747 19.17680       4.358733      20.89420       5.345230      15.76843       7.530161  323.0299 43.73277 275.0173 70.25086 48.01266       82.75107 
1 1 1 0   15 14 o 824.8712 16.68363 132.3607       5.344469      132.9266       7.575612      131.8000       7.540949  825.8804 23.61960 822.3740 23.61177 3.506409       33.39762 
1 1 1 0   15 15 o 370.3480 28.43565 26.91872       4.058571      33.28984       5.932335      21.31285       5.564665  410.6168 37.61975 326.3205 45.11726 84.29630       58.74362 
1 1 1 0   15 16 o 810.4513 17.66383 127.7783       5.559550      125.1371       7.784187      130.5283       7.943001  801.2856 25.01485 818.3671 24.99243 -17.08148      35.36049 
1 1 1 0   15 17 o 808.2738 18.37857 127.1217       5.768970      128.4370       8.019751      125.7112       8.304826  811.6710 25.44209 802.8586 26.63566 8.812378       36.83420 
1 1 1 0   15 18 o 288.9366 48.60469 16.90055       5.260304      7.413884       7.965293      24.23816       7.005226  208.7493 75.91602 346.0292 53.88316 -137.2798      93.09476 
1 1 1 0   15 19 o 692.6475 24.87360 93.60554       6.690812      93.27678       10.88397      93.80524       8.483022  687.4561 40.95320 692.3802 31.54844 -4.924194      51.69593 
1 1 1 0   15 20 o 607.2445 23.95541 71.95358       5.649308      68.40446       7.541226      76.49243       8.528152  589.8795 33.05239 623.3388 35.37496 -33.45935      48.41331 
1 1 1 0   15 21 o 233.1773 64.65775 11.30030       6.059310      11.52860       7.012536      10.62762       12.03738  236.4270 70.81514 248.4289 92.79865 -12.00186      116.7321 
1 1 1 0   15 22 o 523.1231 34.66767 54.00430       7.003066      50.92931       8.003728      64.04689       14.46415  506.2987 41.05957 557.9339 68.17275 -51.63516      79.58274 
1 1 1 0   15 23 o 664.6920 26.94408 86.50878       6.955234      90.52359       8.453375      78.09537       12.23725  678.7681 32.06866 623.0013 51.02614 55.76672       60.26662 
1 1 1 0   15 24 o 376.9933 42.30468 28.61299       6.086821      30.84441       7.534435      24.42031       10.32776  388.5301 51.17976 333.7184 80.59711 54.81171       95.47389 
1 1 1 0   15 25 o 335.4294 57.64828 23.62375       7.238920      32.91267       11.99707      18.30561       9.077635  383.9842 82.88079 287.0550 78.95959 96.92917       114.4720 
1 1 1 0   15 26 o 107.8101 52.03186 -9.294450      6.547671      -11.84761      10.53177      -7.685852      8.359615  141.4212 67.66064 132.4382 62.45823 8.983063       92.08144 
1 1 1 0   15 27 o 388.3889 40.40715 30.77289       6.005482      24.30527       7.930429      39.46824       9.195333  333.1371 63.61811 431.3269 56.23260 -98.18973      84.90800 
1 1 1 0   15 28 o 416.9979 38.47780 35.55393       6.160925      35.27685       8.670052      35.83655       8.756316  403.9111 56.84516 407.0700 56.94814 -3.158875      80.46405 
1 1 1 0   15 29 o 195.3086 65.93090 8.563159       5.934361      0.4019052      8.073372      18.15549       8.752628  154.5326 68.32161 270.4562 78.62856 -115.9236      104.1647 
1 1 1 0   15 30 o 207.1402 66.37324 10.15440       6.043481      8.485476       8.468109      11.88681       8.627670  196.7827 76.75520 219.2742 79.12156 -22.49142      110.2342 
1 1 1 0   16 0  o 1664.680 22.59036 539.6591       14.60434      546.9076       20.79413      532.6031       20.51599  1673.385 31.99756 1651.358 31.99066 22.02673       45.24650 
1 1 1 0   16 1  o 226.4053 38.93329 10.39634       3.299809      12.51046       3.928008      5.326397       6.082879  248.0623 42.29073 178.7939 66.12881 69.26846       78.49538 
1 1 1 0   16 2  o 288.7085 30.67850 16.53544       3.387007      16.16153       3.983749      17.51065       6.433672  284.0319 36.99370 289.8083 59.16529 -5.776367      69.77869 
1 1 1 0   16 3  o 525.4001 17.68489 53.78978       3.608449      54.74165       4.896504      52.65838       5.338308  529.2753 23.82191 518.0324 26.62498 11.24292       35.72636 
1 1 1 0   16 4  o 1144.550 14.67602 254.9756       6.523355      253.1966       8.986106      256.9575       9.484925  1139.314 20.30954 1147.489 21.28420 -8.174805      29.41929 
1 1 1 0   16 5  o 1118.953 16.87877 243.8673       7.334668      245.9255       8.955827      239.6747       12.78222  1122.839 20.53810 1105.726 29.76671 17.11328       36.16449 
1 1 1 0   16 6  o 134.8374 53.00543 2.200355       4.064275      -0.5068519     5.505585      5.442441       6.024971  132.9505 57.64847 179.6800 65.92130 -46.72946      87.57262 
1 1 1 0   16 7  o 120.3237 47.70933 1.596982       3.319197      1.342869       3.995926      2.162513       5.961184  126.8089 51.62345 154.9513 63.06339 -28.14243      81.49829 
1 1 1 0   16 8  o 496.9913 23.31463 48.20484       4.499925      45.54942       5.607066      53.01011       7.542729  481.3760 30.14523 517.7372 37.77449 -36.36118      48.32853 
1 1 1 0   16 9  o 794.4382 17.49115 122.8748       5.396430      124.3027       6.439572      119.5068       9.889842  798.6110 20.76317 780.9344 32.60970 17.67651       38.65878 
1 1 1 0   16 10 o 558.4904 17.41958 60.71220       3.778168      60.20470       5.390718      61.20217       5.296793  555.4443 24.99068 560.0966 24.35129 -4.652283      34.89297 
1 1 1 0   16 11 o 436.7620 30.92475 37.48433       5.211492      37.48433       5.211492      0.000000       0.000000  436.7620 30.92475 ?        ?        0.000000       30.92475 
1 1 1 0   16 12 o 981.3198 18.17451 187.4129       6.926297      188.5949       8.390374      184.8842       12.27208  983.8997 21.95849 972.2708 32.50148 11.62891       39.22399 
1 1 1 0   16 13 o 1042.855 15.42804 211.4945       6.248312      214.7503       9.101517      208.5922       8.593266  1049.990 22.32034 1034.960 21.37996 15.02991       30.90793 
1 1 1 0   16 14 o 1129.848 15.75158 248.2448       6.911495      246.7101       9.852256      249.7319       9.698223  1125.478 22.54086 1132.423 22.05238 -6.944946      31.53407 
1 1 1 0   16 15 o 610.3973 19.86151 72.51597       4.708177      60.19261       6.746871      84.21327       6.573259  554.2681 31.47380 657.2681 25.75195 -103.0000      40.66649 
1 1 1 0   16 16 o 661.5710 19.88346 85.19359       5.108535      78.48011       7.139880      92.23528       7.312325  634.1028 28.99368 687.6211 27.38283 -53.51831      39.88048 
1 1 1 0   16 17 o 321.8771 37.03708 20.56562       4.545317      19.51573       6.374545      21.65150       6.482922  309.4829 55.05537 326.9048 52.86964 -17.42191      76.33015 
1 1 1 0   16 18 o 361.3957 39.75066 25.96521       5.486771      19.70827       8.631140      30.20839       7.107764  306.4605 73.47393 388.1776 48.18557 -81.71713      87.86505 
1 1 1 0   16 19 o 194.5681 62.42479 7.458717       5.344527      7.773028       8.177162      7.224319       7.061566  211.5848 76.92334 201.1965 71.69302 10.38831       105.1527 
1 1 1 0   16 20 o 454.1203 47.66401 41.28178       8.280632      0.000000       0.000000      41.28178       8.280632  ?        ?        454.1203 47.66401 0.000000       47.66401 
1 1 1 0   16 21 o 560.5228 32.16302 61.81931       6.971992      62.28123       7.983825      60.33554       14.30897  561.4865 36.81755 540.9418 69.73689 20.54462       78.85915 
1 1 1 0   16 22 o 118.8246 53.76511 -2.666837      5.319110      -2.702603      7.081486      -2.620533      8.057361  140.0369 62.81323 150.8317 67.37415 -10.79486      92.11285 
1 1 1 0   16 23 f 789.8358 25.23607 122.1598       7.740813      125.7705       9.514947      115.0927       13.31167  799.8378 30.63208 758.3244 45.41010 41.51337       54.77592 
1 1 1 0   16 24 o 408.8342 42.52631 33.72819       6.653196      41.54853       8.431060      20.82006       10.83181  451.6279 48.84818 304.2672 87.18644 147.3608       99.93808 
1 1 1 0   16 25 o 891.5560 26.23030 156.4127       9.081965      162.8365       14.79134      152.5255       11.50633  900.2029 42.30964 876.5911 33.79961 23.61176       54.15274 
1 1 1 0   16 26 o 590.6969 28.25060 69.01700       6.480678      73.45071       8.736622      63.59272       9.663423  604.1781 37.41908 557.6693 45.00294 46.50885       58.52736 
1 1 1 0   16 27 o 144.3955 61.04207 1.460015       5.892302      3.726993       8.012480      -1.209798      8.695284  174.4277 72.27208 156.0754 69.83361 18.35226       100.4987 
1 1 1 0   16 28 o 408.0868 38.72697 34.26992       6.064021      35.51489       8.588870      33.03249       8.562830  403.4587 56.35452 387.0956 58.81052 16.36316       81.45249 
1 1 1 0   16 29 o 489.1985 33.73699 48.83215       6.370252      55.69307       8.995300      41.92958       9.022554  512.5815 45.66648 436.8719 54.35511 75.70959       70.99229 
1 1 1 0   17 1  f 317.1700 29.87403 19.88141       3.636357      23.71487       4.323302      10.61084       6.723167  346.1220 32.54533 227.2001 69.61964 118.9219       76.85111 
1 1 1 0   17 2  o 220.9065 36.22610 9.842151       3.000076      11.02347       4.034999      8.381803       4.486291  231.8387 46.43452 201.4622 55.54720 30.37648       72.39928 
1 1 1 0   17 3  o 329.4923 25.56195 21.34199       3.245297      20.93454       4.339270      21.85918       4.888804  324.5802 34.97689 330.9141 38.77683 -6.333832      52.22093 
1 1 1 0   17 4  o 176.4182 51.15233 6.329566       3.708752      4.906941       5.881607      7.268599       4.778494  174.6385 64.93937 190.1669 58.76383 -15.52847      87.58031 
1 1 1 0   17 5  o 499.9554 19.87536 48.71326       3.858995      48.05450       5.381813      49.41040       5.536354  494.8793 28.11884 501.7580 28.52983 -6.878723      40.05771 
1 1 1 0   17 6  o 382.0089 25.95376 28.63400       3.827525      28.55698       4.550692      28.82022       7.076205  380.6425 31.05514 378.2326 49.35014 2.409851       58.30830 
1 1 1 0   17 7  f 371.9853 23.45927 27.09749       3.371615      25.55386       3.834503      32.35817       7.078779  360.5922 27.59136 402.1785 46.15843 -41.58630      53.77624 
1 1 1 0   17 8  o 329.9386 26.43214 21.38721       3.358394      21.38725       3.814087      21.38706       7.085190  329.3635 30.15325 322.9401 58.65429 6.423431       65.95107 
1 1 1 0   17 9  f 771.6946 17.82736 115.9042       5.342696      125.8803       6.530101      95.70497       9.291897  803.8685 20.91736 699.0570 34.22660 104.8115       40.11230 
1 1 1 0   17 10 o 257.0456 39.27299 13.25375       3.795997      8.962241       4.478339      24.20659       7.154431  208.8925 54.59526 345.4504 55.18612 -136.5579      77.62828 
1 1 1 0   17 11 f 897.0858 15.39272 156.5048       5.362622      157.7392       7.580641      155.2684       7.587149  899.9412 21.69021 892.8413 21.88146 7.099854       30.81013 
1 1 1 0   17 12 o 516.3582 29.69724 52.21907       5.930094      52.21907       5.930094      0.000000       0.000000  516.3582 29.69724 ?        ?        0.000000       29.69724 
1 1 1 0   17 13 o 1136.248 22.74180 251.4524       10.03520      251.4524       10.03520      0.000000       0.000000  1136.248 22.74180 ?        ?        0.000000       22.74180 
1 1 1 0   17 14 o 471.1415 23.10938 43.23798       4.228317      41.72486       6.223828      44.53501       5.762293  460.5807 35.05884 476.5221 31.31184 -15.94144      47.00589 
1 1 1 0   17 15 o 491.6307 23.46513 47.09311       4.480122      40.61927       6.430871      53.19798       6.244919  454.0132 36.78948 520.9582 31.00729 -66.94498      48.11359 
1 1 1 0   17 16 o 667.8760 28.40669 87.09551       7.367911      87.09551       7.367911      0.000000       0.000000  667.8760 28.40669 ?        ?        0.000000       28.40669 
1 1 1 0   17 17 o 416.7323 34.51581 34.25645       5.535746      31.71600       9.477156      35.57211       6.820183  393.3549 64.25824 423.1498 42.05977 -29.79498      76.79939 
1 1 1 0   17 18 o 490.7591 31.07203 47.32844       5.891402      55.04798       9.866160      43.05056       7.344580  525.0609 48.94923 465.8630 41.01396 59.19781       63.86057 
1 1 1 0   17 19 o 438.1910 35.28751 37.93359       5.954098      48.18895       9.526681      31.35992       7.627285  490.1147 50.78854 394.2799 51.00819 95.83481       71.98132 
1 1 1 0   17 20 o 182.7636 66.94134 5.627447       6.209186      12.23304       7.135144      -14.98327      12.60356  242.5314 71.13124 156.4781 74.62935 86.05336       103.0980 
1 1 1 0   17 21 o 234.9347 59.25510 11.54123       5.405581      10.08926       7.101900      13.54092       8.334477  223.3610 71.99100 254.2591 77.43841 -30.89809      105.7327 
1 1 1 0   17 22 o 178.2384 64.30278 5.636961       5.698161      0.6978141      7.679880      11.68600       8.499078  162.1042 69.15186 238.7117 78.87032 -76.60759      104.8928 
1 1 1 0   17 23 o 223.0840 68.36487 10.48960       6.482829      12.84992       8.131335      6.372068       10.73975  245.2386 76.80035 213.1062 85.38343 32.13243       114.8417 
1 1 1 0   17 24 o 445.3616 48.46173 40.59594       8.246555      38.17043       11.85565      42.86950       11.47828  416.9174 76.02417 447.1647 68.26044 -30.24731      102.1722 
1 1 1 0   17 25 o 651.3614 26.85919 83.70056       6.794271      97.79005       9.532260      69.15082       9.686703  699.3028 35.21247 583.5068 43.05069 115.7960       55.61726 
1 1 1 0   17 26 o 335.2636 45.89756 23.39583       5.818993      23.97360       7.983230      22.74090       8.499621  329.2413 64.74354 316.7824 70.86272 12.45886       95.98569 
1 1 1 0   17 27 o 163.8617 62.89256 4.749826       5.616884      9.795591       7.789530      -0.7155043     8.106921  210.5061 75.26714 151.7482 67.69693 58.75786       101.2325 
1 1 1 0   17 28 o 332.1174 47.07891 23.58041       5.902196      21.40738       8.194213      25.92337       8.508594  299.0283 71.52383 332.9610 68.09814 -33.93274      98.75735 
1 1 1 0   17 29 o 159.5448 62.67984 4.609640       5.680021      13.99400       8.077330      -4.570425      7.988925  235.2499 76.84824 132.5274 62.04311 102.7225       98.76740 
1 1 1 0   18 0  o 847.0333 29.73165 139.8428       9.780195      139.8428       9.780195      0.000000       0.000000  847.0333 29.73165 ?        ?        0.000000       29.73165 
1 1 1 0   18 1  o 604.8875 19.61016 71.28021       4.606635      69.58603       5.513658      75.19688       8.383356  597.1976 23.77353 618.1048 35.06875 -20.90723      42.36742 
1 1 1 0   18 2  o 913.9890 17.29254 162.6184       6.138013      168.1238       7.532089      151.7345       10.59044  928.7985 20.88170 880.4403 30.97321 48.35822       37.35485 
1 1 1 0   18 3  o 280.0338 36.17685 15.63767       3.842328      22.09683       6.268941      11.75117       4.862790  330.3557 50.46460 238.6437 53.76012 91.71201       73.73484 
1 1 1 0   18 4  o 554.5134 27.63126 60.07020       5.950325      0.000000       0.000000      60.07020       5.950325  ?        ?        554.5134 27.63126 0.000000       27.63126 
1 1 1 0   18 5  o 503.9872 24.40983 49.54736       4.777627      45.75458       7.666542      51.95551       6.108879  480.5374 41.48812 514.5101 30.71322 -33.97269      51.61943 
1 1 1 0   18 6  o 577.1199 17.71554 64.82420       3.970530      60.68013       4.456519      80.77647       8.743657  558.1440 20.55992 641.0909 35.25473 -82.94690      40.81184 
1 1 1 0   18 7  o 122.8475 46.72280 2.106428       3.082368      2.248604       3.470583      1.575437       6.707063  128.9884 49.45378 159.6637 66.13635 -30.67525      82.58144 
1 1 1 0   18 8  o 819.3939 15.94452 130.5953       5.073788      131.2681       5.811568      128.4386       10.40496  821.2869 18.22093 810.3140 33.06429 10.97290       37.75248 
1 1 1 0   18 9  o 1104.031 15.33695 237.0336       6.575790      247.8419       7.690541      207.6460       12.68119  1128.660 17.54549 1030.813 31.67757 97.84705       36.21206 
1 1 1 0   18 10 o 360.2177 27.14979 25.44988       3.770120      26.44849       4.324349      22.28592       7.697276  366.7657 30.64079 329.8192 62.37937 36.94653       69.49851 
1 1 1 0   18 11 o 240.8087 37.25829 11.61151       3.371850      10.74558       5.026026      12.32022       4.546920  228.6684 56.84184 245.9149 49.32677 -17.24646      75.26039 
1 1 1 0   18 12 o 316.5521 30.91247 19.74852       3.751705      25.48110       5.624171      15.15250       5.035867  358.2095 41.17799 273.4182 49.23710 84.79129       64.18659 
1 1 1 0   18 13 o 207.4221 47.18702 8.795593       3.715387      18.42933       5.710661      1.724761       4.892427  301.9033 50.48992 141.4080 57.28494 160.4953       76.35965 
1 1 1 0   18 14 o 913.2909 16.90134 162.2572       5.994573      155.1563       8.609249      168.9399       8.351823  892.1443 24.84862 931.1767 23.09517 -39.03235      33.92404 
1 1 1 0   18 15 o 350.9476 32.02993 24.28422       4.317321      24.72049       6.431525      23.92639       5.824706  350.7569 48.51376 345.9235 44.38117 4.833374       65.75160 
1 1 1 0   18 16 o 545.4467 24.16087 58.03147       5.117913      60.85079       7.629694      55.72514       6.900725  555.9896 35.52111 532.3601 33.54969 23.62952       48.86032 
1 1 1 0   18 17 o 246.0764 55.96389 12.52560       5.227382      12.68079       8.946049      12.44514       6.441461  250.6002 80.80212 244.5651 66.20128 6.035019       104.4586 
1 1 1 0   18 18 o 664.0610 25.67031 86.12910       6.620137      87.18094       11.18454      85.56186       8.213459  663.0933 43.67710 660.8048 32.00552 2.288513       54.14834 
1 1 1 0   18 19 f 712.3355 29.78831 99.36401       8.240593      92.41871       11.03353      108.1254       12.39240  683.0051 41.79816 738.3989 43.40607 -55.39374      60.25922 
1 1 1 0   18 20 o 171.1325 65.69656 4.255531       6.129668      6.740784       7.153855      -2.608067      11.88860  196.9560 71.89676 185.6381 82.44923 11.31787       109.3939 
1 1 1 0   18 21 o 463.8465 32.22139 42.51531       5.768241      46.84587       7.881289      37.51953       8.465004  484.0541 42.35142 429.6552 51.77443 54.39890       66.88972 
1 1 1 0   18 22 o 179.4442 64.45295 5.856713       5.718120      -0.3098665     7.729421      13.31143       8.498461  156.6384 68.11301 249.6048 78.57159 -92.96645      103.9850 
1 1 1 0   18 23 o 562.4357 41.71307 63.64967       9.046224      51.15604       13.02440      75.29425       12.57406  488.1946 70.75940 605.0343 54.08421 -116.8397      89.06174 
1 1 1 0   18 24 o 567.4996 33.71830 64.25626       7.397807      61.44412       9.204019      69.38864       12.43421  550.0834 43.43792 576.5099 56.25390 -26.42651      71.07288 
1 1 1 0   18 25 o 238.1694 61.58224 12.50452       5.738118      13.98471       8.251791      11.11863       7.984648  247.4596 77.34612 224.9798 76.47424 22.47981       108.7692 
1 1 1 0   18 26 o 237.4673 59.40032 12.55817       5.464132      13.66861       7.837465      11.50796       7.621942  241.8053 75.34673 224.4790 74.71475 17.32625       106.1104 
1 1 1 0   18 27 o 296.8811 48.64772 18.94916       5.414514      20.10239       7.659257      17.79712       7.655303  292.8785 68.55214 273.2137 71.36770 19.66473       98.95830 
1 1 1 0   18 28 o 126.3321 56.21531 -0.5472251     5.552055      -4.426016      8.056024      2.961733       7.662344  134.0703 62.61509 162.1411 69.11789 -28.07080      93.26270 
1 1 1 0   19 1  o 131.5817 52.17379 1.885995       3.969497      0.4677453E-01  6.226279      3.145486       5.152394  145.4574 62.16286 154.9541 60.02923 -9.496704      86.41603 
1 1 1 0   19 2  o 853.3931 17.88056 141.7330       5.925953      144.7853       7.202979      135.3400       10.42452  862.1006 21.51425 831.8220 32.26990 30.27856       38.78414 
1 1 1 0   19 3  f 480.6771 29.31363 45.29559       5.445910      42.46410       7.409367      48.62259       8.031563  463.0722 41.64612 495.6535 42.12397 -32.58130      59.23536 
1 1 1 0   19 4  o 109.6312 48.22770 -1.021098      3.974670      -3.278303      6.375484      0.4139550      5.083486  130.3042 58.91963 134.2835 56.72886 -3.979279      81.79050 
1 1 1 0   19 5  o 426.7370 32.74123 35.81449       5.384672      35.81449       5.384672      0.000000       0.000000  426.7370 32.74123 ?        ?        0.000000       32.74123 
1 1 1 0   19 6  o 777.7115 16.10185 117.6383       4.863202      118.5020       5.545245      114.7609       10.12149  780.3745 18.29741 765.9644 34.02575 14.41016       38.63350 
1 1 1 0   19 7  o 197.0423 44.40652 7.927238       3.316714      7.003756       3.737567      11.34908       7.194574  185.4684 50.52110 236.9595 71.89892 -51.49113      87.87398 
1 1 1 0   19 8  o 722.3976 16.84786 101.5026       4.726601      102.9316       5.394790      96.78174       9.805142  727.2921 19.10019 702.3960 36.06709 24.89612       40.81240 
1 1 1 0   19 9  o 1379.226 15.83488 369.9091       8.481607      361.9786       9.525140      400.2699       18.63713  1364.077 17.98061 1431.125 33.53308 -67.04724      38.04957 
1 1 1 0   19 10 o 1477.301 16.28710 424.4203       9.344173      425.1035       10.73769      422.2889       18.96678  1478.132 18.70552 1470.063 33.22230 8.068726       38.12634 
1 1 1 0   19 11 o 451.3633 24.55690 39.81516       4.288354      38.60932       4.933889      43.54007       8.671649  443.9196 28.77415 467.9392 48.41863 -24.01956      56.32331 
1 1 1 0   19 12 o 818.6477 24.23997 130.6026       7.706498      130.6026       7.706498      0.000000       0.000000  818.6477 24.23997 ?        ?        0.000000       24.23997 
1 1 1 0   19 13 o 913.8708 24.23283 162.8034       8.600367      162.8034       8.600367      0.000000       0.000000  913.8708 24.23283 ?        ?        0.000000       24.23283 
1 1 1 0   19 14 o 872.9121 17.46607 148.2876       5.920980      154.4576       8.831140      143.2491       7.980402  889.7604 25.55734 857.1129 23.97501 32.64758       35.04253 
1 1 1 0   19 15 o 504.4551 24.64962 49.65085       4.829040      38.01488       6.959670      60.45398       6.705979  437.6215 41.44460 554.9731 31.24154 -117.3517      51.90076 
1 1 1 0   19 16 o 1143.898 19.49076 254.8981       8.658526      272.2284       15.61941      247.2100       10.40329  1178.248 34.13499 1125.630 23.79835 52.61829       41.61201 
1 1 1 0   19 17 o 547.8112 27.66211 58.81562       5.865936      61.75376       9.907152      57.22957       7.279001  556.8560 46.22988 538.8639 34.97185 17.99213       57.96751 
1 1 1 0   19 18 o 562.4590 33.23660 62.28978       7.227739      63.92251       10.02911      60.52542       10.42555  566.2875 46.00103 549.8668 49.34701 16.42065       67.46275 
1 1 1 0   19 19 o 97.91706 47.69593 -10.19380      5.843217      -8.918501      7.013344      -13.08818      10.56570  116.2169 55.49472 142.2209 67.96803 -26.00397      87.74575 
1 1 1 0   19 20 o 251.9951 57.19299 13.30603       5.468949      6.178392       7.645269      20.77547       7.826437  195.0257 73.72497 313.3256 66.38303 -118.2999      99.20724 
1 1 1 0   19 21 o 157.6409 60.86872 3.601442       5.283919      12.89510       7.320179      -6.508615      7.634934  245.3692 72.07165 130.2200 60.86385 115.1491       94.33308 
1 1 1 0   19 22 o 204.9431 69.41673 8.509337       6.578680      8.094193       11.17474      8.729534       8.138463  222.6950 87.78034 212.6137 76.82606 10.08131       116.6518 
1 1 1 0   19 23 o 224.7663 76.31534 10.71848       7.951415      -1.307340      11.17661      23.04324       11.31466  178.6358 79.60436 313.9666 88.81646 -135.3308      119.2695 
1 1 1 0   19 24 o 188.4006 68.53019 6.911964       6.491301      7.147291       8.121881      6.495816       10.80053  197.6870 75.68614 207.1345 84.65941 -9.447449      113.5588 
1 1 1 0   19 25 f 156.4448 61.63322 3.762349       5.506239      7.871120       7.991105      0.4810121E-01  7.597773  199.2234 75.35906 151.9350 66.76191 47.28842       100.6784 
1 1 1 0   19 26 o 175.1561 61.76084 6.413968       5.227306      16.68451       8.029837      -1.139546      6.886276  263.0939 74.95987 138.2385 61.97856 124.8553       97.26420 
1 1 1 0   19 27 o 123.7550 53.88034 0.2655333      4.848537      -2.683546      7.336921      2.551915       6.460186  134.4005 61.69924 152.1084 64.08809 -17.70790      88.96111 
1 1 1 0   20 0  o 722.3943 35.42482 101.7215       9.938252      0.000000       0.000000      101.7215       9.938252  ?        ?        722.3943 35.42482 0.000000       35.42482 
1 1 1 0   20 1  o 638.4569 18.76604 79.32212       4.652991      82.85611       6.447287      75.48061       6.721951  651.9359 25.46503 622.0052 27.82744 29.93060       37.72047 
1 1 1 0   20 2  o 463.9037 26.15137 42.09280       4.692190      39.89083       7.578355      43.46171       5.975276  448.5406 44.07480 470.4341 32.91366 -21.89349      55.00815 
1 1 1 0   20 3  o 488.2237 30.05363 46.70770       5.670595      56.93348       7.858155      35.59714       8.191065  537.8851 37.86012 421.9688 51.02034 115.9164       63.53317 
1 1 1 0   20 4  o 312.4969 34.51835 19.32258       4.119197      19.90411       4.988187      18.07582       7.303835  315.9075 41.67628 295.8906 65.30963 20.01691       77.47426 
1 1 1 0   20 5  o 901.7781 18.63352 158.2215       6.525631      153.9814       7.866051      167.5813       11.68700  889.1740 22.77938 926.1824 32.49215 -37.00842      39.68174 
1 1 1 0   20 6  o 974.2985 18.42430 184.6801       6.971254      195.0688       8.705143      166.1057       11.64000  1000.866 22.39607 922.1289 32.50374 78.73730       39.47249 
1 1 1 0   20 7  o 1224.504 15.63505 291.5544       7.435107      295.2403       8.567925      280.3144       14.96172  1231.954 17.90826 1197.993 32.15876 33.96057       36.80885 
1 1 1 0   20 8  o 252.7281 37.88254 12.77375       3.603532      15.60835       4.118446      3.516408       7.442697  279.6886 38.97597 179.1726 71.31573 100.5160       81.27152 
1 1 1 0   20 9  o 119.4197 48.93307 0.9812848      3.619767      1.527870       4.155755      -0.7371547     7.368653  131.0637 52.90056 154.2077 66.77933 -23.14395      85.19360 
1 1 1 0   20 10 o 295.6552 34.49349 17.32295       3.886054      19.73831       4.455220      9.639995       7.945884  315.3989 37.08102 225.6203 76.29034 89.77861       84.82464 
1 1 1 0   20 11 o 173.3528 53.12674 5.958911       3.914893      10.49652       4.543025      -7.131475      7.716276  226.0461 52.71935 131.1613 61.26455 94.88484       80.82496 
1 1 1 0   20 12 o 830.5665 20.48635 134.3484       6.607955      139.4482       8.006631      123.4547       11.70213  845.6631 24.37948 793.3278 37.98257 52.33527       45.13352 
1 1 1 0   20 13 o 860.6211 17.48701 144.1558       5.844611      137.9533       8.338217      150.1466       8.194709  840.7977 25.53605 877.4139 24.04922 -36.61615      35.07784 
1 1 1 0   20 14 o 251.8050 47.33222 12.92542       4.458673      17.10307       6.745054      9.683279       5.942038  287.0721 62.29134 217.9820 65.16274 69.09015       90.14651 
1 1 1 0   20 15 o 878.5865 20.73618 150.4404       7.075242      151.3002       12.52255      150.0372       8.575107  877.6542 36.74018 876.6437 25.18769 1.010437       44.54504 
1 1 1 0   20 16 o 197.2140 60.64080 7.834554       5.095787      5.730652       8.470847      9.027702       6.379128  199.4681 77.05500 212.7728 68.19289 -13.30461      102.8968 
1 1 1 0   20 17 f 438.4910 40.80479 38.25101       6.868890      35.56117       9.403955      41.32745       10.05706  416.9698 59.78418 450.3649 58.91369 -33.39517      83.93433 
1 1 1 0   20 18 o 567.0934 34.84315 63.50005       7.636461      61.49683       10.79892      65.50376       10.80026  552.8936 50.86372 571.4001 49.14880 -18.50659      70.72993 
1 1 1 0   20 19 o 704.3262 23.34443 96.99269       6.385357      105.0871       9.201121      89.47282       8.868574  730.7994 32.42012 673.0520 34.04009 57.74744       47.00842 
1 1 1 0   20 20 o 133.0285 56.79190 0.3026591      5.187046      9.177013       7.411965      -8.215119      7.261530  214.6488 73.67278 120.4249 57.21109 94.22396       93.27802 
1 1 1 0   20 21 o 152.2584 64.42132 1.147059       6.571781      -16.24316      11.97637      8.639229       7.860978  144.9893 70.07123 210.8424 75.58775 -65.85306      103.0703 
1 1 1 0   20 22 o 575.8266 32.54552 65.97846       7.248178      68.41326       12.65978      64.79114       8.840540  571.9895 57.78380 566.9244 40.41843 5.065125       70.51679 
1 1 1 0   20 23 o 500.0402 35.56283 50.26019       6.861021      47.28045       8.503774      55.81739       11.61317  479.3556 46.25428 512.1839 59.49264 -32.82828      75.35802 
1 1 1 0   20 24 o 189.3469 67.38912 7.373260       6.237372      9.609599       7.956563      3.807811       10.04648  211.6493 76.02803 187.3648 79.48413 24.28453       109.9909 
1 1 1 0   20 25 o 150.2328 60.46824 3.200875       5.413353      0.9064052      7.872034      5.259317       7.456160  156.5042 68.38217 177.4265 71.12375 -20.92229      98.66463 
1 1 1 0   20 26 o 143.4495 58.19617 2.853360       5.057175      6.320515       7.320078      -0.3125520     6.994852  181.1378 71.15816 141.7770 63.09235 39.36078       95.10062 
1 1 1 0   21 1  o 699.6790 21.61366 95.30853       5.872935      92.38282       9.357553      97.20994       7.543676  686.4904 35.21795 706.0519 27.51176 -19.56146      44.69006 
1 1 1 0   21 2  o 207.8644 54.99552 8.835564       4.508272      13.69281       7.305743      5.848483       5.729186  257.8334 70.79995 182.8545 64.63811 74.97897       95.86823 
1 1 1 0   21 3  o 496.5109 24.63958 48.03225       4.751055      46.53445       5.679732      51.52246       8.670158  487.3781 30.15592 510.4756 44.16973 -23.09750      53.48219 
1 1 1 0   21 4  o 453.8322 26.37109 40.28413       4.627801      39.85979       5.602458      41.19556       8.210777  450.6255 32.22630 455.4253 47.10438 -4.799835      57.07326 
1 1 1 0   21 5  o 511.8846 24.33702 51.05075       4.838018      52.63735       5.903652      47.80645       8.442057  518.5525 29.43703 491.4400 44.72272 27.11252       53.54121 
1 1 1 0   21 6  o 871.3089 19.44834 147.7378       6.580861      150.3589       8.091952      142.6182       11.30925  878.5366 23.71731 854.1476 34.09361 24.38904       41.53174 
1 1 1 0   21 7  o 338.2238 35.16199 22.61231       4.551039      25.45366       5.580582      16.97044       7.863727  358.0268 40.86849 285.8663 71.12255 72.16055       82.02836 
1 1 1 0   21 8  o 1016.557 19.08760 201.1152       7.535483      203.7122       9.278946      196.0848       12.91405  1022.523 23.36671 1001.471 33.20442 21.05176       40.60217 
1 1 1 0   21 9  o 657.3811 23.16621 84.21209       5.914258      75.66720       7.088894      103.7805       10.72760  622.4733 29.32444 726.6003 38.15057 -104.1270      48.11848 
1 1 1 0   21 10 o 590.0713 25.49443 67.91982       5.842218      66.31370       7.188289      71.04522       10.02741  581.4355 31.95699 599.4063 43.36932 -17.97076      53.87158 
1 1 1 0   21 11 o 787.4235 22.27087 120.8457       6.810414      114.6717       8.266137      133.8934       12.01671  766.2545 27.77804 826.0413 37.45898 -59.78680      46.63469 
1 1 1 0   21 12 o 780.2602 22.65018 118.6992       6.863397      118.0482       8.371842      120.0334       11.98590  777.3289 27.73245 780.3856 39.67952 -3.056702      48.41026 
1 1 1 0   21 13 o 569.8007 33.07829 63.82876       7.288212      75.05177       10.11124      51.69205       10.51478  615.6559 42.55115 507.0892 54.23438 108.5667       68.93452 
1 1 1 0   21 14 o 408.3605 34.05673 32.92738       5.351738      39.02956       9.449075      30.04541       6.493675  438.8849 56.76881 387.7697 43.89402 51.11523       71.75919 
1 1 1 0   21 15 o 825.8738 21.84466 133.0252       7.006273      133.5065       12.25200      132.7914       8.540484  823.6285 38.30432 824.2595 26.68029 -0.6309814     46.68039 
1 1 1 0   21 16 o 637.5184 25.77665 79.44646       6.381859      73.86414       10.58776      82.63197       7.998081  609.0039 45.08717 649.0654 31.72995 -40.06146      55.13295 
1 1 1 0   21 17 o 707.3962 29.77311 98.14130       8.179276      87.57962       11.58556      108.6365       11.54901  662.5092 45.30125 740.1671 40.32999 -77.65784      60.65239 
1 1 1 0   21 18 o 398.8574 35.46358 31.63366       5.435929      28.38632       7.940996      34.49717       7.456945  370.8212 56.96393 413.0286 47.34430 -42.20743      74.07005 
1 1 1 0   21 19 o 192.0609 60.50787 7.552562       5.038914      9.565199       7.289721      5.711002       6.973024  217.1283 73.07418 186.0728 70.39262 31.05547       101.4641 
1 1 1 0   21 20 o 219.2063 61.52849 10.26332       5.452136      -4.868505      7.728800      25.25256       7.692298  136.2851 62.84324 345.9246 59.39913 -209.6395      86.47272 
1 1 1 0   21 21 o 799.4949 25.95294 125.8422       8.058056      113.3445       14.12296      131.8745       9.811906  744.3096 49.13538 816.0688 30.95983 -71.75928      58.07579 
1 1 1 0   21 22 o 221.9901 67.50063 10.83931       6.336335      13.46586       7.738345      5.495220       11.03802  244.4208 74.65667 203.8688 84.67791 40.55200       112.8892 
1 1 1 0   21 23 o 213.1724 86.32101 8.043449       11.10406      0.000000       0.000000      8.043449       11.10406  ?        ?        213.1724 86.32101 0.000000       86.32101 
1 1 1 0   21 24 o 222.9522 66.93342 11.42537       6.259496      12.08755       7.760969      10.19291       10.58803  227.2410 75.38158 218.6116 85.67198 8.629318       114.1143 
1 1 1 0   21 25 o 218.6268 59.87777 10.93948       5.233490      13.01494       7.551417      9.021258       7.259741  231.8230 74.18374 200.3484 72.53458 31.47464       103.7521 
1 1 1 0   22 0  f 714.6331 40.27329 99.95244       11.13152      0.000000       0.000000      99.95244       11.13152  ?        ?        714.6331 40.27329 0.000000       40.27329 
1 1 1 0   22 1  f 1119.418 24.11933 244.1595       10.48541      0.000000       0.000000      244.1595       10.48541  ?        ?        1119.418 24.11933 0.000000       24.11933 
1 1 1 0   22 2  o 633.8630 41.32631 79.13502       10.11737      0.000000       0.000000      79.13502       10.11737  ?        ?        633.8630 41.32631 0.000000       41.32631 
1 1 1 0   22 3  o 1015.047 16.62253 200.3993       6.552569      194.3171       8.819703      207.8926       9.789441  998.7994 22.73776 1032.855 24.40567 -34.05536      33.35629 
1 1 1 0   22 4  o 794.8892 21.21338 123.0322       6.548541      109.4190       10.16439      132.6924       8.562376  747.8386 34.99819 824.8331 26.73008 -76.99451      44.03828 
1 1 1 0   22 5  o 1167.193 24.48152 265.5502       11.09708      0.000000       0.000000      265.5502       11.09708  ?        ?        1167.193 24.48152 0.000000       24.48152 
1 1 1 0   22 6  o 344.2327 36.45020 23.46506       4.798684      23.94020       5.953393      22.58381       8.107821  345.9261 45.41247 330.9731 65.39786 14.95300       79.61892 
1 1 1 0   22 7  f 761.9575 18.02357 112.9899       5.333342      120.1379       6.192635      92.46088       10.49459  785.4518 20.30149 685.2137 39.60659 100.2382       44.50655 
1 1 1 0   22 8  o 573.0313 25.33386 64.05914       5.637775      66.15816       6.905037      59.86182       9.764343  580.9143 30.71653 549.1227 46.21711 31.79163       55.49348 
1 1 1 0   22 9  o 910.5873 20.51637 161.5224       7.255211      160.0575       8.850630      164.5234       12.66763  905.7184 25.16245 916.0638 35.60751 -10.34540      43.60096 
1 1 1 0   22 10 o 297.1176 45.80231 17.81261       5.115141      23.14563       6.346538      7.926105       8.641147  338.5441 49.75618 215.5462 78.96687 122.9979       93.33511 
1 1 1 0   22 11 o 543.5460 28.30010 57.90221       5.953171      58.36131       7.298584      56.98962       10.29017  544.4491 34.69938 533.9924 50.20992 10.45667       61.03346 
1 1 1 0   22 12 o 517.2813 29.92247 52.52763       5.985404      51.31141       7.341809      54.93794       10.33552  509.6942 37.35084 523.6410 51.48997 -13.94681      63.61055 
1 1 1 0   22 13 o 751.9639 41.94046 111.8629       12.19902      0.000000       0.000000      111.8629       12.19902  ?        ?        751.9639 41.94046 0.000000       41.94046 
1 1 1 0   22 14 o 669.3185 31.73537 87.83348       8.249059      98.29975       11.45431      76.55634       11.88974  704.3270 42.06835 618.6514 49.91267 85.67560       65.27649 
1 1 1 0   22 15 o 353.0600 70.34851 26.24486       9.306958      26.24486       9.306958      0.000000       0.000000  353.0600 70.34851 ?        ?        0.000000       70.34851 
1 1 1 0   22 16 o 187.2847 64.58586 6.639709       5.699589      0.4793436      7.576442      14.67118       8.650866  160.2906 68.53900 262.6811 78.64785 -102.3905      104.3220 
1 1 1 0   22 17 o 739.7478 21.48861 106.9352       6.173337      107.9281       9.117213      106.0946       8.389010  740.4230 31.70693 734.8122 29.39723 5.610779       43.23802 
1 1 1 0   22 18 o 364.9165 38.73753 26.74650       5.405814      29.06887       8.096188      24.87821       7.261667  373.5267 57.66948 345.6889 56.00683 27.83783       80.38988 
1 1 1 0   22 19 o 415.4132 34.62423 34.46293       5.534956      32.40577       8.029029      36.32587       7.640626  395.2108 53.70341 421.5909 47.49434 -26.38010      71.69218 
1 1 1 0   22 20 o 209.2505 67.22400 9.301514       6.196335      -1.872727      11.82798      13.52814       7.274423  181.1212 81.21466 247.1719 71.63109 -66.05074      108.2905 
1 1 1 0   22 21 o 350.8243 40.02906 25.11187       5.356080      22.18378       7.586561      28.02164       7.562777  318.2888 63.60022 363.3500 55.34369 -45.06122      84.30843 
1 1 1 0   22 22 o 197.3546 67.08642 8.342473       6.144618      11.26098       7.538113      2.563213       10.60763  223.6631 74.29604 185.3081 80.18522 38.35495       109.3141 
1 1 1 0   22 23 o 382.5387 44.85308 30.65146       6.536923      29.78441       8.153776      32.21128       10.93643  367.6646 59.10835 366.1446 79.21406 1.519989       98.83656 
1 1 1 0   22 24 o 526.2549 29.18014 55.68700       5.940285      54.59023       8.485373      56.74112       8.318769  510.8146 43.17844 522.3772 41.34376 -11.56259      59.78029 
1 1 1 0   23 1  o 289.1981 46.72916 16.88568       5.069249      15.10918       7.747335      18.21568       6.703438  269.4228 72.46514 297.5321 60.08378 -28.10934      94.13425 
1 1 1 0   23 2  o 571.4669 26.13038 63.71735       5.799156      63.70020       9.158380      63.72882       7.492623  567.7963 41.82799 569.5828 34.02823 -1.786560      53.92125 
1 1 1 0   23 3  o 408.9675 28.69775 32.82541       4.529035      30.41202       5.975057      36.08456       6.943542  391.5857 39.84560 426.3116 42.50651 -34.72592      58.26213 
1 1 1 0   23 4  o 670.8160 20.20761 87.63819       5.264369      90.44143       7.028681      84.05627       7.945159  680.7233 26.58736 655.6212 31.20482 25.10217       40.99547 
1 1 1 0   23 5  o 319.6764 43.17620 20.46700       5.223087      20.76299       8.079158      20.25445       6.846149  315.9778 67.86398 314.3484 58.22411 1.629395       89.41794 
1 1 1 0   23 6  o 891.1994 21.36209 154.7618       7.393441      128.5298       11.43250      173.6195       9.693248  809.4935 36.36636 943.0564 26.46694 -133.5629      44.97790 
1 1 1 0   23 7  o 631.5204 23.63170 77.78259       5.795759      78.52140       7.086201      76.28968       10.07311  633.8400 28.78763 621.1362 42.00578 12.70386       50.92360 
1 1 1 0   23 8  o 274.7233 40.30925 15.15032       4.172685      16.00179       4.742396      12.23139       8.780586  281.4557 44.89552 246.9597 80.09566 34.49602       91.82005 
1 1 1 0   23 9  o 640.9861 20.77936 80.06737       5.172600      78.65396       5.901474      84.75252       10.74458  634.9316 23.93346 654.4307 42.50666 -19.49908      48.78142 
1 1 1 0   23 10 o 415.3770 29.65666 33.92367       4.752569      27.54495       5.368002      57.05522       10.22229  372.5530 37.61710 534.2178 49.84804 -161.6647      62.44896 
1 1 1 0   23 11 o 829.5704 22.12111 134.2164       7.126693      125.3129       8.484797      155.5450       13.13230  800.6708 27.28723 889.2662 38.02602 -88.59534      46.80354 
1 1 1 0   23 12 o 370.4760 35.23759 27.20063       5.008775      23.88909       5.745757      37.68266       10.22244  344.9897 43.87863 428.3412 63.36426 -83.35141      77.07375 
1 1 1 0   23 13 o 566.4121 25.66965 62.71877       5.646514      57.28506       6.559665      78.26179       11.09433  539.5250 31.44334 626.5267 45.91651 -87.00171      55.65078 
1 1 1 0   23 14 o 698.7527 22.71155 95.36715       6.163086      92.64517       7.155313      103.1910       12.13097  687.9210 26.78317 719.9766 43.59140 -32.05554      51.16199 
1 1 1 0   23 15 o 432.6836 47.84612 37.83959       7.905256      37.83959       7.905256      0.000000       0.000000  432.6836 47.84612 ?        ?        0.000000       47.84612 
1 1 1 0   23 16 o 502.8724 28.66283 49.85316       5.574457      58.93382       8.446871      42.84690       7.419597  543.0505 40.34045 462.0917 41.79755 80.95880       58.08947 
1 1 1 0   23 17 o 655.5635 23.47611 84.22018       5.976801      94.47363       8.942009      75.94040       8.035433  691.1279 33.31569 618.7017 33.56823 72.42621       47.29441 
1 1 1 0   23 18 o 368.1512 38.46850 27.32593       5.418730      18.26918       7.972836      35.10087       7.387121  287.7081 71.63290 414.3474 46.72314 -126.6393      85.52382 
1 1 1 0   23 19 o 504.0960 34.53593 50.84148       6.720270      55.05019       13.01083      49.31010       7.848224  504.3956 68.16732 493.2887 41.34922 11.10690       79.72793 
1 1 1 0   23 20 o 146.0928 58.97692 2.596634       5.166247      6.588001       7.213906      -1.605681      7.402082  189.1683 71.58987 144.0240 64.43723 45.14438       96.31857 
1 1 1 0   23 21 o 213.0062 60.52024 10.05846       5.241725      9.325378       7.198917      10.88570       7.647214  207.5072 72.52689 220.4320 74.84130 -12.92485      104.2179 
1 1 1 0   23 22 o 313.5869 52.99657 21.31569       6.224072      28.84223       7.684872      6.965429       10.61131  363.4995 56.25541 201.7908 83.35432 161.7088       100.5615 
1 1 1 0   23 23 o 299.2777 55.96005 19.90036       6.264882      19.47228       7.614493      20.79732       11.02211  286.7098 69.18079 279.7407 89.63580 6.969147       113.2279 
1 1 1 0   24 0  o 1237.579 24.08689 298.0814       11.57662      304.5405       16.08515      291.1404       16.67437  1249.644 33.14444 1221.514 35.14981 28.13013       48.31214 
1 1 1 0   24 1  o 714.2469 22.58527 99.45792       6.264721      99.86201       7.295562      98.32336       12.22448  715.1912 26.26689 704.6434 44.90565 10.54779       52.02371 
1 1 1 0   24 2  o 702.3470 28.93811 96.42248       7.893141      93.67851       10.22897      100.4610       12.40957  689.5336 38.35029 712.1987 45.09992 -22.66504      59.20090 
1 1 1 0   24 3  o 409.5202 35.45983 33.13095       5.583834      37.48745       9.035211      30.43884       7.102563  430.8905 55.26760 389.5894 47.95649 41.30106       73.17330 
1 1 1 0   24 4  f 612.4253 26.11169 73.23129       6.210350      67.52998       9.711221      77.17628       8.078094  583.8176 43.13752 626.7661 33.30713 -42.94843      54.49963 
1 1 1 0   24 5  o 114.7213 50.59139 -1.178816      4.399292      -2.148663      5.717319      0.2288791      6.888035  127.1584 56.77993 153.3615 65.45780 -26.20313      86.65266 
1 1 1 0   24 6  o 901.1668 18.45040 158.1395       6.457122      148.5830       8.583664      170.5971       9.800302  872.4199 25.33490 934.4784 27.00488 -62.05853      37.02864 
1 1 1 0   24 7  o 943.8255 20.44234 173.5913       7.492907      163.7107       8.853043      198.5423       14.06846  915.7860 24.89262 1005.623 36.02328 -89.83728      43.78720 
1 1 1 0   24 8  o 1098.528 17.02056 234.9231       7.261272      229.0863       8.166566      256.9578       15.86737  1084.384 19.39226 1143.952 35.71651 -59.56812      40.64147 
1 1 1 0   24 9  o 203.2811 53.70332 8.529924       4.303025      10.16535       4.892663      2.945104       9.041368  221.3996 56.66590 187.5120 77.14288 33.88765       95.71859 
1 1 1 0   24 10 o 222.1489 52.98735 10.22382       4.507283      13.89709       5.166877      -1.470975      9.219300  259.5679 53.04786 167.6407 73.60538 91.92720       90.72942 
1 1 1 0   24 11 o 315.6852 39.21603 19.94647       4.704213      18.56203       5.380986      24.43519       9.689137  302.2949 47.39369 338.8183 75.56008 -36.52344      89.19353 
1 1 1 0   24 12 o 442.6297 30.42476 38.61985       5.198167      38.28108       6.058493      39.56507       10.11996  439.4171 35.81409 438.5212 61.08237 0.8959656      70.80753 
1 1 1 0   24 13 o 461.2038 30.33383 41.95886       5.402792      49.20778       6.380504      23.59214       10.15627  498.8941 33.12029 329.3361 80.16388 169.5580       86.73639 
1 1 1 0   24 14 o 413.2954 54.30257 35.06375       8.504863      35.06375       8.504863      0.000000       0.000000  413.2954 54.30257 ?        ?        0.000000       54.30257 
1 1 1 0   24 15 o 353.3008 41.00176 25.18952       5.521082      29.94031       6.452665      12.20691       10.66688  384.5221 44.00278 245.8838 88.06105 138.6384       98.44284 
1 1 1 0   24 16 o 324.1915 50.39731 21.76378       6.138999      30.85402       7.757988      6.537076       10.04071  385.9086 53.17747 208.1871 82.84274 177.7215       98.44167 
1 1 1 0   24 17 o 363.9746 37.96619 26.73199       5.287572      28.57385       7.546743      24.95596       7.410628  369.6023 54.18627 343.4183 57.60519 26.18393       79.08546 
1 1 1 0   24 18 o 181.5141 65.14748 6.361022       5.840983      2.459771       10.60499      8.059830       6.998103  188.3803 80.83328 200.2402 71.36823 -11.85989      107.8306 
1 1 1 0   24 19 o 519.0358 32.50235 53.95281       6.518458      48.19204       11.32917      56.80369       7.969810  470.9625 63.56578 529.1010 39.06279 -58.13843      74.60905 
1 1 1 0   24 20 o 202.3960 60.14243 9.051867       5.072965      2.608464       7.151917      15.57640       7.196804  161.2070 67.65070 259.8347 69.82475 -98.62762      97.22198 
1 1 1 0   24 21 o 156.0435 62.26007 3.742642       5.685167      4.064652       7.024693      3.131328       9.678865  167.2732 68.31108 178.7434 76.97012 -11.47015      102.9116 
1 1 1 0   24 22 o 185.5210 65.80215 7.497803       5.942197      8.977245       7.284738      4.556054       10.27230  200.0979 72.62632 185.9482 79.66601 14.14972       107.8019 
1 1 1 0   25 1  o 304.3748 39.55097 18.52260       4.564651      20.95069       5.930336      14.99282       7.150241  321.7453 49.00952 267.5286 68.51955 54.21671       84.24287 
1 1 1 0   25 2  o 1286.315 17.30277 322.1162       8.643532      322.5349       11.80999      321.6333       12.68440  1285.714 23.65250 1283.430 25.44893 2.283936       34.74319 
1 1 1 0   25 3  o 474.1574 31.44331 44.22018       5.757153      38.87820       6.588037      61.48170       11.84253  442.9585 38.68516 552.6144 55.95280 -109.6560      68.02395 
1 1 1 0   25 4  o 1052.036 21.01332 215.7522       8.585253      215.6669       14.01627      215.8035       10.86116  1048.392 34.42555 1050.924 26.61195 -2.532104      43.51223 
1 1 1 0   25 5  o 533.5651 30.81924 55.93797       6.358932      52.43779       9.667071      58.60760       8.442569  511.8601 49.23879 543.9776 40.24941 -32.11746      63.59618 
1 1 1 0   25 6  o 827.4172 22.83133 133.5861       7.336411      131.7658       11.73122      134.7552       9.401748  818.5618 36.90317 829.7557 29.17631 -11.19391      47.04360 
1 1 1 0   25 7  o 231.0461 49.43887 10.99679       4.301980      6.011186       4.838560      29.80936       9.398996  177.5252 59.53525 378.9412 66.28163 -201.4160      89.09377 
1 1 1 0   25 8  o 133.4347 54.01545 1.637548       4.346480      1.380582       4.945924      2.509063       9.108499  138.5046 57.02742 185.1747 76.91807 -46.67014      95.75237 
1 1 1 0   25 9  o 353.6533 40.71637 25.03337       5.490007      22.44293       6.584722      30.94003       9.943086  331.1711 52.98469 384.1996 69.18465 -53.02856      87.14294 
1 1 1 0   25 10 o 714.2996 20.67092 99.57772       5.734138      99.28450       6.505948      100.5983       12.13756  712.7189 23.50522 710.2761 44.22173 2.442810       50.08050 
1 1 1 0   25 11 o 477.1184 27.98103 44.80130       5.161953      50.69778       5.952857      26.92838       10.36398  507.0610 30.36974 352.8515 77.73109 154.2095       83.45325 
1 1 1 0   25 12 o 231.5200 55.30464 11.27191       4.904327      9.057046       5.626847      18.27323       10.00417  208.7428 63.63990 288.3696 84.12735 -79.62672      105.4867 
1 1 1 0   25 13 o 153.3230 61.87875 2.572209       5.685457      2.572209       5.685457      0.000000       0.000000  153.3230 61.87875 ?        ?        0.000000       61.87875 
1 1 1 0   25 14 o 346.8299 41.47343 24.36693       5.475377      27.72357       6.410586      15.31398       10.52787  368.6690 45.75862 264.4166 87.80052 104.2525       99.00900 
1 1 1 0   25 15 o 346.3789 41.91554 24.40098       5.523638      23.64587       6.533408      26.29332       10.34269  337.1250 51.53947 341.9317 79.40856 -4.806671      94.66804 
1 1 1 0   25 16 o 534.7532 31.64466 56.91652       6.542515      53.52822       7.950489      64.02404       11.51495  514.7563 40.08689 554.7297 54.14076 -39.97339      67.36602 
1 1 1 0   25 17 o 308.2200 62.91737 20.79358       7.276284      23.03994       10.04141      18.30993       10.55849  314.0227 81.59609 278.1384 87.58228 35.88428       119.7020 
1 1 1 0   25 18 o 271.2567 52.74627 15.81007       5.356402      14.34530       8.305607      16.85309       7.008657  248.5429 77.58375 273.3460 66.62849 -24.80310      102.2673 
1 1 1 0   25 19 o 249.0891 53.70653 13.55599       5.042405      3.468311       6.976188      24.59184       7.296678  164.4004 67.71342 334.9082 58.21416 -170.5078      89.29724 
1 1 1 0   25 20 o 215.7531 64.39570 10.68265       5.806328      9.146374       6.945732      14.24728       10.58012  202.2785 71.20653 240.4998 87.48917 -38.22134      112.8039 
1 1 1 0   25 21 o 187.3533 63.59068 7.819748       5.520853      4.481549       6.771499      14.43818       9.534683  166.5423 67.41946 239.2780 83.47694 -72.73567      107.3023 
1 1 1 0   26 0  o 1018.428 25.79166 202.0641       10.20087      210.9549       13.95639      191.8665       14.94692  1039.229 34.58070 990.3290 38.86370 48.90021       52.02127 
1 1 1 0   26 1  o 247.9752 49.94389 12.64825       4.643383      19.36076       6.074796      3.214851       7.201502  307.5459 52.76170 173.3291 69.75108 134.2169       87.45862 
1 1 1 0   26 2  o 341.9718 37.03222 23.27883       4.839538      27.29652       6.317683      17.57310       7.528791  368.6110 45.07171 288.6841 68.23312 79.92691       81.77541 
1 1 1 0   26 3  o 825.2789 19.79966 132.7840       6.345801      131.5819       8.445215      134.3429       9.617211  820.2307 26.51226 827.9822 29.90888 -7.751526      39.96800 
1 1 1 0   26 4  f 632.3126 22.74621 78.05972       5.585587      77.43651       7.249666      78.97002       8.761887  628.5815 29.69808 632.4821 35.81860 -3.900574      46.52900 
1 1 1 0   26 5  o 237.6892 60.95787 11.83927       5.653890      7.400828       6.312031      29.85536       12.71698  197.4352 67.97411 369.4804 89.55945 -172.0452      112.4339 
1 1 1 0   26 6  o 436.7849 36.42534 37.85758       6.122374      49.18938       9.473690      29.73099       8.022761  493.9358 50.08030 380.9324 55.89343 113.0034       75.04740 
1 1 1 0   26 7  o 570.5069 26.61611 63.74310       5.897031      60.30022       6.958467      72.51727       11.10851  552.7995 32.55664 601.0257 47.99230 -48.22620      57.99306 
1 1 1 0   26 8  o 141.5631 57.90976 1.713596       5.059094      1.204105       5.984789      2.989134       9.469498  148.0565 61.99494 188.9422 78.45065 -40.88571      99.98938 
1 1 1 0   26 9  o 299.3311 47.64153 18.34301       5.352544      11.13449       6.242371      38.35978       10.40216  229.5385 66.30781 428.3453 64.53477 -198.8068      92.52817 
1 1 1 0   26 10 o 265.7769 55.63735 14.82902       5.558419      11.97104       6.666255      21.34902       10.06878  236.9133 68.54643 310.5787 82.19673 -73.66547      107.0276 
1 1 1 0   26 11 o 117.3187 53.66463 -3.233639      5.482450      -5.608792      6.713202      1.522621       9.499848  122.6735 57.24754 180.1680 76.88534 -57.49451      95.85737 
1 1 1 0   26 12 f 157.4289 61.39320 3.534348       5.416839      3.534348       5.416839      0.000000       0.000000  157.4289 61.39320 ?        ?        0.000000       61.39320 
1 1 1 0   26 13 o 350.6524 39.01650 24.85170       5.223071      29.86426       6.060335      10.37701       10.29844  383.8948 41.29929 230.4112 85.88042 153.4836       95.29469 
1 1 1 0   26 14 o 788.7322 24.34807 122.3227       7.457996      130.2016       9.257544      107.7539       12.58856  811.4343 29.37747 728.3817 44.71928 83.05267       53.50561 
1 1 1 0   26 15 o 593.6628 28.92536 69.79166       6.668784      78.14809       8.204989      53.52708       11.44694  625.0814 33.92682 501.4710 59.96760 123.6103       68.89951 
1 1 1 0   26 16 o 175.6235 65.29341 5.744427       5.945364      5.971659       7.276158      5.287933       10.31299  184.5418 71.37953 197.2620 81.88470 -12.72017      108.6285 
1 1 1 0   26 17 o 132.5579 58.01150 -0.1470231     5.685458      5.838864       6.931185      -12.45800      9.940073  180.2521 69.68185 131.8405 63.74559 48.41162       94.44077 
1 1 1 0   26 18 f 242.5816 57.14048 13.10174       5.294392      10.93818       6.130089      19.45382       10.50365  218.6341 66.37355 277.1598 87.36470 -58.52570      109.7180 
1 1 1 0   26 19 o 363.0186 40.94081 27.45012       5.671022      23.75563       6.613335      37.71441       11.02321  329.8356 53.45891 399.0601 73.84809 -69.22446      91.16685 
1 1 1 0   26 20 o 334.3634 81.48763 28.24188       10.48467      0.000000       0.000000      28.24188       10.48467  ?        ?        334.3634 81.48763 0.000000       81.48763 
1 1 1 0   27 1  o 348.3801 58.69494 25.17293       7.658843      0.000000       0.000000      25.17293       7.658843  ?        ?        348.3801 58.69494 0.000000       58.69494 
1 1 1 0   27 2  o 429.5867 30.88991 36.45259       5.119015      45.79912       6.733262      23.65137       7.879998  480.2959 36.36816 335.9278 62.70845 144.3681       72.49133 
1 1 1 0   27 3  o 661.2606 22.63305 85.47612       5.812242      83.56245       7.543122      88.27272       9.118709  652.2305 29.77982 667.9347 35.27885 -15.70422      46.16747 
1 1 1 0   27 4  o 435.5764 30.66162 37.48393       5.153567      34.30492       6.590095      42.48877       8.268767  413.5925 41.59299 458.7920 47.07542 -45.19955      62.81777 
1 1 1 0   27 5  o 386.0170 34.70774 29.64574       5.147461      25.04366       6.505183      37.35310       8.418505  350.1954 49.18863 427.9241 51.70549 -77.72873      71.36510 
1 1 1 0   27 6  o 427.9450 33.10633 36.33403       5.459278      29.66220       6.808660      48.34587       9.135740  382.2018 46.85241 488.3859 48.82144 -106.1841      67.66595 
1 1 1 0   27 7  o 546.2563 34.83797 59.24495       7.352031      59.24495       7.352031      0.000000       0.000000  546.2563 34.83797 ?        ?        0.000000       34.83797 
1 1 1 0   27 8  o 248.7034 54.95726 13.04465       5.166666      12.84789       6.011411      13.60088       10.10742  244.9132 62.87999 253.2794 86.04166 -8.366257      106.5695 
1 1 1 0   27 9  o 347.2339 40.99025 24.39478       5.420947      24.46998       6.325419      24.18679       10.51998  345.0658 48.54411 328.0652 82.61860 17.00058       95.82465 
1 1 1 0   27 10 o 239.7353 57.32549 12.27210       5.265008      14.41744       6.129461      6.234573       10.28262  258.7065 61.84679 207.4928 83.40075 51.21373       103.8302 
1 1 1 0   27 11 o 507.4167 35.53439 51.48784       6.958119      51.48784       6.958119      0.000000       0.000000  507.4167 35.53439 ?        ?        0.000000       35.53439 
1 1 1 0   27 12 o 597.5531 33.28719 71.20610       7.694031      66.29308       10.11340      77.95688       11.85495  569.6877 46.10761 615.4042 50.03664 -45.71655      68.04099 
1 1 1 0   27 13 o 104.0285 49.64473 -6.628479      5.595053      -0.6994873     6.830516      -18.71895      9.754043  143.0281 63.05877 118.8457 58.63842 24.18236       86.10966 
1 1 1 0   27 14 o 149.2729 61.33175 2.398899       5.705772      -2.178887      6.887775      12.41083       10.18615  136.0369 61.40107 236.8619 85.89378 -100.8250      105.5833 
1 1 1 0   27 15 o 313.7175 59.04399 21.55369       6.929559      16.05706       9.465208      27.90280       10.17275  259.0361 83.07088 344.7044 77.83308 -85.66833      113.8365 
1 1 1 0   27 16 o 208.0590 69.36568 9.707667       6.568649      1.169031       8.531176      22.14002       10.29417  163.3917 71.29495 298.4284 84.81987 -135.0368      110.8033 
1 1 1 0   27 17 o 161.6466 62.28262 4.668108       5.523056      9.642198       6.532767      -7.796485      10.34140  205.9781 69.17698 144.8797 68.66738 61.09839       97.47135 
1 1 1 0   27 18 o 129.5233 55.55931 0.8504204      5.007055      -1.494576      5.846815      7.300533       9.696878  125.4727 56.60773 196.9190 80.32022 -71.44631      98.26379 
1 1 1 0   28 0  o 254.4221 67.78643 13.48707       6.818348      28.83442       9.025279      -6.918493      10.40682  374.4016 64.39367 159.3259 73.26737 215.0757       97.54308 
1 1 1 0   28 1  o 776.1172 20.68457 117.7688       6.234502      115.1307       8.241918      121.2972       9.531929  765.2934 27.73143 784.2108 31.29825 -18.91736      41.81641 
1 1 1 0   28 2  o 209.5206 57.04465 9.274286       4.766500      2.850906       6.121692      19.16452       7.596139  159.1127 64.21112 298.1844 67.20500 -139.0717      92.94934 
1 1 1 0   28 3  o 394.2705 33.81688 30.96815       5.127813      30.95854       6.583492      30.98298       8.176228  390.7937 44.15348 386.1111 56.17422 4.682678       71.44979 
1 1 1 0   28 4  o 619.1883 23.83008 75.16447       5.730285      66.39352       7.329020      88.95887       9.191236  578.6190 32.74995 668.8457 35.51232 -90.22675      48.30822 
1 1 1 0   28 5  o 97.54834 46.36426 -5.597766      4.779741      -0.4592636     6.123215      -13.61218      7.647106  138.6192 60.44564 109.6992 53.67741 28.92008       80.83898 
1 1 1 0   28 6  o 201.8080 58.72612 8.611300       4.880422      9.084663       6.154710      7.809502       8.010184  208.4640 67.00061 205.1930 75.88676 3.270966       101.2318 
1 1 1 0   28 7  o 579.3840 27.94068 66.15749       6.286826      58.25713       7.437524      85.92975       11.76612  540.1095 35.65902 650.1873 46.91303 -110.0778      58.92706 
1 1 1 0   28 8  o 244.1509 64.36058 12.98622       6.189022      12.98622       6.189022      0.000000       0.000000  244.1509 64.36058 ?        ?        0.000000       64.36058 
1 1 1 0   28 9  o 252.1440 50.79297 13.42821       4.801759      9.117311       5.251283      35.42293       11.86153  206.1841 61.17260 395.8980 79.90321 -189.7139      100.6311 
1 1 1 0   28 10 o 271.2153 52.58845 15.61908       5.339093      15.61908       5.339093      0.000000       0.000000  271.2153 52.58845 ?        ?        0.000000       52.58845 
1 1 1 0   28 11 f 163.1274 61.45243 4.622149       5.300503      5.654911       6.324189      2.183856       9.717348  177.6786 67.08075 180.0628 77.32349 -2.384171      102.3658 
1 1 1 0   28 12 o 232.9910 59.88390 11.97518       5.448064      8.633459       6.492238      19.93065       10.01711  201.3265 68.95542 288.4420 84.19130 -87.11549      108.8257 
1 1 1 0   28 13 o 337.9694 43.84955 23.75735       5.619694      22.24450       6.716026      27.29010       10.26294  320.4427 56.00662 339.3959 79.29413 -18.95325      97.07883 
1 1 1 0   28 14 o 309.0496 57.88905 21.01735       6.692559      23.82556       9.013075      17.56613       9.991834  318.1153 74.30007 266.3696 85.34296 51.74570       113.1544 
1 1 1 0   28 15 o 337.8567 55.98116 25.02562       7.088008      9.183324       9.384808      46.06223       10.81444  208.6523 80.96455 453.9400 63.04703 -245.2878      102.6167 
1 1 1 0   28 16 o 220.2309 61.30561 11.11634       5.436215      9.476523       6.484323      14.99505       9.972645  203.6413 68.91740 244.0105 85.35883 -40.36925      109.7075 
1 1 1 0   29 1  o 139.3656 55.93929 2.257665       4.618888      -1.431891      6.085964      7.269721       7.093331  132.5025 58.91359 195.9770 71.58398 -63.47443      92.70963 
1 1 1 0   29 2  f 611.1841 23.52054 73.34853       5.582740      70.43229       7.451577      77.07983       8.428801  595.1461 32.36176 621.4199 35.06959 -26.27374      47.71959 
1 1 1 0   29 3  o 531.1225 26.39761 55.56423       5.444867      54.88808       7.271432      56.42724       8.215033  523.5737 35.97975 528.8887 40.29933 -5.315063      54.02387 
1 1 1 0   29 4  o 346.0560 35.99518 24.12592       4.766685      18.93772       6.193528      31.66388       7.465466  298.7613 55.42150 390.7614 50.36705 -92.00015      74.88914 
1 1 1 0   29 5  o 445.6852 30.52758 39.52999       5.251994      37.49342       6.901427      42.33229       8.095551  429.4261 41.91756 454.2223 46.55091 -24.79623      62.64239 
1 1 1 0   29 6  o 393.4775 32.98476 31.00833       4.993852      34.72131       6.492565      25.62945       7.814487  413.2148 41.00002 345.3037 60.47738 67.91110       73.06514 
1 1 1 0   29 7  o 328.7901 42.59600 22.21326       5.311115      21.21563       6.266810      24.75652       10.00593  316.7175 52.80988 327.5276 79.47313 -10.81003      95.41940 
1 1 1 0   29 8  o 215.8002 52.56439 10.02726       4.364472      11.20997       4.844783      4.933981       10.05385  227.4009 55.37589 194.9344 80.87823 32.46651       98.01926 
1 1 1 0   29 9  f 118.6980 52.76709 -1.081961      4.880356      -1.081961      4.880356      0.000000       0.000000  118.6980 52.76709 ?        ?        0.000000       52.76709 
1 1 1 0   29 10 o 630.1484 25.28472 78.52948       6.187697      78.52948       6.187697      0.000000       0.000000  630.1484 25.28472 ?        ?        0.000000       25.28472 
1 1 1 0   29 11 o 336.3546 37.54034 23.16843       4.820047      26.70361       5.471482      10.91769       10.18546  360.2628 39.77027 223.9340 84.98946 136.3288       93.83434 
1 1 1 0   29 12 o 174.4086 57.78216 6.477709       4.560616      5.519122       5.250305      9.424270       9.205054  167.9428 61.54934 210.8875 80.61430 -42.94470      101.4248 
1 1 1 0   29 13 o 131.5499 56.90786 0.5152022      5.339951      1.866201       6.579692      -2.091763      9.139991  150.7601 64.15237 153.4567 69.84413 -2.696579      94.83528 
1 1 1 0   29 14 o 139.1674 59.17516 1.448833       5.590728      -1.653921      6.936046      7.203494       9.446005  135.8273 61.43267 196.1067 79.54402 -60.27940      100.5049 
1 1 1 0   30 0  o 160.6318 65.65517 2.374849       6.496070      -4.377229      8.587761      11.40572       9.931757  148.5985 67.65939 241.2175 85.12266 -92.61897      108.7366 
1 1 1 0   30 1  o 318.3001 39.77834 20.73710       4.809770      24.54443       6.291334      15.38181       7.461457  342.6114 48.65044 260.3087 71.57970 82.30267       86.54779 
1 1 1 0   30 2  o 409.8596 31.15497 33.60896       4.921834      43.97535       6.707108      21.51310       7.245024  466.2711 37.35343 313.6899 61.67019 152.5811       72.10056 
1 1 1 0   30 3  o 98.90377 46.48727 -4.257023      4.561947      -6.871789      5.995626      -0.6618743     7.030345  107.8586 51.44999 144.4805 63.82264 -36.62194      81.97823 
1 1 1 0   30 4  f 352.2806 35.51583 25.13714       4.792611      28.18396       6.334083      21.05686       7.330018  368.7252 45.17884 308.8043 63.24898 59.92093       77.72748 
1 1 1 0   30 5  o 221.6150 55.50391 10.72421       4.766579      15.12932       6.291540      4.789070       7.302873  260.5566 62.89331 176.3959 70.50259 84.16074       94.47849 
1 1 1 0   30 6  o 341.0294 37.39476 23.73545       4.871330      24.28990       6.342005      22.93762       7.607611  339.0564 49.63427 321.6285 63.16079 17.42792       80.32961 
1 1 1 0   30 7  o 132.2322 58.27579 -0.4791305     5.827904      -0.4791305     5.827904      0.000000       0.000000  132.2322 58.27579 ?        ?        0.000000       58.27579 
1 1 1 0   30 8  o 131.9195 55.52611 1.260124       4.841502      1.260124       4.841502      0.000000       0.000000  131.9195 55.52611 ?        ?        0.000000       55.52611 
1 1 1 0   30 9  o 246.4858 47.96921 13.04118       4.426563      16.62450       5.063417      1.423662       9.117125  278.7782 48.53202 168.3724 73.57906 110.4058       88.14326 
1 1 1 0   30 10 o 422.2483 29.07108 35.78921       4.738084      34.13482       5.362264      41.68031       10.11877  409.8905 33.99299 432.7104 61.98547 -22.81989      70.69456 
1 1 1 0   30 11 o 202.5480 56.09593 9.175954       4.563773      14.72549       5.232460      -8.469057      9.330152  258.3168 53.90137 134.6406 64.21334 123.6762       83.83741 
1 1 1 0   31 1  o 420.2196 31.54786 35.54970       5.110847      45.00527       6.818521      23.42554       7.720972  469.6450 37.70238 323.1370 63.79010 146.5080       74.09890 
1 1 1 0   31 2  o 372.0904 34.67577 28.12869       4.953036      25.06901       6.547404      32.22240       7.573368  342.7137 50.72595 388.7524 51.42587 -46.03873      72.23394 
1 1 1 0   31 3  o 425.9061 30.72990 36.47145       5.048663      40.51749       6.744094      31.31338       7.614690  444.1971 39.50729 382.1204 52.71626 62.07675       65.87739 
1 1 1 0   31 4  o 127.4991 53.62928 1.175622       4.511436      -5.997406      5.912685      11.17050       6.979467  108.7677 51.65901 220.3121 71.40540 -111.5443      88.13276 
1 1 1 0   31 5  o 198.5398 57.32438 8.758832       4.666556      10.24339       6.135495      6.721416       7.187721  212.0889 66.76035 185.9162 71.19562 26.17273       97.60000 
1 1 1 0   31 6  o 392.2162 37.95639 31.60682       5.709163      31.12425       6.456700      33.33637       12.22349  385.7065 43.88619 363.3039 87.64589 22.40256       98.01938 
1 1 1 0   31 7  o 512.1056 35.06429 53.36735       6.931553      53.36735       6.931553      0.000000       0.000000  512.1056 35.06429 ?        ?        0.000000       35.06429 
1 1 1 0   31 8  o 210.1256 52.70359 9.779867       4.293259      10.89206       4.825292      5.554252       9.405427  220.3818 56.20359 187.7730 78.09320 32.60878       96.21534 
1 1 1 1   0  0  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   0  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   0  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   0  3  o 720.5895 14.13609 101.0741       3.952464      101.0741       3.952464      101.0741       3.952464  720.5895 14.13609 720.5895 14.13609 0.000000       0.000000 
1 1 1 1   0  4  o 299.0929 15.20250 17.52717       1.755420      17.52717       1.755420      17.52717       1.755420  299.0929 15.20250 299.0929 15.20250 0.000000       0.000000 
1 1 1 1   0  5  o 896.5357 15.53069 156.3855       5.403714      156.3855       5.403714      156.3855       5.403714  896.5357 15.53069 896.5357 15.53069 0.000000       0.000000 
1 1 1 1   0  6  o 520.4487 15.42876 52.77957       3.112236      52.77957       3.112236      52.77957       3.112236  520.4487 15.42876 520.4487 15.42876 0.000000       0.000000 
1 1 1 1   0  7  o 1710.665 21.09605 569.2045       14.01023      569.2045       14.01023      569.2045       14.01023  1710.665 21.09605 1710.665 21.09605 0.000000       0.000000 
1 1 1 1   0  8  o 1074.252 17.42522 224.4235       7.265319      224.4235       7.265319      224.4235       7.265319  1074.252 17.42522 1074.252 17.42522 0.000000       0.000000 
1 1 1 1   0  9  f 802.4196 17.11112 125.2803       5.326746      125.2803       5.326746      125.2803       5.326746  802.4196 17.11112 802.4196 17.11112 0.000000       0.000000 
1 1 1 1   0  10 o 94.41518 50.49530 2.489808       2.531136      2.489808       2.531136      2.489808       2.531136  94.41518 50.49530 94.41518 50.49530 0.000000       0.000000 
1 1 1 1   0  11 o 1350.084 19.65445 354.5216       10.30011      354.5216       10.30011      354.5216       10.30011  1350.084 19.65445 1350.084 19.65445 0.000000       0.000000 
1 1 1 1   0  12 o 373.2126 25.51118 27.47721       3.657891      27.47721       3.657891      27.47721       3.657891  373.2126 25.51118 373.2126 25.51118 0.000000       0.000000 
1 1 1 1   0  13 o 1233.495 19.74531 296.1009       9.453188      296.1009       9.453188      296.1009       9.453188  1233.495 19.74531 1233.495 19.74531 0.000000       0.000000 
1 1 1 1   0  14 o 785.0339 20.07701 120.1300       6.111854      120.1300       6.111854      120.1300       6.111854  785.0339 20.07701 785.0339 20.07701 0.000000       0.000000 
1 1 1 1   0  15 o 440.6990 37.28452 38.81234       6.276062      38.81234       6.276062      38.81234       6.276062  440.6990 37.28452 440.6990 37.28452 0.000000       0.000000 
1 1 1 1   0  16 o 180.6596 64.71665 8.524418       4.149502      8.524418       4.149502      8.524418       4.149502  180.6596 64.71665 180.6596 64.71665 0.000000       0.000000 
1 1 1 1   0  17 o 508.7936 27.11396 50.93858       5.322750      50.93858       5.322750      50.93858       5.322750  508.7936 27.11396 508.7936 27.11396 0.000000       0.000000 
1 1 1 1   0  18 o 675.5405 24.57680 89.29623       6.428338      89.29623       6.428338      89.29623       6.428338  675.5405 24.57680 675.5405 24.57680 0.000000       0.000000 
1 1 1 1   0  19 o 189.2596 86.63997 10.45231       6.946658      10.45231       6.946658      10.45231       6.946658  189.2596 86.63997 189.2596 86.63997 0.000000       0.000000 
1 1 1 1   0  20 f 202.0983 73.31787 10.70553       5.286856      10.70553       5.286856      10.70553       5.286856  202.0983 73.31787 202.0983 73.31787 0.000000       0.000000 
1 1 1 1   0  21 o 1471.148 23.41328 421.5157       13.36899      421.5157       13.36899      421.5157       13.36899  1471.148 23.41328 1471.148 23.41328 0.000000       0.000000 
1 1 1 1   0  22 o 320.3699 53.63211 21.71062       6.110642      21.71062       6.110642      21.71062       6.110642  320.3699 53.63211 320.3699 53.63211 0.000000       0.000000 
1 1 1 1   0  23 o 725.8637 28.35810 103.0890       7.966217      103.0890       7.966217      103.0890       7.966217  725.8637 28.35810 725.8637 28.35810 0.000000       0.000000 
1 1 1 1   0  24 o 532.9892 35.65845 56.20368       7.305073      56.20368       7.305073      56.20368       7.305073  532.9892 35.65845 532.9892 35.65845 0.000000       0.000000 
1 1 1 1   0  25 o 218.6264 86.11623 13.10102       7.021246      13.10102       7.021246      13.10102       7.021246  218.6264 86.11623 218.6264 86.11623 0.000000       0.000000 
1 1 1 1   0  26 o 422.6062 48.59088 36.48906       7.701200      36.48906       7.701200      36.48906       7.701200  422.6062 48.59088 422.6062 48.59088 0.000000       0.000000 
1 1 1 1   0  27 f 610.0472 37.52447 73.75163       8.813020      73.75163       8.813020      73.75163       8.813020  610.0472 37.52447 610.0472 37.52447 0.000000       0.000000 
1 1 1 1   0  28 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   0  29 o 281.2327 113.8387 23.37478       12.16080      23.37478       12.16080      23.37478       12.16080  281.2327 113.8387 281.2327 113.8387 0.000000       0.000000 
1 1 1 1   0  30 o 162.0760 88.56673 8.221294       7.946134      8.221294       7.946134      8.221294       7.946134  162.0760 88.56673 162.0760 88.56673 0.000000       0.000000 
1 1 1 1   0  31 o 238.5183 114.7349 19.59468       12.29780      19.59468       12.29780      19.59468       12.29780  238.5183 114.7349 238.5183 114.7349 0.000000       0.000000 
1 1 1 1   0  32 o 79.67184 57.23446 -12.41158      8.526484      -12.41158      8.526484      -12.41158      8.526484  79.67184 57.23446 79.67184 57.23446 0.000000       0.000000 
1 1 1 1   0  33 f 95.87483 66.71040 -5.311503      8.848740      -5.311503      8.848740      -5.311503      8.848740  95.87483 66.71040 95.87483 66.71040 0.000000       0.000000 
1 1 1 1   0  34 o 243.1051 117.3569 24.21090       12.87778      24.21090       12.87778      24.21090       12.87778  243.1051 117.3569 243.1051 117.3569 0.000000       0.000000 
1 1 1 1   1  0  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   1  1  o 16.28409 7.240062 -0.3590539E-01 0.9190794E-01 0.6373555E-01  0.9645120E-01 -1.019439      0.3030285 21.75187 8.266857 17.94607 9.065057 3.805796       12.26850 
1 1 1 1   1  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   1  3  o 503.7794 11.11982 49.35744       2.175536      50.53233       2.662755      46.99852       3.773020  509.5566 13.45584 490.7686 19.79631 18.78793       23.93645 
1 1 1 1   1  4  o 675.3083 14.33103 88.74880       3.758438      88.74880       3.758438      0.000000       0.000000  675.3083 14.33103 ?        ?        0.000000       14.33103 
1 1 1 1   1  5  o 1375.324 12.96510 367.8228       6.924825      360.2687       9.557017      376.1725       10.04777  1360.194 18.09229 1389.776 18.61644 -29.58276      25.95964 
1 1 1 1   1  6  o 756.9667 10.91437 111.3526       3.208509      113.6640       4.605290      109.1725       4.472651  764.4695 15.51204 749.2240 15.37182 15.24554       21.83841 
1 1 1 1   1  7  o 1151.004 12.33008 257.4558       5.511514      254.7528       7.739592      260.2368       7.850506  1144.487 17.41323 1156.733 17.47578 -12.24609      24.67029 
1 1 1 1   1  8  o 1268.718 12.97808 312.7965       6.394459      312.0846       9.016286      313.5169       9.070218  1266.791 18.32715 1269.687 18.39471 -2.896606      25.96632 
1 1 1 1   1  9  o 566.2597 12.49800 62.30509       2.748428      65.27996       3.920858      59.43119       3.853739  579.4355 17.42401 552.8469 17.94938 26.58862       25.01552 
1 1 1 1   1  10 o 906.0248 12.50551 159.5078       4.400171      153.7213       6.113678      165.7267       6.337942  889.1264 17.70562 923.1957 17.67773 -34.06927      25.01981 
1 1 1 1   1  11 f 577.4675 13.70047 64.81285       3.072493      61.34949       4.311474      68.38661       4.379651  561.5416 19.77042 592.9166 19.02033 -31.37494      27.43433 
1 1 1 1   1  12 o 605.2297 14.16556 71.20985       3.329523      69.83469       4.666842      72.63543       4.751615  599.0096 20.06141 610.9056 20.02807 -11.89606      28.34755 
1 1 1 1   1  13 o 1117.129 13.77161 242.6454       5.974697      242.9734       8.449821      242.3176       8.449174  1117.154 19.47630 1115.642 19.50121 1.512451       27.56127 
1 1 1 1   1  14 o 463.5914 20.70320 41.88652       3.727356      39.24281       4.522834      47.48311       6.580599  447.4829 26.13961 490.7586 34.75260 -43.27570      43.48589 
1 1 1 1   1  15 o 544.0975 23.93062 57.82898       5.056602      63.93113       7.444474      52.60211       6.889910  569.4310 33.81564 516.1459 34.57249 53.28510       48.36067 
1 1 1 1   1  16 o 459.5264 22.38033 41.24221       3.993970      49.82657       7.034272      37.15813       4.851907  501.4608 36.36778 434.4058 28.92537 67.05499       46.46819 
1 1 1 1   1  17 o 317.2430 27.06033 19.84785       3.302026      18.32193       4.724427      21.30513       4.616966  301.5475 41.43795 326.6598 37.04956 -25.11221      55.58574 
1 1 1 1   1  18 o 518.8062 23.10190 52.55951       4.654583      51.40844       7.940763      53.16202       5.745030  508.6091 40.53891 520.2418 28.54445 -11.63266      49.58013 
1 1 1 1   1  19 o 669.1105 25.43984 87.44197       6.610590      99.64393       9.479115      75.88876       9.223687  712.5936 34.25294 619.8814 38.50533 92.71222       51.53566 
1 1 1 1   1  20 o 361.5044 33.03162 25.79550       4.586127      29.77919       5.572983      17.43816       8.071959  387.7886 37.47232 288.4836 72.21620 99.30505       81.35941 
1 1 1 1   1  21 f 550.1456 21.52881 58.95056       4.599658      54.83247       6.461451      63.18131       6.549236  528.7191 31.61346 567.9812 29.79522 -39.26215      43.44153 
1 1 1 1   1  22 o 1440.481 16.77144 403.5936       9.382230      407.9223       13.38620      399.4138       13.15381  1446.948 23.82190 1431.812 23.65580 15.13623       33.57201 
1 1 1 1   1  23 o 409.9869 29.15214 32.96973       4.611358      29.74890       6.499447      36.23454       6.543669  386.7387 44.06092 428.1385 39.81191 -41.39981      59.38310 
1 1 1 1   1  24 o 516.7620 25.74873 52.09032       5.167427      49.39179       7.369293      54.70069       7.247910  500.4214 38.20820 527.2925 35.60283 -26.87109      52.22478 
1 1 1 1   1  25 o 377.3804 35.07257 28.15920       5.081336      21.68959       7.059601      35.11420       7.319639  325.3478 58.00004 419.4050 45.67810 -94.05719      73.82746 
1 1 1 1   1  26 o 535.8327 26.98205 56.25079       5.596778      49.88295       7.860052      62.79998       7.971198  501.5954 40.70102 564.2151 36.57608 -62.61975      54.72095 
1 1 1 1   1  27 o 223.9494 61.63545 10.42130       5.529470      9.524757       7.885298      11.28869       7.756008  222.1738 75.99466 235.6561 75.15789 -13.48222      106.8826 
1 1 1 1   1  28 o 277.8182 62.49768 16.23518       6.579737      24.22577       11.20193      12.02622       8.130012  333.0091 86.01342 241.2437 76.94957 91.76544       115.4103 
1 1 1 1   1  29 o 308.3275 51.71924 19.64408       5.973573      19.10510       8.205874      20.25168       8.712703  297.0348 71.90665 305.1299 74.23432 -8.095093      103.3504 
1 1 1 1   1  30 o 231.1274 70.54922 11.52928       6.911950      9.903798       8.304758      15.19340       12.46871  220.9787 77.85397 265.3912 95.19147 -44.41249      122.9742 
1 1 1 1   1  31 o 490.8979 40.99811 48.90790       7.744440      37.48013       9.326178      74.29178       13.89959  419.7813 58.82261 590.8901 61.47118 -171.1088      85.08117 
1 1 1 1   1  32 o 536.2893 39.64468 58.67562       8.198282      55.17004       14.50177      60.32225       9.938939  487.1318 79.39076 537.8151 48.09349 -50.68326      92.82175 
1 1 1 1   1  33 o 163.7005 68.26245 3.371208       7.213665      3.732059       9.040968      2.739011       11.96678  176.9274 75.24150 188.4323 83.25112 -11.50494      112.2142 
1 1 1 1   1  34 o 196.8265 71.63152 8.852048       7.093419      5.521108       11.93882      10.66948       8.818755  194.4071 84.59441 211.6822 79.35882 -17.27512      115.9915 
1 1 1 1   2  0  o 385.0539 19.40196 29.01457       2.891998      29.01457       2.891998      0.000000       0.000000  385.0539 19.40196 ?        ?        0.000000       19.40196 
1 1 1 1   2  1  f 975.1289 15.11123 185.2195       5.722554      185.2195       5.722554      0.000000       0.000000  975.1289 15.11123 ?        ?        0.000000       15.11123 
1 1 1 1   2  2  o 698.3214 11.10149 94.84406       3.010679      94.45071       3.722111      95.58844       5.120230  696.5704 13.75930 699.9958 18.83502 -3.425476      23.32544 
1 1 1 1   2  3  o 1211.205 13.88836 285.5025       6.532759      277.5659       7.722357      305.4760       12.25070  1193.663 16.65866 1249.627 25.24368 -55.96375      30.24491 
1 1 1 1   2  4  o 655.9992 11.85155 83.67648       3.019302      86.39709       3.708587      78.32833       5.199674  666.3663 14.33070 633.7392 21.12699 32.62708       25.52878 
1 1 1 1   2  5  o 145.9074 18.45958 4.210637       1.022590      2.844042       1.443864      5.585959       1.448468  118.4240 31.02358 167.7387 22.82850 -49.31468      38.51757 
1 1 1 1   2  6  o 756.7582 10.94289 111.2860       3.216008      117.6976       4.703778      105.6581       4.406962  777.9514 15.56920 737.1019 15.39515 40.84949       21.89545 
1 1 1 1   2  7  o 458.0945 11.88689 40.77758       2.114712      41.85909       3.007093      39.71940       2.974483  463.9671 16.68905 451.9433 16.94726 12.02374       23.78517 
1 1 1 1   2  8  o 908.5284 11.84568 160.3797       4.179519      163.1951       5.960416      157.6562       5.862272  916.1791 16.75206 900.4965 16.76316 15.68262       23.69884 
1 1 1 1   2  9  o 1715.959 15.23428 572.3336       10.15212      577.8967       14.51840      567.0106       14.20139  1723.388 21.69240 1707.122 21.42092 16.26611       30.48633 
1 1 1 1   2  10 o 905.3636 12.55763 159.2776       4.415286      160.6831       6.262969      157.8889       6.225515  909.0259 17.74092 901.0837 17.79025 7.942139       25.12436 
1 1 1 1   2  11 o 846.0796 12.90999 139.1200       4.241945      145.0031       6.125109      133.6975       5.880403  863.4167 18.26692 829.0745 18.26357 34.34222       25.83096 
1 1 1 1   2  12 o 887.3765 13.22005 153.0600       4.555846      156.9235       6.506614      149.3441       6.381097  898.0473 18.65640 876.0815 18.75525 21.96582       26.45413 
1 1 1 1   2  13 o 876.8365 13.65767 149.4892       4.650753      144.8000       6.488253      154.4446       6.669819  862.3974 19.37280 890.6662 19.28285 -28.26880      27.33374 
1 1 1 1   2  14 o 320.5520 26.35913 20.20902       3.252315      20.54467       4.006602      19.56059       5.568836  322.1789 32.46460 310.8973 47.64170 11.28156       57.65139 
1 1 1 1   2  15 o 546.4788 16.90168 58.16533       3.586998      53.27705       5.007081      63.31886       5.141136  522.1136 24.69401 569.4044 23.24932 -47.29077      33.91644 
1 1 1 1   2  16 o 328.7738 28.85069 21.35068       3.646439      16.19372       6.089988      24.23279       4.552762  278.5691 58.17065 349.3328 33.98934 -70.76373      67.37284 
1 1 1 1   2  17 o 846.1924 15.67439 139.4326       5.150956      131.0927       7.221173      148.0719       7.349630  819.2277 22.69735 870.8804 21.73096 -51.65271      31.42299 
1 1 1 1   2  18 o 752.5907 18.93201 110.3923       5.533293      110.2555       9.436689      110.4640       6.830797  749.4272 32.42368 752.0977 23.38671 -2.670471      39.97791 
1 1 1 1   2  19 o 507.6003 21.06927 50.22843       4.153358      51.41868       5.889736      49.05103       5.857866  511.7351 29.76478 499.6694 30.33112 12.06564       42.49611 
1 1 1 1   2  20 o 233.0189 49.24929 11.12604       4.317278      14.64406       5.298858      4.179108       7.446107  267.3750 52.90416 182.6156 71.75872 84.75935       89.15248 
1 1 1 1   2  21 o 262.7201 40.87025 13.85934       4.034379      17.19333       5.689511      10.48767       5.721571  290.7518 52.31120 226.0901 62.87894 64.66170       81.79378 
1 1 1 1   2  22 o 936.0454 24.53804 170.7445       8.919998      170.7445       8.919998      0.000000       0.000000  936.0454 24.53804 ?        ?        0.000000       24.53804 
1 1 1 1   2  23 o 304.6289 57.09412 18.94116       6.506281      18.94116       6.506281      0.000000       0.000000  304.6289 57.09412 ?        ?        0.000000       57.09412 
1 1 1 1   2  24 o 805.8709 19.64603 126.4430       6.148488      131.6816       8.878432      121.6155       8.523004  821.2866 27.83643 789.2766 27.80581 32.01007       39.34501 
1 1 1 1   2  25 o 555.8003 25.45269 60.29790       5.493896      52.92720       7.620710      68.27389       7.927448  517.6876 38.17461 589.0887 34.80625 -71.40112      51.66019 
1 1 1 1   2  26 o 281.0399 57.50998 16.32347       6.065335      14.60210       10.54080      17.17554       7.416090  267.9347 87.80113 286.1617 67.77645 -18.22705      110.9175 
1 1 1 1   2  27 o 268.7628 54.52464 14.92133       5.496440      12.37307       7.754539      17.49419       7.791877  244.4789 74.74503 287.7497 70.32219 -43.27084      102.6257 
1 1 1 1   2  28 f 374.3358 40.67656 28.04557       5.818179      29.86909       8.147188      26.14773       8.311568  381.3631 56.73835 354.2579 62.70852 27.10519       84.56713 
1 1 1 1   2  29 o 441.2990 35.61637 38.76828       6.051943      40.26185       8.444856      37.19133       8.677361  444.7297 49.74763 425.6399 53.68934 19.08981       73.19407 
1 1 1 1   2  30 o 149.5212 64.22762 0.4970527      6.708169      -10.03237      7.996440      25.50924       12.32452  122.2787 58.62181 330.6624 92.40026 -208.3837      109.4273 
1 1 1 1   2  31 o 267.5763 66.91953 15.90064       6.935955      22.56492       8.562613      3.183818       11.82820  317.4980 71.20068 198.6123 85.29983 118.8857       111.1107 
1 1 1 1   2  32 o 160.4312 71.79610 -1.010538      9.195488      3.121348       12.79191      -5.428826      13.22781  199.0224 87.05933 174.4248 81.04967 24.59766       118.9470 
1 1 1 1   2  33 o 232.3153 67.67519 12.65542       6.478121      19.93468       9.459576      6.226606       8.889839  281.6374 81.70294 188.8616 76.95486 92.77577       112.2382 
1 1 1 1   2  34 o 226.6342 72.65111 12.60642       7.240188      5.840804       12.51658      16.00857       8.875830  197.5921 86.28374 249.0448 80.50361 -51.45267      118.0073 
1 1 1 1   3  0  o 351.3789 11.45544 24.01513       1.563203      24.49666       2.828000      23.80327       1.875827  353.6136 20.68324 349.6913 13.81274 3.922363       24.87144 
1 1 1 1   3  1  o 38.41506 17.10518 -0.2054075     0.5149549     -0.4819229E-01 0.5612230     -1.042681      1.295155  43.18317 18.56432 55.57478 25.66108 -12.39162      31.67215 
1 1 1 1   3  2  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   3  3  o 1290.197 14.36609 323.9052       7.198181      319.7222       8.627255      333.4886       13.05841  1281.228 17.33876 1306.133 25.74393 -24.90442      31.03840 
1 1 1 1   3  4  o 1028.209 13.19578 205.5966       5.269196      202.1965       6.305188      213.4693       9.594340  1019.320 15.92794 1045.974 23.61927 -26.65356      28.48805 
1 1 1 1   3  5  o 647.2374 10.53545 81.40807       2.648162      81.10582       3.741590      81.71146       3.748552  645.7789 14.91916 648.1874 14.89138 -2.408508      21.07925 
1 1 1 1   3  6  o 781.5003 11.03988 118.6739       3.350592      125.5840       4.894598      112.5803       4.596356  803.6496 15.68275 760.9141 15.55429 42.73553       22.08811 
1 1 1 1   3  7  o 1346.946 13.16811 352.5825       6.888131      362.4469       9.997997      343.6700       9.503387  1365.059 18.85965 1329.284 18.40911 35.77551       26.35492 
1 1 1 1   3  8  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   3  9  o 1223.430 13.07692 290.8571       6.213159      290.6552       8.744734      291.0630       8.829344  1222.558 18.41829 1223.399 18.58371 -0.8410645     26.16463 
1 1 1 1   3  10 o 759.8477 12.61288 112.1950       3.721935      112.2922       5.216109      112.0942       5.312434  759.9050 17.67500 759.2128 18.01781 0.6921387      25.23979 
1 1 1 1   3  11 o 221.8130 25.64288 9.713556       2.168210      10.09789       3.000892      9.293785       3.136206  224.5928 35.59216 214.6505 39.06127 9.942322       52.84491 
1 1 1 1   3  12 o 525.6242 15.04508 53.72190       3.071128      56.40579       4.400711      51.17379       4.287946  538.2365 21.05337 512.6343 21.53841 25.60223       30.11889 
1 1 1 1   3  13 o 1537.834 17.31124 460.2373       10.33869      466.5408       12.94306      449.1252       17.18476  1547.388 21.53821 1516.058 29.18769 31.33057       36.27418 
1 1 1 1   3  14 o 650.8153 15.01886 82.41710       3.795968      80.17426       5.318026      84.74681       5.420047  641.2181 21.35584 659.2739 21.16943 -18.05573      30.07020 
1 1 1 1   3  15 o 571.0032 16.55609 63.49952       3.671337      61.14349       5.142479      65.94864       5.243092  559.4409 23.66957 581.0722 23.23429 -21.63129      33.16746 
1 1 1 1   3  16 o 194.3436 46.51876 7.811760       3.464239      5.228303       6.097216      9.043293       4.209727  177.9801 66.13139 208.5139 52.12715 -30.53372      84.20570 
1 1 1 1   3  17 o 272.2205 45.84702 15.10623       4.674616      0.000000       0.000000      15.10623       4.674616  ?        ?        272.2205 45.84702 0.000000       45.84702 
1 1 1 1   3  18 o 250.2174 36.70857 12.57358       3.461017      8.559510       4.880919      16.63304       4.908433  203.8825 58.55650 286.3340 45.67580 -82.45148      74.26400 
1 1 1 1   3  19 f 902.0782 16.04720 158.3611       5.621750      164.3849       8.067809      152.6758       7.837887  918.0714 22.62826 884.7386 22.81161 33.33276       32.13111 
1 1 1 1   3  20 o 737.0590 20.64946 105.8193       5.910701      107.4172       7.224016      102.5831       10.28070  742.0528 25.06778 722.3418 36.76969 19.71100       44.50172 
1 1 1 1   3  21 o 764.6923 20.82646 113.8634       6.184863      112.9339       7.531374      115.7886       10.83881  761.0374 25.48240 768.9486 36.29581 -7.911194      44.34792 
1 1 1 1   3  22 o 1343.234 16.71536 350.9298       8.719578      361.6547       12.52308      340.8375       12.14815  1362.474 23.66764 1322.684 23.64974 39.79053       33.45844 
1 1 1 1   3  23 o 493.5594 25.26660 47.60992       4.826761      52.69127       6.848716      42.59522       6.803648  517.9514 34.24124 464.7937 38.02531 53.15765       51.17017 
1 1 1 1   3  24 o 1321.947 17.49152 340.0690       8.979860      336.5067       12.63449      343.7055       12.76541  1313.577 24.76703 1327.555 24.76020 -13.97778      35.02104 
1 1 1 1   3  25 o 1229.397 20.55694 294.4971       9.814734      295.6128       16.78223      293.9171       12.09967  1227.644 35.20055 1227.075 25.39069 0.5687256      43.40237 
1 1 1 1   3  26 o 1048.288 19.13764 214.0840       7.791071      208.4711       10.72292      220.3608       11.33938  1032.847 26.73308 1061.695 27.50182 -28.84753      38.35372 
1 1 1 1   3  27 o 897.9629 29.35236 157.9223       10.23598      157.9223       10.23598      0.000000       0.000000  897.9629 29.35236 ?        ?        0.000000       29.35236 
1 1 1 1   3  28 o 373.6208 40.89211 27.95938       5.836468      31.97685       8.110125      23.64358       8.405840  395.5839 54.21766 334.8067 66.98746 60.77716       86.17932 
1 1 1 1   3  29 o 445.9532 82.46834 43.58904       13.75644      0.000000       0.000000      43.58904       13.75644  ?        ?        445.9532 82.46834 0.000000       82.46834 
1 1 1 1   3  30 o 500.8560 45.62962 51.02179       8.778028      51.02179       8.778028      0.000000       0.000000  500.8560 45.62962 ?        ?        0.000000       45.62962 
1 1 1 1   3  31 o 731.6302 25.01336 105.4926       7.107087      94.25748       9.775723      118.0884       10.35079  684.7805 36.89563 768.8851 34.66443 -84.10468      50.62519 
1 1 1 1   3  32 o 418.8697 40.91356 36.06627       6.570421      29.51489       9.190605      42.91488       9.396782  361.7369 67.91611 447.6063 55.22863 -85.86938      87.53741 
1 1 1 1   3  33 o 211.6220 88.95745 8.307589       12.40031      0.000000       0.000000      8.307589       12.40031  ?        ?        211.6220 88.95745 0.000000       88.95745 
1 1 1 1   3  34 f 577.1734 31.99599 67.73351       7.143759      67.67379       10.36070      67.78763       9.863251  561.5647 47.96754 564.8716 45.34383 -3.306885      66.00718 
1 1 1 1   4  0  f 727.5703 12.02184 102.9507       3.396831      97.17581       5.785819      105.9882       4.196118  705.7175 21.11086 737.9457 14.64183 -32.22821      25.69147 
1 1 1 1   4  1  o 977.7601 12.86254 185.9544       4.884130      177.3351       8.276593      190.5596       6.049804  953.1837 22.35872 989.3715 15.74541 -36.18787      27.34649 
1 1 1 1   4  2  o 613.4498 14.83432 73.22825       3.534065      71.98894       4.980199      74.48536       5.015839  607.5764 21.10658 618.0475 20.89747 -10.47113      29.70171 
1 1 1 1   4  3  o 292.9650 12.88860 16.68944       1.466390      17.26061       1.729727      15.23021       2.764776  297.4835 15.02081 278.0871 25.89848 19.39639       29.93921 
1 1 1 1   4  4  o 1000.169 13.20658 194.4916       5.129694      193.9504       6.188619      195.6800       9.169844  998.4816 15.95973 1001.819 23.56920 -3.337097      28.46437 
1 1 1 1   4  5  o 1192.743 12.24479 276.4910       5.671870      275.6690       7.994731      277.3241       8.048005  1190.438 17.29295 1193.999 17.35627 -3.560303      24.50074 
1 1 1 1   4  6  o 295.7662 13.55927 17.00198       1.557445      16.37627       2.170789      17.66571       2.235769  289.4830 19.42185 300.7305 19.24443 -11.24750      27.34148 
1 1 1 1   4  7  o 497.3789 11.94415 48.06771       2.307122      47.91959       3.248115      48.21852       3.277612  496.4533 16.84710 497.9955 16.94744 -1.542206      23.89645 
1 1 1 1   4  8  o 1501.818 14.06267 438.3338       8.201876      436.1453       11.50153      440.5982       11.69941  1497.438 19.77784 1505.032 20.01660 -7.593750      28.13943 
1 1 1 1   4  9  o 597.8296 12.58816 69.44772       2.922588      68.20436       4.086783      70.74918       4.181160  592.2474 17.76849 603.1912 17.84900 -10.94379      25.18543 
1 1 1 1   4  10 o 651.1153 12.87033 82.38826       3.254433      84.23369       4.610255      80.55524       4.594713  658.1104 18.03841 643.5605 18.38404 14.54987       25.75572 
1 1 1 1   4  11 o 289.4815 20.87347 16.39527       2.330880      15.24014       3.304439      17.53918       3.288345  277.6914 31.18015 298.5029 28.72068 -20.81149      42.39197 
1 1 1 1   4  12 f 920.2619 15.16426 164.6900       5.419519      165.1109       6.754013      163.9291       9.081470  921.0601 18.88191 916.8873 25.50423 4.172729       31.73314 
1 1 1 1   4  13 o 418.9901 20.17413 34.19832       3.282665      38.17316       4.176602      27.77484       5.309434  441.6720 24.44493 374.4136 36.99883 67.25842       44.34488 
1 1 1 1   4  14 o 665.2662 14.83269 86.12235       3.832159      89.99895       5.468158      82.38076       5.372100  679.3846 20.72514 649.9210 21.28411 29.46356       29.70765 
1 1 1 1   4  15 o 412.2227 19.87231 33.14216       3.181326      31.00966       4.447503      35.37652       4.552484  396.7128 29.07011 424.1146 27.79366 -27.40173      40.21889 
1 1 1 1   4  16 o 107.2586 45.31995 0.2757988      3.245296      1.893806       5.324032      -0.6808282     4.093755  146.0010 59.52937 112.9475 49.33281 33.05350       77.31411 
1 1 1 1   4  17 o 599.6901 25.08896 70.32209       5.843022      0.000000       0.000000      70.32209       5.843022  ?        ?        599.6901 25.08896 0.000000       25.08896 
1 1 1 1   4  18 o 559.8070 18.92461 61.06516       4.114274      56.47607       5.780464      65.77694       5.857218  536.5684 27.83582 580.1052 25.99900 -43.53680      38.08912 
1 1 1 1   4  19 o 690.5825 17.48787 92.84042       4.690083      91.37096       6.630986      94.31147       6.634573  684.1927 24.95581 695.1694 24.57505 -10.97668      35.02464 
1 1 1 1   4  20 o 579.8194 19.85336 65.46429       4.470486      61.63957       6.293310      69.36012       6.351536  561.0008 28.98503 596.0618 27.43844 -35.06097      39.91240 
1 1 1 1   4  21 o 1458.891 19.25833 414.2439       10.91112      417.6115       13.39622      407.6068       18.80664  1463.962 23.56267 1443.742 33.54237 20.22021       40.99134 
1 1 1 1   4  22 f 1442.609 16.91649 404.7899       9.477352      393.2467       13.10841      417.4323       13.71838  1420.726 23.75811 1463.685 24.13389 -42.95947      33.86580 
1 1 1 1   4  23 o 817.0504 21.59224 130.0038       6.851324      133.2979       11.57753      128.2284       8.499331  825.1885 36.12725 810.7915 26.99278 14.39703       45.09754 
1 1 1 1   4  24 o 527.1394 25.42269 54.21090       5.204452      56.19198       7.237265      52.08924       7.489634  534.4421 35.06392 513.9254 37.79112 20.51672       51.55238 
1 1 1 1   4  25 o 1096.892 18.25040 234.2764       7.774354      238.7782       10.92605      229.6599       11.06445  1105.940 25.43921 1084.425 26.27256 21.51526       36.57049 
1 1 1 1   4  26 o 229.8265 58.72974 10.97317       5.261386      16.07750       7.281044      5.395168       7.611392  276.6860 68.19750 191.2042 73.25359 85.48183       100.0849 
1 1 1 1   4  27 o 667.3091 24.44328 86.99528       6.334533      85.31571       8.793645      88.80688       9.132741  657.9795 34.53415 671.1646 35.16070 -13.18506      49.28369 
1 1 1 1   4  28 o 278.5422 60.69194 16.30764       6.379640      22.58315       7.881958      4.386696       10.86339  327.7575 64.22000 206.1181 84.65051 121.6394       106.2540 
1 1 1 1   4  29 o 534.1055 35.25105 56.71218       7.270731      60.79710       8.691402      47.18961       13.27015  550.9032 40.91655 467.9082 75.60577 82.99496       85.96741 
1 1 1 1   4  30 o 426.1261 37.27879 36.47840       6.107115      36.86747       8.482169      36.05962       8.800135  421.4604 52.99472 415.2426 55.99884 6.217804       77.09936 
1 1 1 1   4  31 o 307.6283 52.77645 20.06566       6.078121      23.07178       8.344139      16.66747       8.871613  321.7081 68.86562 268.4851 79.47736 53.22299       105.1624 
1 1 1 1   4  32 o 276.8253 66.52229 17.46802       7.062644      26.28606       11.43902      12.03575       8.978285  324.2905 88.40374 229.1173 80.92490 95.17316       119.8502 
1 1 1 1   4  33 o 455.4468 55.46770 45.41290       9.608210      0.000000       0.000000      45.41290       9.608210  ?        ?        455.4468 55.46770 0.000000       55.46770 
1 1 1 1   5  0  o 615.4501 10.36310 73.61688       2.476912      73.85921       3.499569      73.37363       3.506206  616.1855 14.62430 614.1508 14.70058 2.034729       20.73589 
1 1 1 1   5  1  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 1   5  2  o 781.9476 12.51107 118.8721       3.799268      122.4191       6.810853      117.2699       4.577663  792.5059 22.12947 776.4374 15.18131 16.06842       26.83628 
1 1 1 1   5  3  o 1208.363 14.15380 283.9129       6.641995      278.4498       7.894775      297.1470       12.28760  1196.321 16.99276 1234.290 25.63433 -37.96826      30.75504 
1 1 1 1   5  4  o 531.5635 12.56542 54.91761       2.593942      55.39448       3.097995      53.79923       4.744308  533.7638 14.94526 525.5328 23.24583 8.231018       27.63566 
1 1 1 1   5  5  o 1328.422 12.90192 342.9581       6.656075      334.6655       9.166622      352.2069       9.680619  1311.733 17.99434 1345.604 18.52498 -33.87109      25.82579 
1 1 1 1   5  6  o 509.4359 11.60720 50.42487       2.296387      53.04171       3.275105      47.89418       3.220741  522.3370 16.14531 496.3236 16.70948 26.01334       23.23527 
1 1 1 1   5  7  o 1171.544 12.58624 266.6953       5.726414      258.1554       7.833653      276.4956       8.391879  1152.263 17.50591 1192.434 18.12162 -40.17090      25.19623 
1 1 1 1   5  8  o 2026.841 16.83793 798.6821       13.25368      799.5002       18.75521      797.8660       18.73187  2026.625 23.82981 2024.554 23.82450 2.071045       33.69669 
1 1 1 1   5  9  o 970.9089 12.45277 183.1755       4.695396      182.4684       6.577488      183.9103       6.704933  968.6946 17.48418 972.4932 17.75333 -3.798523      24.91741 
1 1 1 1   5  10 o 451.3304 14.79331 39.59850       2.592912      37.22667       3.602360      42.14834       3.735104  437.3439 21.20978 465.3843 20.66631 -28.04041      29.61336 
1 1 1 1   5  11 o 874.4092 13.07552 148.6167       4.440192      153.7929       6.330785      143.6052       6.229206  889.0714 18.33551 859.0881 18.67097 29.98334       26.16861 
1 1 1 1   5  12 o 218.2398 32.09988 9.510012       2.639325      8.358241       3.305517      11.53588       4.383918  202.3767 43.36303 237.5140 49.14785 -35.13734      65.54284 
1 1 1 1   5  13 o 759.6022 14.07761 112.2313       4.152820      115.4868       5.901614      109.0383       5.844748  769.9044 19.73813 748.0521 20.11898 21.85229       28.18452 
1 1 1 1   5  14 o 580.0493 15.85927 65.50201       3.572532      64.06705       4.995335      67.00435       5.111309  572.9159 22.45152 585.9003 22.46365 -12.98444      31.75982 
1 1 1 1   5  15 o 477.8634 18.35727 44.51303       3.406745      38.81759       4.661346      51.04329       4.991290  444.4221 27.13776 510.8503 25.15887 -66.42813      37.00577 
1 1 1 1   5  16 o 1028.754 16.85079 206.1835       6.732244      197.6469       11.02377      211.2610       8.501812  1004.237 28.26608 1040.387 21.04208 -36.14923      35.23834 
1 1 1 1   5  17 o 485.7877 23.21234 46.09061       4.379187      41.96416       7.742437      48.03169       5.310204  458.1203 44.06159 494.5370 27.76159 -36.41669      52.07811 
1 1 1 1   5  18 o 175.5679 53.24227 6.196094       3.946025      7.037879       6.983227      5.801221       4.782819  198.8240 71.24667 175.2378 59.18924 23.58615       92.62534 
1 1 1 1   5  19 o 557.2252 19.96520 60.48243       4.320485      68.96546       6.215976      52.55378       6.009434  594.2538 26.93452 517.5400 30.02842 76.71381       40.33825 
1 1 1 1   5  20 o 178.8331 51.30117 6.473027       3.748337      9.318067       5.345372      3.720637       5.257615  213.6698 61.25353 160.6721 61.04212 52.99768       86.47621 
1 1 1 1   5  21 o 436.7216 30.82264 37.43216       5.194040      30.70630       6.304391      51.64429       9.164295  393.3980 41.91040 510.2570 46.76720 -116.8589      62.79850 
1 1 1 1   5  22 o 166.9384 65.12772 3.496274       6.097765      11.19931       8.727630      -3.849945      8.523092  240.6921 79.94293 152.4510 68.60270 88.24110       105.3433 
1 1 1 1   5  23 o 868.4330 18.60363 146.7681       6.274252      147.5864       8.764849      145.9080       8.985532  869.9430 25.94333 864.8645 26.75271 5.078491       37.26612 
1 1 1 1   5  24 o 536.4227 25.22697 56.14115       5.255333      52.36747       7.143962      60.59179       7.758319  515.6149 35.90076 554.7388 36.21096 -39.12396      50.99116 
1 1 1 1   5  25 o 271.8445 49.39973 15.07388       5.023125      17.41488       6.842548      12.33783       7.397395  289.4592 62.68472 244.4541 72.62224 45.00510       95.93416 
1 1 1 1   5  26 o 237.4813 58.35470 11.72785       5.343380      13.01410       7.256446      10.20426       7.897557  249.7029 71.29823 227.8172 76.06276 21.88562       104.2544 
1 1 1 1   5  27 o 589.8315 30.73452 68.40491       7.015792      71.94788       8.557517      61.14161       12.25267  603.3841 36.69384 548.6240 58.40604 54.76013       68.97610 
1 1 1 1   5  28 o 453.0171 38.26949 40.88080       6.669788      44.45834       7.891461      31.93426       12.47937  470.8232 43.65561 381.0346 86.33231 89.78857       96.74233 
1 1 1 1   5  29 o 445.6878 40.04549 39.87685       6.857282      39.98625       7.919965      39.54926       13.70492  443.7554 46.65567 420.3126 86.83379 23.44281       98.57413 
1 1 1 1   5  30 o 439.3599 36.18298 38.72217       6.118907      28.97055       8.339387      50.09480       9.005878  369.0945 60.25900 494.7237 47.45672 -125.6292      76.70259 
1 1 1 1   5  31 o 168.7680 64.47285 4.865522       5.885522      10.20039       8.208720      -0.7782024     8.442993  218.5322 77.35829 156.9376 69.60234 61.59462       104.0615 
1 1 1 1   5  32 o 238.6535 71.26872 13.25695       7.110501      -0.8948181     11.50546      22.00217       9.044488  175.6953 79.32416 303.8117 76.65823 -128.1164      110.3123 
1 1 1 1   5  33 o 173.1515 70.39714 4.949641       7.418480      10.82060       14.54608      2.885816       8.624382  225.6716 95.68287 169.0725 72.73140 56.59903       120.1876 
1 1 1 1   6  0  o 984.2402 11.48259 188.2656       4.389032      180.9232       6.014098      196.6319       6.419804  964.4638 16.05671 1005.422 16.44166 -40.95770      22.98143 
1 1 1 1   6  1  o 731.8908 10.79080 104.0899       3.067101      100.6216       4.246872      107.8711       4.434263  719.3347 15.20233 744.7880 15.33066 -25.45331      21.59028 
1 1 1 1   6  2  o 660.4680 10.76812 84.76144       2.761975      81.94500       3.825779      87.82722       3.991535  649.1837 15.17485 672.0728 15.29310 -22.88910      21.54425 
1 1 1 1   6  3  o 676.1620 22.97937 89.03043       6.034161      0.000000       0.000000      89.03043       6.034161  ?        ?        676.1620 22.97937 0.000000       22.97937 
1 1 1 1   6  4  o 474.0908 10.95933 43.66942       2.017778      41.03922       2.797448      46.52181       2.913211  459.4500 15.67818 489.1909 15.33436 -29.74094      21.93052 
1 1 1 1   6  5  o 289.6939 13.38426 16.30912       1.505781      12.52955       2.116367      20.18395       2.142871  252.8180 21.76758 321.7316 17.21280 -68.91364      27.75082 
1 1 1 1   6  6  o 2142.573 17.33466 892.5635       14.42377      888.8451       20.26540      896.3812       20.53383  2136.725 24.42185 2145.714 24.64168 -8.988525      34.69350 
1 1 1 1   6  7  o 1063.748 12.30402 219.8673       5.082925      224.8456       7.282278      215.1379       7.097950  1075.367 17.43743 1051.902 17.37520 23.46582       24.61628 
1 1 1 1   6  8  o 1235.131 13.10285 296.4574       6.285026      308.7137       9.165784      285.5802       8.634707  1259.893 18.73302 1211.808 18.34788 48.08508       26.22157 
1 1 1 1   6  9  o 1067.137 12.75395 221.3046       5.285582      223.6332       7.516904      219.0272       7.433674  1072.301 18.05070 1061.202 18.03754 11.09912       25.51824 
1 1 1 1   6  10 o 739.2902 12.97385 106.2271       3.724875      113.4965       5.355408      99.41487       5.184295  763.8318 18.05372 714.8329 18.67485 48.99890       25.97474 
1 1 1 1   6  11 o 536.3450 16.27483 55.95361       3.389915      55.91370       4.252364      56.02320       5.614888  535.8903 20.43274 535.1921 27.10329 0.6981812      33.94238 
1 1 1 1   6  12 o 480.5668 16.19088 44.93551       3.021705      46.98756       4.309024      42.95006       4.238521  490.9440 22.60055 469.3231 23.25490 21.62091       32.42800 
1 1 1 1   6  13 o 873.9298 13.83469 148.5712       4.695414      147.3079       6.545498      149.9106       6.739381  869.4515 19.38516 877.0339 19.78680 -7.582336      27.70022 
1 1 1 1   6  14 o 230.6527 31.81750 10.63465       2.774177      12.67526       3.812689      8.338834       4.044087  250.2098 40.63115 200.5781 51.61604 49.63165       65.68947 
1 1 1 1   6  15 o 384.2533 24.46576 28.98532       3.631939      32.74481       6.175397      26.99725       4.490716  405.0860 39.76721 369.4171 31.60618 35.66888       50.79746 
1 1 1 1   6  16 o 132.4703 47.06282 3.050856       3.040839      2.614946       4.293002      3.489782       4.307828  140.7953 54.72467 148.8615 55.53235 -8.066177      77.96558 
1 1 1 1   6  17 o 492.1980 19.89077 47.23323       3.802063      55.73454       5.400286      38.87742       5.353873  533.8853 26.04599 444.1601 31.23730 89.72513       40.67140 
1 1 1 1   6  18 o 295.6447 37.44910 17.44515       4.203315      21.85147       7.531332      15.45170       5.065659  325.0648 61.91986 275.2620 49.19261 49.80283       79.08212 
1 1 1 1   6  19 f 416.9325 24.79396 34.02963       3.996479      31.46291       5.538040      36.81881       5.773031  398.9795 36.13395 432.1296 34.69274 -33.15012      50.09240 
1 1 1 1   6  20 o 494.0138 26.47171 47.74331       5.060188      37.20290       8.373124      53.80780       6.351204  431.1726 50.99184 523.7842 31.36743 -92.61157      59.86721 
1 1 1 1   6  21 o 1127.930 16.60551 247.4439       7.273820      247.3842       10.21417      247.5054       10.36087  1126.891 23.33958 1127.115 23.67009 -0.2238770     33.24168 
1 1 1 1   6  22 o 954.4778 20.15690 177.3294       7.471667      182.1940       9.114593      167.3636       13.04583  966.9553 24.27185 924.7604 36.32573 42.19489       43.68846 
1 1 1 1   6  23 o 295.9612 41.57878 17.52858       4.647151      22.12287       6.500375      12.72589       6.646177  330.7047 52.35764 248.1316 67.27782 82.57307       85.25038 
1 1 1 1   6  24 o 784.6265 20.55658 119.9354       6.263857      115.5443       8.595983      124.9070       9.146486  768.9210 28.78629 799.3455 29.46400 -30.42444      41.19197 
1 1 1 1   6  25 o 1381.722 20.78257 372.1017       11.15188      384.1151       13.78507      349.3491       18.97117  1402.587 25.30760 1333.585 36.63074 69.00256       44.52287 
1 1 1 1   6  26 o 151.2947 60.40827 2.494405       5.355497      2.505371       7.078623      2.479726       8.189974  168.0372 68.59219 177.7472 73.30788 -9.709961      100.3939 
1 1 1 1   6  27 o 468.6980 32.44250 43.34529       5.868890      45.30125       7.839321      40.85110       8.852448  476.4538 42.82464 449.4818 51.65210 26.97205       67.09612 
1 1 1 1   6  28 o 317.1825 56.07956 20.89890       6.655140      21.48099       7.765757      19.28918       12.91406  318.4872 64.98667 296.7191 97.18156 21.76810       116.9082 
1 1 1 1   6  29 o 444.5304 34.97791 39.40277       5.989644      41.44918       8.019470      36.82095       9.007656  451.6402 46.38058 420.9394 56.53034 30.70078       73.12207 
1 1 1 1   6  30 o 402.5242 39.44268 32.78390       6.086537      32.25714       8.244734      33.41482       9.023167  391.6501 55.78276 396.1223 60.57984 -4.472168      82.35068 
1 1 1 1   6  31 o 314.3052 58.44925 21.42139       6.871828      21.93872       11.05896      21.09600       8.770584  300.2713 88.69534 302.3899 75.04025 -2.118622      116.1805 
1 1 1 1   6  32 o 332.8203 57.86454 24.36869       7.207601      31.73417       11.69567      19.85858       9.152036  357.7090 85.37673 285.3415 79.58518 72.36749       116.7176 
1 1 1 1   6  33 o 577.6127 31.18520 67.48838       6.969489      72.51850       10.14319      62.98957       9.592542  586.5310 44.87067 545.6810 45.68585 40.84998       64.03573 
1 1 1 1   7  0  o 605.4078 11.17740 71.21487       2.627949      74.65611       3.776477      67.98396       3.659256  619.6708 15.69270 591.3207 15.93462 28.35016       22.36455 
1 1 1 1   7  1  o 549.0688 11.23393 58.57676       2.395446      57.27482       3.327198      59.97785       3.451569  542.7661 15.78476 555.4164 16.00184 -12.65039      22.47704 
1 1 1 1   7  2  o 1348.737 13.11832 353.5209       6.871213      351.4737       9.630278      355.6439       9.806853  1344.277 18.44684 1352.201 18.67499 -7.923706      26.24959 
1 1 1 1   7  3  o 378.1986 12.88462 27.79517       1.892428      28.93119       2.621560      26.55906       2.734614  385.7256 17.50062 369.0291 19.14706 16.69650       25.93996 
1 1 1 1   7  4  o 424.5753 14.02374 35.03392       2.312312      34.17105       2.680346      37.54473       4.572225  419.2446 16.46248 438.1823 27.00008 -18.93765      31.62305 
1 1 1 1   7  5  o 343.7511 18.49375 23.04528       2.459785      23.04528       2.459785      0.000000       0.000000  343.7511 18.49375 ?        ?        0.000000       18.49375 
1 1 1 1   7  6  o 1031.743 12.06902 206.8314       4.835836      208.9146       6.892152      204.8113       6.786874  1036.594 17.12056 1026.371 17.02697 10.22339       24.14605 
1 1 1 1   7  7  o 1179.933 12.73693 270.5399       5.836470      267.3708       8.147190      273.8810       8.365155  1172.583 17.89106 1186.748 18.15045 -14.16479      25.48586 
1 1 1 1   7  8  o 667.2725 12.37151 86.52295       3.205929      97.80111       4.721114      76.87202       4.367270  709.1846 17.14183 628.7003 17.88704 80.48431       24.77476 
1 1 1 1   7  9  o 264.0197 20.51580 13.64771       2.087031      16.44897       2.919966      10.72205       2.984093  289.3325 26.27323 231.8139 34.17200 57.51857       43.10462 
1 1 1 1   7  10 o 1389.531 16.10822 375.5174       8.692477      370.1316       10.59273      386.6220       15.21016  1378.970 19.77994 1407.693 27.82260 -28.72351      34.13712 
1 1 1 1   7  11 o 566.8038 20.40987 62.57067       4.492633      62.57067       4.492633      0.000000       0.000000  566.8038 20.40987 ?        ?        0.000000       20.40987 
1 1 1 1   7  12 f 929.0331 13.48456 167.8635       4.865146      173.0176       6.920203      162.8264       6.841188  942.4594 18.90724 914.2262 19.26859 28.23322       26.99560 
1 1 1 1   7  13 o 263.1996 26.48951 13.68256       2.670829      11.80765       3.802523      15.50819       3.752224  241.0658 42.15190 278.6477 35.47890 -37.58186      55.09569 
1 1 1 1   7  14 o 460.4340 20.52293 41.36366       3.669735      46.33395       6.221393      38.71160       4.544522  484.3271 33.27853 443.9523 26.47919 40.37473       42.52773 
1 1 1 1   7  15 o 563.4636 19.38814 61.91910       4.242579      66.11876       7.181652      59.66779       5.258182  579.2245 32.05101 552.4064 24.51032 26.81805       40.34877 
1 1 1 1   7  16 o 447.8935 20.49677 39.13238       3.565235      40.08424       4.982971      38.13403       5.103185  451.4592 28.56848 439.9981 30.04459 11.46103       41.45884 
1 1 1 1   7  17 o 701.9037 16.69612 95.92168       4.551148      100.9578       6.473780      91.00053       6.399455  719.2021 23.17816 682.6665 24.13828 36.53564       33.46467 
1 1 1 1   7  18 o 664.5075 20.57535 86.04272       5.309761      89.69135       9.201136      84.22099       6.501563  675.2955 35.20677 656.8236 25.48831 18.47192       43.46459 
1 1 1 1   7  19 o 1119.167 18.58918 243.8129       8.079476      250.8877       14.19021      240.4191       9.828071  1132.492 32.26455 1110.666 22.78542 21.82642       39.49907 
1 1 1 1   7  20 o 678.9087 18.91929 89.70158       4.988205      86.73256       6.995173      92.77332       7.115131  666.7990 27.01317 689.6808 26.56482 -22.88184      37.88668 
1 1 1 1   7  21 o 589.4069 21.16621 67.63492       4.844916      68.33699       6.706303      66.86845       7.007082  591.7584 29.18172 584.3740 30.98652 7.384399       42.56451 
1 1 1 1   7  22 o 394.7758 35.24260 30.72781       5.346332      30.73564       6.465441      30.71088       9.507369  393.3767 43.02293 387.7429 65.46903 5.633820       78.34007 
1 1 1 1   7  23 o 614.5484 25.93376 73.68038       6.189415      81.25670       7.515542      57.71074       10.91135  644.8588 30.01011 537.4646 52.96420 107.3942       60.87539 
1 1 1 1   7  24 o 614.5645 26.60180 73.75668       6.349017      83.34669       7.678824      53.03369       11.28786  652.7489 30.29149 512.8192 57.67958 139.9297       65.14989 
1 1 1 1   7  25 o 633.8500 33.00975 78.97189       8.097526      78.97189       8.097526      0.000000       0.000000  633.8500 33.00975 ?        ?        0.000000       33.00975 
1 1 1 1   7  26 o 399.4511 36.49667 31.63536       5.599127      37.36801       7.713361      25.25002       8.140626  431.7509 46.74925 349.3755 62.28183 82.37546       77.87502 
1 1 1 1   7  27 o 490.4470 36.80640 47.69009       6.959283      40.78484       8.133168      66.56665       13.44719  450.2769 47.21304 570.2318 61.70708 -119.9549      77.69707 
1 1 1 1   7  28 o 666.6943 33.63940 87.93792       8.681595      87.93792       8.681595      0.000000       0.000000  666.6943 33.63940 ?        ?        0.000000       33.63940 
1 1 1 1   7  29 o 220.9911 63.35798 10.46053       5.718746      4.501212       7.706988      17.76167       8.530643  181.6309 72.48373 282.8192 76.02851 -101.1883      105.0439 
1 1 1 1   7  30 o 378.6643 42.65737 29.29384       6.163747      35.27818       8.524737      22.73791       8.922576  409.7005 54.96395 318.0724 73.67949 91.62802       91.92226 
1 1 1 1   7  31 o 301.4337 61.50931 20.03694       6.956668      40.72281       11.25998      7.266504       8.847150  425.8111 70.56220 199.7429 78.30305 226.0682       105.4058 
1 1 1 1   7  32 o 627.8366 29.43245 78.86107       7.176307      90.96036       10.33415      67.59238       9.973136  664.8585 40.21293 568.2720 45.57397 96.58649       60.77883 
1 1 1 1   7  33 o 149.0823 62.40709 2.585118       6.062244      3.095032       8.791888      2.122938       8.370261  170.0240 73.28654 162.8779 70.85339 7.146149       101.9368 
1 1 1 1   8  0  f 256.0653 16.48206 12.80033       1.630335      12.14810       2.289336      13.47149       2.322302  248.6544 24.00595 262.0773 23.05162 -13.42290      33.28157 
1 1 1 1   8  1  o 911.6998 11.78460 161.4993       4.172484      157.3225       5.768586      166.0823       6.042508  899.5648 16.51235 924.2476 16.83453 -24.68286      23.58091 
1 1 1 1   8  2  o 391.1231 13.22823 29.72758       2.009292      29.77437       2.815542      29.67901       2.868330  391.2860 18.52847 390.6467 18.90675 0.6392517      26.47205 
1 1 1 1   8  3  o 701.5798 11.75685 95.63410       3.203289      92.30186       4.403656      99.37868       4.668177  689.0504 16.45638 714.9591 16.81272 -25.90869      23.52616 
1 1 1 1   8  4  o 1633.867 14.68178 518.8445       9.315872      513.5146       10.52998      538.0420       19.98423  1625.232 16.68339 1661.143 30.97792 -35.91113      35.18475 
1 1 1 1   8  5  o 418.6353 17.82997 34.07827       2.898774      0.000000       0.000000      34.07827       2.898774  ?        ?        418.6353 17.82997 0.000000       17.82997 
1 1 1 1   8  6  o 1673.135 14.91582 544.1333       9.691839      531.0497       13.28217      559.0326       14.17391  1652.114 20.70147 1694.946 21.53305 -42.83203      29.87010 
1 1 1 1   8  7  o 568.8690 12.43541 62.88628       2.747264      65.46941       3.956625      60.48157       3.817542  580.2136 17.55937 557.6705 17.62699 22.54309       24.88056 
1 1 1 1   8  8  o 742.9200 12.48635 107.2628       3.602512      105.9130       5.059372      108.6509       5.130822  737.9194 17.65467 747.3949 17.67701 -9.475464      24.98328 
1 1 1 1   8  9  o 907.2968 14.34668 160.0443       5.055090      158.3450       6.259782      163.2300       8.570878  902.1566 17.86690 915.2385 24.11366 -13.08191      30.01158 
1 1 1 1   8  10 o 1089.415 14.96083 230.8161       6.329614      228.4807       7.803140      235.3091       10.82317  1083.434 18.54551 1098.354 25.37372 -14.91931      31.42867 
1 1 1 1   8  11 o 1039.901 13.39700 210.2960       5.410379      216.7643       7.772251      204.2148       7.536077  1054.981 18.97029 1023.991 18.95053 30.99091       26.81407 
1 1 1 1   8  12 o 291.7481 23.97310 16.73117       2.692168      15.69910       3.710178      17.87885       3.912473  280.6111 34.79188 299.8437 34.21167 -19.23257      48.79461 
1 1 1 1   8  13 o 703.1562 16.58278 96.29950       4.528321      96.78822       7.467349      96.01524       5.694946  703.1025 27.34764 701.4896 20.90453 1.612854       34.42227 
1 1 1 1   8  14 o 985.9164 16.15061 189.3199       6.183824      178.4905       9.976381      196.0766       7.880261  954.7382 26.90672 1002.489 20.24104 -47.75104      33.67004 
1 1 1 1   8  15 o 418.8486 20.71729 34.23069       3.369907      33.13019       4.746668      35.34909       4.785100  409.9092 30.02658 423.6399 29.26422 -13.73065      41.92839 
1 1 1 1   8  16 o 783.1324 15.51356 119.3834       4.718182      115.4678       6.606583      123.4594       6.740464  769.2007 22.11613 795.4271 21.82034 -26.22638      31.06848 
1 1 1 1   8  17 o 1022.771 17.90030 203.7003       7.109955      211.0385       12.87153      200.4782       8.529284  1037.814 31.93614 1013.981 21.65982 23.83344       38.58840 
1 1 1 1   8  18 o 1074.309 18.22750 224.6770       7.604739      221.8322       13.20271      226.0894       9.302993  1064.698 31.93070 1077.013 22.24199 -12.31482      38.91369 
1 1 1 1   8  19 o 1087.213 18.64468 230.0611       7.872227      241.1514       13.94993      224.8791       9.535666  1110.506 32.34621 1074.268 22.85653 36.23755       39.60679 
1 1 1 1   8  20 o 588.7253 20.80331 67.47660       4.756342      64.65767       6.588418      70.54486       6.873610  574.7795 29.61629 601.1790 29.44104 -26.39948      41.76003 
1 1 1 1   8  21 o 910.6201 17.67337 161.3126       6.250067      167.3149       8.713104      154.9505       8.970367  926.6639 24.21155 891.5452 25.90830 35.11871       35.46039 
1 1 1 1   8  22 o 459.2099 31.26704 41.38815       5.542848      47.72495       6.706326      27.72751       9.846573  492.5852 35.29090 366.1006 71.82148 126.4846       80.02357 
1 1 1 1   8  23 o 166.4496 61.55811 4.412945       5.270851      2.817721       6.326376      8.033376       9.530688  163.7728 65.56229 221.7288 82.62256 -57.95593      105.4746 
1 1 1 1   8  24 o 448.2805 30.24154 39.49330       5.234023      39.68354       7.086227      39.26492       7.764195  447.0801 41.27944 443.5973 45.72461 3.482788       61.60139 
1 1 1 1   8  25 o 728.9221 22.61931 103.6489       6.403074      93.71029       8.491673      116.7472       9.748496  691.5773 31.61728 771.7145 32.52767 -80.13727      45.36190 
1 1 1 1   8  26 o 638.0523 28.64435 79.71199       7.097792      73.90955       8.175282      97.47504       14.30395  612.3093 34.52065 696.6581 53.27371 -84.34882      63.48042 
1 1 1 1   8  27 o 155.4295 64.50117 1.683364       6.396385      2.652044       7.385665      -1.223446      12.79404  170.4849 69.88162 196.3456 86.44685 -25.86066      111.1598 
1 1 1 1   8  28 o 932.5580 21.21402 170.0510       7.682930      178.9489       10.39970      159.3598       11.39963  954.1601 28.06542 898.4938 32.66988 55.66626       43.06958 
1 1 1 1   8  29 o 425.6023 37.73536 36.39697       6.172389      35.97809       8.297449      36.91596       9.235924  416.7995 52.42090 419.2908 58.29749 -2.491333      78.39993 
1 1 1 1   8  30 o 296.5829 62.25529 19.20314       6.942048      23.25574       10.83506      16.38111       9.041604  313.4431 86.28419 266.6145 80.53541 46.82864       118.0293 
1 1 1 1   8  31 o 252.6404 63.48368 14.36227       6.221049      0.9658515      8.526342      29.61244       9.097158  163.5748 71.32755 363.2719 66.94984 -199.6971      97.82587 
1 1 1 1   8  32 o 511.4389 34.09809 53.16287       6.733722      66.27663       9.565211      40.27850       9.481186  563.0941 44.09290 426.7134 58.77295 136.3807       73.47410 
1 1 1 1   8  33 o 191.5870 66.38206 8.366280       6.024451      19.26624       8.871265      -0.9628096     8.207158  274.5676 78.96864 147.9267 66.87234 126.6409       103.4792 
1 1 1 1   9  0  o 851.0448 11.99681 140.7267       3.965028      141.4938       5.590415      139.9502       5.624532  853.0983 16.87396 848.4199 17.07055 4.678467       24.00280 
1 1 1 1   9  1  o 344.7115 14.70521 23.09513       1.968589      24.32698       2.737959      21.77679       2.832457  353.0749 20.05058 333.8150 21.97170 19.25986       29.74528 
1 1 1 1   9  2  o 1306.298 13.30641 331.6049       6.750426      330.6721       9.504769      332.5543       9.588876  1303.958 18.76939 1307.651 18.88199 -3.693604      26.62366 
1 1 1 1   9  3  o 1387.920 13.70786 374.3611       7.388602      370.3657       10.31057      378.5786       10.59329  1379.934 19.23960 1395.113 19.55210 -15.17847      27.43077 
1 1 1 1   9  4  o 2118.206 17.37340 872.4392       14.29160      881.8726       16.64755      846.0059       27.86726  2129.122 20.13362 2081.649 34.47139 47.47314       39.92041 
1 1 1 1   9  5  o 892.8003 14.21699 154.9282       4.929354      163.2530       6.024789      138.0709       8.573325  916.2861 16.93101 841.8445 26.22343 74.44165       31.21421 
1 1 1 1   9  6  o 1489.512 14.15349 431.2535       8.187199      433.6578       11.61399      428.8785       11.54323  1492.888 20.03209 1484.641 20.02064 8.247559       28.32156 
1 1 1 1   9  7  o 403.5336 21.08285 31.78383       3.292507      31.78383       3.292507      0.000000       0.000000  403.5336 21.08285 ?        ?        0.000000       21.08285 
1 1 1 1   9  8  o 457.5492 16.00686 40.71560       2.844277      40.93581       3.685633      40.39134       4.472397  458.5414 20.69692 454.4722 25.44211 4.069153       32.79731 
1 1 1 1   9  9  o 806.9690 14.52194 126.6351       4.551027      133.4563       5.874004      116.3916       7.198284  828.0613 18.26601 772.6565 23.98913 55.40485       30.15171 
1 1 1 1   9  10 o 680.9217 13.63640 90.16850       3.605994      92.16422       5.142871      88.23848       5.057493  687.8956 19.25108 673.0753 19.34834 14.82025       27.29399 
1 1 1 1   9  11 o 834.9711 13.51543 135.6125       4.382575      130.6798       6.079688      140.9484       6.323281  818.9302 19.11641 850.4925 19.14450 -31.56226      27.05456 
1 1 1 1   9  12 o 852.9081 13.83300 141.5479       4.581911      136.4685       6.409652      146.8559       6.552304  836.5694 19.72898 867.8764 19.44053 -31.30701      27.69777 
1 1 1 1   9  13 o 568.5424 18.15923 63.00518       4.009481      56.69147       6.409997      67.06316       5.138908  536.5172 30.89482 585.9580 22.58273 -49.44086      38.26839 
1 1 1 1   9  14 o 681.3362 15.62128 90.39307       4.133389      85.07092       5.716853      96.22276       5.983229  660.0182 22.30350 702.0101 21.94645 -41.99188      31.29046 
1 1 1 1   9  15 f 696.6461 18.99368 94.60107       5.138654      102.6298       9.245347      91.01205       6.181397  722.8218 32.93548 682.6381 23.31676 40.18365       40.35365 
1 1 1 1   9  16 o 863.8207 17.92651 145.3317       6.013777      140.6808       10.51737      147.5910       7.330328  847.0985 31.97018 869.8978 21.69838 -22.79932      38.63822 
1 1 1 1   9  17 o 787.0417 16.22869 120.5376       4.960316      134.4948       7.213038      108.0148       6.832325  830.5633 22.36235 744.1459 23.64190 86.41736       32.54250 
1 1 1 1   9  18 o 398.8825 25.19729 31.15607       3.883193      35.95296       5.497918      26.38095       5.485434  427.3381 33.39360 364.5422 39.37196 62.79590       51.62638 
1 1 1 1   9  19 o 1459.592 19.22796 414.6435       10.89915      411.6426       18.90752      416.1370       13.33823  1450.844 33.55722 1461.377 23.50218 -10.53271      40.96876 
1 1 1 1   9  20 o 1067.208 16.51749 221.5075       6.845751      225.9117       9.582300      216.9164       9.783544  1076.973 22.91063 1055.175 23.87502 21.79797       33.08948 
1 1 1 1   9  21 o 939.0703 20.04727 171.6478       7.311078      173.9529       8.772659      166.4065       13.22841  944.8760 23.90718 921.9730 36.94550 22.90302       44.00595 
1 1 1 1   9  22 o 447.9519 28.32106 39.32922       4.901481      45.23374       6.699995      32.53074       7.189328  479.1850 36.27215 403.7614 46.71214 75.42355       59.14129 
1 1 1 1   9  23 o 323.7427 45.44577 21.06152       5.556366      17.24845       6.559335      30.74920       10.45521  288.8867 60.40925 384.4415 72.69157 -95.55475      94.51636 
1 1 1 1   9  24 o 814.3040 20.93902 129.2439       6.621721      133.3565       8.949888      124.2699       9.842710  825.9526 27.90195 796.5189 31.81930 29.43365       42.32005 
1 1 1 1   9  25 o 982.5496 27.07059 188.7442       10.32952      188.7442       10.32952      0.000000       0.000000  982.5496 27.07059 ?        ?        0.000000       27.07059 
1 1 1 1   9  26 o 491.1162 36.03478 47.73338       6.824831      46.86759       7.896685      50.28909       13.56727  484.8816 42.36068 490.3826 73.50584 -5.501038      84.83829 
1 1 1 1   9  27 o 353.5841 42.40014 25.18550       5.706094      22.21041       7.456289      29.39042       8.864435  325.5265 61.22781 374.8732 63.13236 -49.34668      87.94623 
1 1 1 1   9  28 o 554.2987 29.96218 60.72177       6.425831      64.92433       8.539593      55.23612       9.756497  569.8953 38.81579 521.1032 48.77806 48.79211       62.33751 
1 1 1 1   9  29 o 300.9091 59.91750 19.41821       6.755841      14.82256       10.04273      23.21701       9.130665  257.6865 85.76270 322.4686 74.42122 -64.78210      113.5507 
1 1 1 1   9  30 o 203.0017 71.10455 8.605223       6.921094      -0.1614547     10.59687      15.12679       9.139786  176.0691 78.03726 255.6486 81.59310 -79.57948      112.9037 
1 1 1 1   9  31 o 329.6265 51.57592 23.27960       6.385888      9.516050       8.755951      38.91952       9.333734  211.1192 79.08985 422.6427 58.42886 -211.5236      98.33177 
1 1 1 1   9  32 o 142.9324 60.98683 1.552432       5.975740      6.136714       8.632350      -2.665829      8.280568  186.2314 75.85190 143.2995 65.69688 42.93196       100.3474 
1 1 1 1   10 0  o 880.5838 12.30450 150.6783       4.207873      151.3302       5.912738      150.0094       5.989670  882.1807 17.25850 878.3005 17.56029 3.880188       24.62153 
1 1 1 1   10 1  o 588.9100 12.70058 67.39520       2.904694      66.32394       4.006054      68.58272       4.217839  584.0016 17.66342 593.8312 18.28938 -9.829529      25.42632 
1 1 1 1   10 2  o 491.7577 13.53277 46.99868       2.584436      42.81504       3.546394      51.73686       3.774115  469.1381 19.46517 515.7361 18.84341 -46.59805      27.09183 
1 1 1 1   10 3  o 667.1641 12.67342 86.49897       3.283633      84.64568       4.478582      88.65332       4.828669  659.7401 17.47993 675.1211 18.41695 -15.38098      25.39157 
1 1 1 1   10 4  o 1407.231 16.23360 385.0540       8.871727      382.2487       10.65833      391.3821       16.00779  1401.660 19.58027 1416.609 29.09734 -14.94934      35.07195 
1 1 1 1   10 5  o 956.0176 12.55068 177.6250       4.659732      179.0464       5.313987      172.8949       9.693472  959.7154 14.25772 941.8011 26.50282 17.91431       30.09456 
1 1 1 1   10 6  o 1045.868 12.60582 212.5977       5.120069      215.7225       7.310312      209.5889       7.173371  1053.027 17.87592 1037.958 17.79572 15.06934       25.22372 
1 1 1 1   10 7  o 201.9462 26.05401 8.083923       1.995677      6.295232       2.669551      10.34995       3.004712  175.7114 40.01644 227.3661 35.16385 -51.65471      53.27111 
1 1 1 1   10 8  o 530.7689 24.10631 54.93347       4.968945      0.000000       0.000000      54.93347       4.968945  ?        ?        530.7689 24.10631 0.000000       24.10631 
1 1 1 1   10 9  o 607.6091 13.59235 71.79874       3.207353      69.39874       4.549804      74.16959       4.522086  596.8682 19.62846 617.1185 18.86871 -20.25031      27.22692 
1 1 1 1   10 10 o 652.6537 14.00114 82.86663       3.548741      84.06471       5.070414      81.71623       4.968493  656.7286 19.88060 647.5053 19.75847 9.223328       28.02919 
1 1 1 1   10 11 f 1143.991 13.84628 254.6468       6.151542      258.3141       8.812423      251.1615       8.590991  1150.984 19.71506 1134.990 19.49051 15.99353       27.72298 
1 1 1 1   10 12 o 716.6572 16.36219 100.0354       4.553873      97.47792       7.482906      101.5397       5.738969  705.5090 27.31113 721.3988 20.48474 -15.88977      34.13975 
1 1 1 1   10 13 o 611.8932 15.92142 72.91467       3.783427      66.79871       5.200951      79.78876       5.513901  584.7602 22.90219 639.2076 22.21207 -54.44745      31.90433 
1 1 1 1   10 14 o 1077.691 16.89900 226.2218       7.072670      219.0576       12.22402      229.8270       8.671525  1057.048 29.77772 1085.435 20.57140 -28.38684      36.19247 
1 1 1 1   10 15 o 778.0775 22.48981 118.1371       6.795739      0.000000       0.000000      118.1371       6.795739  ?        ?        778.0775 22.48981 0.000000       22.48981 
1 1 1 1   10 16 o 312.0471 28.84381 19.20028       3.455881      18.00010       4.788136      20.50536       4.993006  299.3651 42.36797 320.1616 41.10680 -20.79642      59.03231 
1 1 1 1   10 17 o 350.0836 27.85514 24.08412       3.755762      26.47371       5.064017      21.16286       5.599099  365.7408 36.12492 324.5947 45.68079 41.14609       58.23868 
1 1 1 1   10 18 o 776.2922 23.49393 117.4428       7.082862      117.4428       7.082862      0.000000       0.000000  776.2922 23.49393 ?        ?        0.000000       23.49393 
1 1 1 1   10 19 o 202.4185 62.67315 8.134327       5.432394      -3.292556      7.494438      20.78518       7.885608  143.5872 64.49734 317.4999 66.10222 -173.9126      92.35480 
1 1 1 1   10 20 o 1124.196 19.97429 245.9753       8.720496      258.3369       15.13386      239.8305       10.66999  1149.592 33.89832 1109.373 24.76614 40.21851       41.98163 
1 1 1 1   10 21 o 1363.206 16.81729 361.4853       8.903186      356.4736       12.19568      367.2039       13.02745  1352.639 23.21647 1372.596 24.43929 -19.95715      33.70881 
1 1 1 1   10 22 o 434.8219 29.09937 37.10110       4.885499      36.82883       6.722566      37.40585       7.112162  431.0874 40.63465 434.0202 42.75026 -2.932800      58.98101 
1 1 1 1   10 23 o 565.5684 28.73093 62.68878       6.289758      67.92470       7.553983      50.85339       11.35720  587.8796 33.22319 501.3361 59.49413 86.54349       68.14200 
1 1 1 1   10 24 o 412.5413 37.85466 33.73648       5.997129      34.63224       7.215568      31.73531       10.78491  416.2107 45.37574 389.2622 74.04793 26.94846       86.84499 
1 1 1 1   10 25 o 586.4067 30.64634 67.56765       6.954965      67.56641       8.105968      67.57110       13.54053  585.1400 35.84392 576.4092 61.43578 8.730774       71.12764 
1 1 1 1   10 26 o 605.2867 26.15164 71.70882       6.147353      76.77869       8.234866      65.32738       9.238832  623.6938 34.12769 572.7779 41.82303 50.91589       53.98023 
1 1 1 1   10 27 f 530.9691 30.28572 55.64933       6.219160      58.51715       8.354982      52.08590       9.313291  541.2925 40.02917 507.4987 47.81796 33.79382       62.36098 
1 1 1 1   10 28 o 99.33990 48.01128 -8.415486      5.623833      -11.57621      7.247295      -3.631474      8.916182  110.1248 53.52336 152.5502 69.25846 -42.42542      87.52991 
1 1 1 1   10 29 o 204.6117 82.14806 6.498643       9.963528      6.498643       9.963528      0.000000       0.000000  204.6117 82.14806 ?        ?        0.000000       82.14806 
1 1 1 1   10 30 o 678.7388 27.18081 91.27111       7.164618      85.25365       9.627106      98.74126       10.72640  648.6020 38.39079 697.1070 39.78607 -48.50500      55.28819 
1 1 1 1   10 31 o 163.2024 64.47773 4.377076       6.042138      12.40912       8.558699      -3.603281      8.531114  229.2969 79.14026 143.4750 66.11088 85.82191       103.1205 
1 1 1 1   10 32 o 460.0045 36.85561 43.57132       6.528768      43.55912       9.625521      43.58173       8.885018  442.9595 57.29697 447.8514 52.05650 -4.891846      77.41332 
1 1 1 1   11 0  o 905.2400 12.64577 159.2587       4.445668      160.5235       6.288596      157.9951       6.285654  908.4379 17.82504 901.2433 17.95893 7.194580       25.30326 
1 1 1 1   11 1  o 1241.585 13.41132 299.6252       6.466601      303.1905       9.168330      296.0956       9.122154  1248.344 18.91158 1233.636 19.04068 14.70874       26.83646 
1 1 1 1   11 2  o 341.2693 17.27441 22.71020       2.281980      18.86278       3.065238      27.49385       3.417900  310.0547 25.68783 374.9711 23.59138 -64.91644      34.87718 
1 1 1 1   11 3  o 83.05498 35.12535 0.8561645E-01  1.952341      0.5097930      2.645633      -0.4215791     2.892970  100.2524 41.53296 96.34611 41.78256 3.906288       58.91324 
1 1 1 1   11 4  o 609.8439 13.67457 72.29800       3.238623      70.45140       4.442422      74.39270       4.731438  601.6882 19.01167 618.2393 19.70646 -16.55109      27.38226 
1 1 1 1   11 5  o 665.4277 15.84664 86.11932       4.095114      95.06846       5.093619      69.76216       6.886357  698.9208 18.76595 597.7028 29.66718 101.2181       35.10417 
1 1 1 1   11 6  o 99.64861 38.61948 1.238447       2.133205      1.238447       2.133205      0.000000       0.000000  99.64861 38.61948 ?        ?        0.000000       38.61948 
1 1 1 1   11 7  o 313.3510 19.90129 19.20137       2.409250      18.15735       3.195791      20.57596       3.666996  303.6920 27.39154 323.1017 29.55150 -19.40961      40.29377 
1 1 1 1   11 8  o 728.0757 13.05349 103.0876       3.690891      103.2742       5.268209      102.9077       5.172521  728.1653 18.62966 726.9086 18.32291 1.256653       26.13032 
1 1 1 1   11 9  o 688.0211 13.45115 92.08243       3.594093      93.31936       5.162472      90.91900       5.006735  691.9855 19.21024 683.0709 18.87386 8.914612       26.93058 
1 1 1 1   11 10 o 168.9315 36.33167 5.830737       2.312761      5.201836       3.355929      6.399598       3.191722  161.0841 49.15608 176.3021 46.09638 -15.21796      67.38840 
1 1 1 1   11 11 o 876.1694 15.51359 149.4758       5.278716      154.5438       8.980408      146.8003       6.524959  888.6846 26.02079 867.6265 19.36497 21.05804       32.43584 
1 1 1 1   11 12 o 153.4445 48.92476 4.625586       3.286770      2.401299       6.599862      5.359167       3.790210  162.1775 66.21973 164.7410 52.53950 -2.563522      84.53078 
1 1 1 1   11 13 o 383.3994 25.34690 28.86705       3.752726      30.64520       6.777970      28.08101       4.506484  390.3853 45.56454 377.0570 31.05142 13.32831       55.13908 
1 1 1 1   11 14 o 179.9422 44.36528 6.659862       3.080677      10.34600       4.259455      2.616637       4.461001  223.7949 50.24053 142.8785 55.71528 80.91637       75.02202 
1 1 1 1   11 15 o 120.7277 47.29906 1.747531       3.226644      -5.459812      4.477587      9.533457       4.653841  94.58286 44.93148 214.7144 55.43120 -120.1316      71.35445 
1 1 1 1   11 16 o 358.2292 26.61147 25.18921       3.675738      25.71150       5.073797      24.61232       5.332397  360.2097 36.78640 351.7486 39.73215 8.461121       54.14687 
1 1 1 1   11 17 o 1307.083 15.84686 332.3138       8.044040      346.0061       11.53791      319.3639       11.22071  1332.623 22.29420 1280.236 22.56847 52.38660       31.72329 
1 1 1 1   11 18 o 961.5128 18.63784 179.8999       6.959508      179.5650       8.337401      180.6696       12.63862  960.1698 22.35912 961.2237 33.85690 -1.053894      40.57364 
1 1 1 1   11 19 f 865.9540 20.41929 145.9609       6.866944      144.1420       11.56769      146.9507       8.533155  858.5896 34.69228 868.3243 25.30462 -9.734680      42.94040 
1 1 1 1   11 20 o 638.2108 24.77071 79.38192       6.139466      57.70808       9.649305      94.12408       7.958090  539.7473 46.48739 694.4168 29.50942 -154.6696      55.06254 
1 1 1 1   11 21 o 227.7589 69.64458 10.47114       6.732024      0.000000       0.000000      10.47114       6.732024  ?        ?        227.7589 69.64458 0.000000       69.64458 
1 1 1 1   11 22 o 559.0586 24.32122 60.96793       5.280447      67.47495       7.153626      53.17805       7.827095  586.3979 31.52849 518.8242 39.13460 67.57373       50.25497 
1 1 1 1   11 23 o 614.4666 26.50488 73.75518       6.324876      79.59146       7.770395      62.29628       10.88796  637.5514 31.38339 558.1476 50.78633 79.40375       59.70066 
1 1 1 1   11 24 o 616.8784 34.31443 74.91730       8.188105      74.91730       8.188105      0.000000       0.000000  616.8784 34.31443 ?        ?        0.000000       34.31443 
1 1 1 1   11 25 o 379.3704 45.79461 28.94504       6.610444      22.16653       7.623837      49.47943       13.26928  326.3663 62.42540 487.1864 72.32916 -160.8201      95.54286 
1 1 1 1   11 26 o 507.2332 31.04915 50.76103       6.086808      56.22676       8.273567      44.31250       8.986675  531.1130 40.41563 467.7392 50.26130 63.37381       64.49512 
1 1 1 1   11 27 o 895.5251 21.28060 156.8505       7.400986      168.6913       10.17144      143.5282       10.78898  926.1669 28.27908 852.5403 32.58649 73.62653       43.14610 
1 1 1 1   11 28 o 182.0520 68.84705 5.681554       6.668681      -3.060663      10.32666      11.93515       8.734020  166.2910 75.10783 236.2045 79.98388 -69.91359      109.7206 
1 1 1 1   11 29 o 296.8629 55.61026 18.85484       6.175596      17.90579       8.131097      20.14857       9.493565  280.7019 73.66264 294.3965 80.65321 -13.69464      109.2297 
1 1 1 1   11 30 o 394.1201 41.70386 32.01961       6.286149      31.35188       8.653412      32.76569       9.147027  378.1367 61.00251 385.0338 63.37773 -6.897156      87.96614 
1 1 1 1   11 31 o 283.3845 58.85446 18.02550       6.265370      17.39297       9.065966      18.60380       8.668533  263.9684 80.83782 275.0475 77.71687 -11.07907      112.1368 
1 1 1 1   11 32 o 161.4714 63.05329 4.759065       5.719576      9.762085       8.601180      0.7930021      7.658112  205.9592 78.11654 151.4693 66.77560 54.48988       102.7676 
1 1 1 1   12 0  o 658.2332 13.44261 84.22982       3.436303      85.03569       4.825481      83.40070       4.894588  661.0051 18.79783 654.5830 19.25411 6.422119       26.90872 
1 1 1 1   12 1  o 678.9294 13.36462 89.60928       3.523784      83.63077       4.757584      96.87478       5.244722  655.5259 18.68825 705.4852 19.14285 -49.95929      26.75256 
1 1 1 1   12 2  o 202.4848 28.17885 8.155052       2.155804      7.918183       2.927588      8.435645       3.186358  197.4822 39.55180 203.6312 41.69556 -6.148987      57.47055 
1 1 1 1   12 3  o 801.8284 13.09131 124.9908       4.076548      123.1647       5.657297      126.9630       5.879331  795.4971 18.31228 807.6249 18.74521 -12.12787      26.20539 
1 1 1 1   12 4  o 543.7209 14.82042 57.49782       3.129425      57.72739       4.278199      57.23361       4.589537  544.4259 20.23458 541.9612 21.80583 2.464722       29.74782 
1 1 1 1   12 5  o 661.2402 15.00258 85.05299       3.852594      85.05299       3.852594      0.000000       0.000000  661.2402 15.00258 ?        ?        0.000000       15.00258 
1 1 1 1   12 6  o 771.2402 14.91624 115.7233       4.467628      115.7233       4.467628      0.000000       0.000000  771.2402 14.91624 ?        ?        0.000000       14.91624 
1 1 1 1   12 7  o 505.7997 17.36834 49.81927       3.411653      47.54182       3.964330      56.32187       6.698678  493.8097 20.67199 534.9556 32.39633 -41.14594      38.42985 
1 1 1 1   12 8  o 273.3222 32.23461 14.85848       3.355748      14.85848       3.355748      0.000000       0.000000  273.3222 32.23461 ?        ?        0.000000       32.23461 
1 1 1 1   12 9  o 364.1846 18.58781 25.91913       2.620170      23.87905       3.845909      27.68626       3.579390  347.9378 28.71893 375.5399 24.68028 -27.60214      37.86678 
1 1 1 1   12 10 o 251.4765 29.29294 12.56345       2.807199      3.958364       4.778332      17.09868       3.468954  157.2343 58.51979 293.5705 30.89039 -136.3362      66.17237 
1 1 1 1   12 11 o 542.6279 22.46314 57.50410       4.733698      0.000000       0.000000      57.50410       4.733698  ?        ?        542.6279 22.46314 0.000000       22.46314 
1 1 1 1   12 12 o 390.7441 21.27232 29.88015       3.215854      25.32250       4.580892      34.30883       4.515619  357.4609 33.38491 417.6495 28.00264 -60.18857      43.57408 
1 1 1 1   12 13 o 184.6220 42.96171 7.003235       3.022434      5.015953       4.198800      9.140308       4.354167  163.5554 55.45684 210.0263 53.29537 -46.47089      76.91461 
1 1 1 1   12 14 o 650.7256 16.71792 82.42668       4.224819      86.86235       5.996894      78.05579       5.952941  667.2505 23.14245 632.3773 24.23971 34.87329       33.51323 
1 1 1 1   12 15 o 634.5526 17.45396 78.37148       4.301200      82.89536       6.087621      73.86185       6.078022  651.9205 24.04501 615.2108 25.43960 36.70972       35.00480 
1 1 1 1   12 16 o 1355.771 18.29689 357.7458       9.633662      360.4590       11.68731      351.9951       17.01529  1360.176 22.12542 1341.447 32.66164 18.72949       39.45018 
1 1 1 1   12 17 o 735.4098 17.78170 105.2237       5.078444      108.9419       7.000815      101.0941       7.378033  747.6724 24.11067 719.9819 26.38706 27.69049       35.74355 
1 1 1 1   12 18 o 731.1899 18.16311 104.0132       5.157610      101.6336       6.963446      106.9050       7.676501  722.1793 24.82854 740.4652 26.69504 -18.28595      36.45658 
1 1 1 1   12 19 o 715.3848 38.45280 100.5161       10.64387      100.5161       10.64387      0.000000       0.000000  715.3848 38.45280 ?        ?        0.000000       38.45280 
1 1 1 1   12 20 o 794.4926 22.12356 122.9525       6.826104      121.1058       11.23575      124.0328       8.593935  786.3368 36.79301 797.2607 27.75644 -10.92389      46.08845 
1 1 1 1   12 21 o 896.7858 18.25532 156.5455       6.357790      151.9072       8.510759      162.4023       9.563596  882.4818 24.83331 912.0820 26.99972 -29.60022      36.68349 
1 1 1 1   12 22 o 1083.081 18.01727 228.3901       7.578412      245.0286       10.71660      211.7461       10.71839  1120.546 24.62630 1041.258 26.50592 79.28809       36.18036 
1 1 1 1   12 23 o 635.4668 24.18571 78.81757       5.968699      74.89722       7.744631      84.55231       9.366895  617.3727 32.41508 654.9257 36.97898 -37.55304      49.17502 
1 1 1 1   12 24 o 645.9661 33.16043 82.10477       8.290709      82.10477       8.290709      0.000000       0.000000  645.9661 33.16043 ?        ?        0.000000       33.16043 
1 1 1 1   12 25 o 400.4461 37.24971 31.89466       5.726464      42.29903       7.824340      19.89293       8.403531  459.5431 44.39520 305.3955 72.02453 154.1476       84.60772 
1 1 1 1   12 26 o 373.8921 39.81051 28.05071       5.691676      28.38341       7.791101      27.66995       8.334877  370.5694 55.87394 363.6817 61.18562 6.887756       82.85878 
1 1 1 1   12 27 o 469.9263 38.08984 44.24054       6.891508      33.56572       10.72279      51.75296       8.995334  392.9877 72.94441 504.8861 46.39619 -111.8984      86.44937 
1 1 1 1   12 28 o 122.7219 57.07399 -4.891861      6.582007      -13.32527      10.25948      1.007285       8.580619  135.2262 65.22992 167.8255 72.36961 -32.59935      97.42845 
1 1 1 1   12 29 o 624.4545 38.71035 78.97737       9.341355      78.97737       9.341355      0.000000       0.000000  624.4545 38.71035 ?        ?        0.000000       38.71035 
1 1 1 1   12 30 o 359.4594 45.69426 27.12978       6.234651      21.72112       8.506461      33.40763       9.164523  304.0658 72.96717 387.2429 63.11354 -83.17712      96.47552 
1 1 1 1   12 31 o 527.6735 31.92590 56.39124       6.511590      72.26132       10.04536      44.89025       8.551519  586.6049 44.42484 458.1583 48.81346 128.4465       66.00243 
1 1 1 1   13 0  o 989.6758 13.44471 190.4682       5.167403      189.9013       7.177207      191.0783       7.445815  987.5219 18.71461 990.4791 19.35704 -2.957153      26.92455 
1 1 1 1   13 1  o 482.2715 15.79878 45.25542       2.958988      44.21056       4.019264      46.49187       4.372270  476.2372 21.73178 488.2510 23.05875 -12.01389      31.68559 
1 1 1 1   13 2  o 192.8871 31.78016 7.473062       2.297679      7.141043       3.050121      7.908667       3.493674  186.6874 42.96198 196.1894 46.55426 -9.501968      63.34849 
1 1 1 1   13 3  o 398.4413 17.89082 30.91367       2.768360      34.90590       3.831465      26.55300       4.004361  422.3188 23.45358 367.4340 28.27973 54.88489       36.73980 
1 1 1 1   13 4  o 1163.153 15.74018 263.3051       7.110076      267.5745       8.786112      255.2043       12.10272  1171.873 19.30582 1142.523 27.27659 29.35034       33.41746 
1 1 1 1   13 5  o 740.4715 19.41105 106.8580       5.581942      106.8580       5.581942      0.000000       0.000000  740.4715 19.41105 ?        ?        0.000000       19.41105 
1 1 1 1   13 6  o 389.7829 17.81403 29.59874       2.696578      28.38678       3.002982      34.64514       6.127708  380.9903 20.36981 417.5769 38.20982 -36.58667      43.30033 
1 1 1 1   13 7  o 647.0359 14.38079 81.47735       3.613593      82.11395       4.076560      79.14252       7.807120  649.3655 16.16503 634.9448 31.66116 14.42065       35.54909 
1 1 1 1   13 8  o 507.5624 15.11975 50.15387       2.980315      50.62154       4.288508      49.71703       4.144770  509.2260 21.68541 504.7221 21.14561 4.503967       30.28851 
1 1 1 1   13 9  o 294.5691 31.16503 17.22041       3.511049      0.000000       0.000000      17.22041       3.511049  ?        ?        294.5691 31.16503 0.000000       31.16503 
1 1 1 1   13 10 f 701.1776 16.46255 95.75853       4.482839      94.96520       7.948067      96.12864       5.428719  695.9511 29.40728 702.0370 19.91175 -6.085938      35.51430 
1 1 1 1   13 11 o 463.8596 17.84617 41.92225       3.214841      37.48331       4.644325      46.00583       4.454555  436.7527 27.52238 485.3073 23.63521 -48.55463      36.27816 
1 1 1 1   13 12 o 563.7958 16.85324 61.89330       3.690057      60.20168       5.243441      63.55315       5.193969  555.2081 24.31826 570.5693 23.44029 -15.36121      33.77610 
1 1 1 1   13 13 o 331.8794 26.18291 21.64693       3.347222      19.54492       4.757648      23.70713       4.710083  312.6227 40.11240 345.7391 35.58775 -33.11642      53.62362 
1 1 1 1   13 14 o 998.9463 15.18247 194.1136       5.889965      195.0806       8.290093      193.1279       8.369814  1000.564 21.33470 995.4916 21.64961 5.072266       30.39532 
1 1 1 1   13 15 o 516.2427 23.12357 51.94157       4.635930      51.83800       5.546696      52.18159       8.443801  514.5573 27.86081 513.4415 42.73483 1.115845       51.01461 
1 1 1 1   13 16 o 1067.643 15.52189 221.6701       6.435743      230.1703       9.150765      213.3504       9.053052  1087.140 21.67424 1046.578 22.27385 40.56165       31.07888 
1 1 1 1   13 17 o 581.2414 20.20673 65.75702       4.561215      67.71221       6.232705      63.50242       6.692919  589.2489 27.23640 569.5439 30.36904 19.70502       40.79338 
1 1 1 1   13 18 o 343.3446 31.08552 23.20362       4.099975      25.56188       5.457648      20.14865       6.211751  359.0449 39.81089 315.6018 52.52745 43.44308       65.90932 
1 1 1 1   13 19 o 504.9273 24.12534 49.68375       4.730753      48.75818       6.258292      50.91776       7.226201  498.4357 32.50896 508.6525 36.83074 -10.21680      49.12572 
1 1 1 1   13 20 o 1222.535 19.94384 291.0301       9.468872      296.9554       16.22958      287.9723       11.65886  1231.657 33.93042 1215.188 24.70499 16.46985       41.97154 
1 1 1 1   13 21 o 112.3813 50.58472 -2.189907      4.637548      -1.408507      6.126421      -3.238531      7.097088  136.0797 59.86877 138.7413 62.50151 -2.661591      86.54887 
1 1 1 1   13 22 o 660.9963 22.46478 85.20693       5.766725      91.31730       7.744071      77.60084       8.640060  683.2734 29.18414 627.7893 35.58482 55.48407       46.02166 
1 1 1 1   13 23 o 1085.801 21.65948 229.9261       9.133270      225.0132       10.76376      242.5587       17.25984  1073.156 25.82696 1109.416 40.06034 -36.25964      47.66406 
1 1 1 1   13 24 o 514.6230 33.84160 52.26699       6.725726      55.06755       8.257210      46.74603       11.59359  526.4299 40.70547 476.5924 64.27834 49.83755       76.08312 
1 1 1 1   13 25 o 259.3539 57.66515 14.11330       5.657744      16.74387       7.530563      10.70410       8.572910  279.7457 69.59954 231.4662 79.23853 48.27950       105.4649 
1 1 1 1   13 26 o 584.8669 39.31108 68.34254       8.877073      68.34254       8.877073      0.000000       0.000000  584.8669 39.31108 ?        ?        0.000000       39.31108 
1 1 1 1   13 27 o 550.7917 35.33852 60.56659       7.519101      65.39214       11.58583      57.05513       9.883204  562.6405 53.67443 528.0650 48.74294 34.57550       72.50393 
1 1 1 1   13 28 o 201.0976 65.96108 8.579689       5.948550      -0.8870896     7.941062      20.68382       8.979336  152.7372 67.63206 300.6432 76.66833 -147.9060      102.2357 
1 1 1 1   13 29 o 236.7876 64.23898 12.62051       6.057289      17.31159       8.189900      6.955652       8.999873  271.9553 75.07901 197.9226 78.53448 74.03270       108.6486 
1 1 1 1   13 30 o 209.3844 65.91718 10.02456       5.981287      12.25791       8.528378      7.862620       8.390930  227.2119 78.96695 197.1776 76.54473 30.03435       109.9767 
1 1 1 1   13 31 o 148.8708 61.11488 3.009111       5.659539      5.224535       8.046124      0.8396984      7.962132  177.1082 72.80755 154.2875 68.04946 22.82068       99.65775 
1 1 1 1   14 0  o 452.6685 17.00613 39.90465       2.989604      39.11282       4.049019      40.85375       4.432886  446.9719 23.40748 456.5616 25.09745 -9.589722      34.31898 
1 1 1 1   14 1  o 757.4755 13.96333 111.6331       4.107574      116.0826       5.760079      107.0293       5.859162  771.7429 19.21887 740.8682 20.36416 30.87463       28.00114 
1 1 1 1   14 2  o 1052.051 13.78867 215.3391       5.633615      222.0491       8.003542      208.7497       7.931222  1067.313 19.30912 1034.768 19.73645 32.54480       27.61104 
1 1 1 1   14 3  o 1145.955 15.89766 255.6770       7.075035      258.5557       8.735694      250.1889       12.06173  1151.606 19.53284 1130.601 27.47086 21.00476       33.70727 
1 1 1 1   14 4  o 140.3928 46.13105 3.768518       2.909052      4.129792       3.443708      2.868394       5.435749  148.5325 50.22403 154.5001 61.11956 -5.967606      79.10786 
1 1 1 1   14 5  o 543.1866 18.74588 57.51701       3.954420      64.46889       4.791361      42.66541       7.003173  574.7274 21.46688 463.1926 39.30280 111.5348       44.78323 
1 1 1 1   14 6  o 804.9047 13.79796 126.0749       4.313079      123.2392       4.822332      137.4140       9.643036  795.5601 15.60832 837.0446 29.66451 -41.48450      33.52018 
1 1 1 1   14 7  o 242.6584 28.62974 11.69654       2.646040      10.92459       2.968821      14.67874       5.835224  233.3610 33.73818 265.0178 58.28179 -31.65683      67.34265 
1 1 1 1   14 8  o 191.3988 64.54899 7.075071       5.688146      0.000000       0.000000      7.075071       5.688146  ?        ?        191.3988 64.54899 0.000000       64.54899 
1 1 1 1   14 9  o 345.8987 22.78788 23.46392       3.043978      28.22917       5.126135      20.86838       3.783213  377.1173 35.41631 324.8250 30.34185 52.29233       46.63628 
1 1 1 1   14 10 o 195.1101 36.35995 7.725513       2.653697      7.876836       4.009017      7.607505       3.540320  195.2699 51.95552 191.9894 47.69576 3.280472       70.52845 
1 1 1 1   14 11 o 339.3351 23.24387 22.57658       3.044673      24.58846       4.528038      20.91630       4.113401  352.4576 33.48284 324.9099 33.06001 27.54770       47.05384 
1 1 1 1   14 12 o 1034.764 14.46641 208.2815       5.813396      203.9179       8.180510      212.7334       8.262874  1022.937 20.59224 1044.855 20.36324 -21.91846      28.96035 
1 1 1 1   14 13 o 1029.832 31.83306 207.5204       12.73130      0.000000       0.000000      207.5204       12.73130  ?        ?        1029.832 31.83306 0.000000       31.83306 
1 1 1 1   14 14 o 891.1728 15.64830 154.4727       5.415731      157.1149       7.703877      151.8911       7.614898  898.0140 22.09013 882.9434 22.20769 15.07062       31.32339 
1 1 1 1   14 15 o 719.4785 17.16422 100.7010       4.795898      92.55997       6.585485      109.8943       6.998158  689.1142 24.60756 750.9437 23.99653 -61.82947      34.37100 
1 1 1 1   14 16 o 1277.519 15.86017 317.3707       7.868706      317.8232       10.96692      316.8906       11.29645  1277.552 22.10437 1275.560 22.80410 1.991821       31.75894 
1 1 1 1   14 17 o 423.8719 26.38476 35.16021       4.321721      37.12767       5.708446      32.51828       6.614931  434.5131 34.10275 404.9408 42.70768 29.57230       54.65293 
1 1 1 1   14 18 o 1128.185 16.46561 247.5541       7.214165      248.3296       9.932351      246.6880       10.49568  1129.127 22.65069 1125.172 24.01949 3.954834       33.01499 
1 1 1 1   14 19 o 1253.725 16.74723 305.7974       8.154048      311.3608       11.42977      300.0313       11.63613  1263.951 23.28515 1240.569 24.15237 23.38269       33.54900 
1 1 1 1   14 20 o 427.4668 36.00604 36.08110       5.921650      30.71367       9.822936      39.14528       7.421890  385.7738 68.05375 443.7155 43.63500 -57.94177      80.84136 
1 1 1 1   14 21 o 457.0840 29.87420 41.04271       5.273814      41.25563       7.048361      40.77188       7.949237  456.1591 40.19812 452.0432 45.91859 4.115875       61.02790 
1 1 1 1   14 22 o 461.0706 36.37370 42.01926       6.460133      48.06196       7.504896      24.73486       12.69276  492.5385 39.56925 338.2025 93.50735 154.3359       101.5350 
1 1 1 1   14 23 o 363.3802 39.40078 26.32978       5.471171      33.57681       7.128355      15.94027       8.535071  409.2015 45.63359 274.2414 76.98582 134.9601       89.49436 
1 1 1 1   14 24 o 166.6357 63.42890 4.198491       5.683619      13.29837       6.908012      -14.86850      9.999456  250.5594 68.86362 132.1667 63.91113 118.3927       93.95122 
1 1 1 1   14 25 o 180.4646 64.75340 5.926090       5.770163      11.00907       7.245754      -2.885500      9.540064  229.2722 72.59298 162.5255 72.90294 66.74672       102.8814 
1 1 1 1   14 26 o 583.5557 33.38136 67.64840       7.533685      80.35163       12.24954      59.92033       9.554290  627.2386 50.72149 543.7514 45.66788 83.48718       68.25120 
1 1 1 1   14 27 o 547.1137 40.89323 60.51799       8.625924      60.51799       8.625924      0.000000       0.000000  547.1137 40.89323 ?        ?        0.000000       40.89323 
1 1 1 1   14 28 o 243.1181 61.94388 13.08801       5.865145      3.288735       7.818744      25.69775       8.869379  171.5580 71.26346 338.1243 69.85551 -166.5663      99.79115 
1 1 1 1   14 29 o 198.7652 66.18809 8.715926       5.981272      5.992645       8.416209      11.49503       8.502036  187.7151 75.45235 223.8304 78.78246 -36.11534      109.0859 
1 1 1 1   14 30 o 144.9733 60.95966 2.091873       5.825974      7.560329       8.094028      -3.787204      8.392414  192.6848 75.07294 140.2760 64.96416 52.40881       99.27885 
1 1 1 1   15 0  o 304.7855 23.65359 18.26031       2.777819      19.50128       3.748040      16.74794       4.137654  313.6744 31.18109 289.0130 37.76780 24.66138       48.97619 
1 1 1 1   15 1  o 743.6724 16.44430 107.7210       4.749250      111.8032       5.865156      99.94738       8.093625  757.0831 19.94840 713.9766 29.18980 43.10657       35.35510 
1 1 1 1   15 2  o 160.9750 44.78170 5.300250       2.901643      8.057985       3.507217      -0.6823812     5.165739  197.4482 46.50531 127.4727 55.55389 69.97546       72.44984 
1 1 1 1   15 3  o 106.1940 42.21443 1.206979       2.604788      -0.7092884     3.415725      3.870035       4.026659  102.4409 44.89465 150.0736 54.06713 -47.63270      70.27648 
1 1 1 1   15 4  o 200.8365 36.46070 8.187681       2.739040      7.227854       3.658677      9.411586       4.131441  186.9886 49.57711 212.9185 50.69316 -25.92990      70.90618 
1 1 1 1   15 5  o 167.6274 42.66595 5.780717       2.784568      4.904179       3.681197      6.953059       4.257264  158.9219 51.87764 184.6639 55.14605 -25.74199      75.71246 
1 1 1 1   15 6  o 618.8531 23.18194 74.81474       5.571413      75.25748       7.840077      74.36305       7.918848  617.9940 32.78417 614.1505 33.32638 3.843445       46.74879 
1 1 1 1   15 7  o 637.6084 17.64525 79.20924       4.369280      75.52829       5.116497      89.12351       8.396975  622.1544 21.17613 673.7139 32.09367 -51.55945      38.45038 
1 1 1 1   15 8  o 312.2238 27.34157 19.21819       3.281850      19.71444       3.821867      17.82489       6.403945  315.4738 31.62061 293.1281 58.30713 22.34573       66.32936 
1 1 1 1   15 9  o 423.2538 22.74461 35.05879       3.724879      37.28489       4.415493      29.56476       6.936683  435.9810 26.20017 383.2831 47.62885 52.69788       54.35951 
1 1 1 1   15 10 o 848.3123 14.34621 139.9929       4.726296      137.8960       6.746950      142.0133       6.622765  841.1086 20.65510 853.6779 19.97640 -12.56927      28.73482 
1 1 1 1   15 11 o 122.0243 45.43598 2.263427       2.881165      7.649009       4.352739      -1.936228      3.843733  193.6168 55.19817 101.7612 45.90516 91.85561       71.79221 
1 1 1 1   15 12 o 792.7741 18.24506 122.3374       5.617238      122.8057       6.741525      121.2739       10.15909  793.8669 21.86666 787.0951 33.23531 6.771790       39.78362 
1 1 1 1   15 13 o 903.1254 15.24571 158.6256       5.347168      157.2144       7.660159      159.9668       7.467592  898.3455 21.95667 906.2722 21.21749 -7.926697      30.53321 
1 1 1 1   15 14 o 891.7153 15.86222 154.6408       5.493110      154.0311       7.900781      155.2114       7.642517  889.2113 22.87900 892.7147 22.04427 -3.503357      31.77103 
1 1 1 1   15 15 o 519.0785 21.19343 52.45507       4.272306      49.02277       5.998256      55.98923       6.086619  500.1237 31.03625 534.8430 29.41673 -34.71924      42.76205 
1 1 1 1   15 16 o 986.0801 16.34433 189.0964       6.259032      186.0209       8.605551      192.5508       9.120055  977.3414 22.67276 994.2233 23.62031 -16.88184      32.74100 
1 1 1 1   15 17 o 914.5397 17.16104 162.6929       6.095006      166.8709       8.499482      158.2701       8.745045  925.4758 23.64827 901.1345 24.98874 24.34137       34.40462 
1 1 1 1   15 18 o 645.9974 20.25675 81.25581       5.081929      81.36892       6.784687      81.11123       7.670408  645.7520 27.05429 644.2814 30.65595 1.470520       40.88670 
1 1 1 1   15 19 o 243.7883 48.17385 12.13513       4.399194      10.03455       5.832377      14.90742       6.700339  221.4039 64.13250 267.6712 65.08602 -46.26729      91.37378 
1 1 1 1   15 20 o 655.7560 26.12635 83.96854       6.653482      73.50604       10.52740      90.92740       8.585629  608.6743 44.85170 681.3560 32.44666 -72.68170      55.35757 
1 1 1 1   15 21 o 1133.726 21.28383 250.5744       9.371004      244.4199       11.07350      266.1021       17.58893  1118.756 25.48717 1162.935 38.94539 -44.17834      46.54395 
1 1 1 1   15 22 f 884.4800 23.35703 152.7065       8.022942      149.0719       9.223333      164.0072       16.26343  873.0753 27.20246 908.5905 46.24378 -35.51526      53.65129 
1 1 1 1   15 23 o 151.1242 59.69955 2.767721       5.179289      8.100582       6.832725      -4.435015      7.940768  205.5951 70.72573 142.1520 64.85435 63.44310       95.95946 
1 1 1 1   15 24 o 160.5136 63.21627 3.350109       5.791022      6.145448       7.076534      -2.317144      10.07604  190.6246 71.16254 169.9070 75.65871 20.71758       103.8670 
1 1 1 1   15 25 f 599.4994 35.59320 71.48847       8.249594      90.08773       12.07958      55.23135       11.29343  667.5952 46.88932 516.8299 57.22703 150.7653       73.98339 
1 1 1 1   15 26 o 288.1671 62.76255 17.95700       6.824925      28.30994       10.78747      11.04719       8.812946  353.9912 80.31245 229.6927 80.24844 124.2985       113.5337 
1 1 1 1   15 27 o 561.0213 28.95749 62.51248       6.287598      57.54143       8.423256      68.76778       9.448873  532.2104 41.07153 581.4062 42.13363 -49.19580      58.83972 
1 1 1 1   15 28 o 219.3410 65.28984 10.80692       5.974671      19.44853       8.216210      1.109251       8.703776  289.2016 73.11435 165.6050 72.14343 123.5965       102.7151 
1 1 1 1   15 29 o 188.2884 65.55521 7.701631       5.878714      1.638453       8.192313      14.13815       8.440767  161.7518 70.22938 241.2020 78.54669 -79.45015      105.3648 
1 1 1 1   15 30 o 263.3542 60.71597 15.95588       6.082596      13.00671       8.671027      18.81309       8.534771  228.9451 79.62150 274.1211 76.99587 -45.17603      110.7608 
1 1 1 1   16 0  o 192.3518 42.34465 7.606273       3.077501      4.193254       3.707913      15.16301       5.517309  151.0433 52.09283 270.4730 54.41105 -119.4297      75.32745 
1 1 1 1   16 1  o 351.5956 25.48185 24.30413       3.455772      28.55332       4.210955      15.53949       6.047761  380.6492 28.69679 272.7594 58.82316 107.8898       65.44975 
1 1 1 1   16 2  o 241.2689 30.96408 11.60547       2.834314      16.60033       3.863358      5.783621       4.170939  288.3362 35.23454 171.3700 55.16400 116.9661       65.45640 
1 1 1 1   16 3  o 312.9499 24.97043 19.26785       3.009526      23.10928       4.022223      14.38192       4.536205  341.8836 30.61853 265.6078 45.62049 76.27582       54.94291 
1 1 1 1   16 4  o 790.0959 17.50424 121.6184       5.370948      128.8766       9.438833      118.1429       6.531464  810.7378 29.97850 778.0483 21.61603 32.68951       36.95894 
1 1 1 1   16 5  o 511.1302 21.57949 50.97842       4.283519      42.22741       7.012823      56.18642       5.410018  460.9391 39.55945 536.0151 25.98925 -75.07608      47.33277 
1 1 1 1   16 6  o 852.1910 16.23643 141.3938       5.373478      142.9500       6.362022      137.5206       10.03695  856.4254 19.12836 837.5291 30.85844 18.89624       36.30616 
1 1 1 1   16 7  o 658.0992 17.33106 84.33749       4.429397      81.01427       5.106036      94.44284       8.903892  644.6495 20.39540 693.8092 33.04546 -49.15973      38.83265 
1 1 1 1   16 8  o 138.4234 45.69704 3.626591       2.853343      3.398106       3.190736      4.538813       6.375467  138.2861 48.28757 175.8793 67.12341 -37.59325      82.68761 
1 1 1 1   16 9  o 754.2155 15.51095 110.6744       4.543200      106.7467       5.103096      125.6849       9.976119  740.4856 17.74554 801.1508 32.06413 -60.66516      36.64713 
1 1 1 1   16 10 o 927.1073 17.30154 167.2782       6.229351      164.3399       7.411952      174.3458       11.49551  918.4704 20.77971 944.0599 31.35456 -25.58948      37.61522 
1 1 1 1   16 11 o 117.8980 45.64114 1.767826       2.976846      4.469705       4.470759      -0.3841459     3.989942  160.6628 57.06672 114.1096 49.27737 46.55318       75.39807 
1 1 1 1   16 12 o 1196.819 15.05142 278.5419       6.995747      272.8776       9.861287      284.2808       9.925990  1183.695 21.45189 1208.224 21.15428 -24.52869      30.12785 
1 1 1 1   16 13 o 361.3171 25.64718 25.57645       3.575406      25.43379       5.392555      25.68836       4.776147  358.1463 39.42377 360.8222 34.50518 -2.675903      52.39123 
1 1 1 1   16 14 o 131.4998 49.60158 2.493202       3.455822      0.9632934      5.097502      3.794404       4.701073  138.4044 57.52045 156.5924 58.09142 -18.18802      81.75093 
1 1 1 1   16 15 o 953.0972 23.23253 176.9312       8.599273      176.9312       8.599273      0.000000       0.000000  953.0972 23.23253 ?        ?        0.000000       23.23253 
1 1 1 1   16 16 o 350.8908 30.54723 24.22070       4.121139      29.70236       5.879222      18.92538       5.778425  387.3216 39.64462 306.0379 50.37198 81.28366       64.10173 
1 1 1 1   16 17 o 278.3281 41.63570 15.53982       4.362141      27.19515       6.172195      3.908602       6.165808  369.3694 43.88680 170.2948 65.75298 199.0746       79.05382 
1 1 1 1   16 18 o 1444.266 16.97528 405.9057       9.521214      392.4852       12.78928      422.5918       14.26062  1418.867 23.21006 1471.823 24.94910 -52.95581      34.07587 
1 1 1 1   16 19 o 986.7285 18.01337 189.5561       6.902728      191.6655       9.434076      187.1257       10.12653  991.0935 24.51076 978.8547 26.63878 12.23877       36.19948 
1 1 1 1   16 20 o 645.7766 33.82304 81.99451       8.452977      75.61070       10.82070      91.99001       13.53996  616.9334 45.48443 678.6389 51.76534 -61.70544      68.90924 
1 1 1 1   16 21 o 160.3280 68.04525 0.6890661      7.368190      1.843665       9.146982      -1.444688      12.43467  182.5452 76.55096 195.0499 85.56499 -12.50473      114.8104 
1 1 1 1   16 22 o 548.8544 27.27222 58.96278       5.813072      55.39288       7.650009      63.84063       8.942282  528.8498 37.49087 566.9135 40.89109 -38.06372      55.47654 
1 1 1 1   16 23 o 199.8937 62.27474 8.165079       5.354202      10.45807       7.245391      5.406410       7.947140  225.6325 72.71376 191.6458 74.46632 33.98668       104.0794 
1 1 1 1   16 24 o 401.8081 50.77422 33.06189       7.746150      33.54590       10.86707      32.56195       11.04450  394.2127 73.69238 386.9707 76.20387 7.242004       106.0075 
1 1 1 1   16 25 o 183.8657 71.52650 5.282599       7.338638      3.616988       9.971594      7.250749       10.83944  192.0578 80.18687 215.5373 85.97793 -23.47952      117.5676 
1 1 1 1   16 26 o 154.8388 61.86400 3.149663       5.620636      8.119418       7.642164      -2.706200      8.295533  203.3471 74.29781 148.7088 67.22816 54.63828       100.1988 
1 1 1 1   16 27 o 423.7185 36.39621 36.36189       5.930967      40.51748       8.214628      31.83676       8.572096  440.4541 48.84669 383.5458 59.47538 56.90836       76.96311 
1 1 1 1   16 28 o 169.3904 63.22417 5.495305       5.585289      7.657179       7.988488      3.427872       7.812049  195.6810 75.02790 169.2625 70.84810 26.41850       103.1922 
1 1 1 1   16 29 o 155.9704 62.10741 3.938824       5.647013      4.129448       7.921645      3.741869       8.052119  171.3975 71.50818 170.0809 71.59938 1.316605       101.1923 
1 1 1 1   17 0  o 863.5670 16.67359 145.2183       5.591819      141.6607       6.739165      153.0810       10.01874  852.3312 20.35962 884.0594 29.18123 -31.72827      35.58171 
1 1 1 1   17 1  o 475.8781 19.01421 44.13426       3.514002      44.52953       4.809729      43.68171       5.146439  476.5403 26.08826 471.5739 28.23128 4.966400       38.43959 
1 1 1 1   17 2  o 141.1509 46.40073 3.798921       2.943043      2.050987       3.945429      5.991526       4.418876  132.2445 52.14859 175.1077 56.82265 -42.86325      77.12515 
1 1 1 1   17 3  o 1072.423 17.23837 223.9624       7.179436      207.0447       11.80657      233.8884       9.043598  1028.270 29.56572 1095.113 21.26445 -66.84290      36.41852 
1 1 1 1   17 4  o 514.3393 18.80942 51.53858       3.757103      50.85523       5.108593      52.34364       5.544872  509.5198 25.90266 516.6127 27.73896 -7.092834      37.95258 
1 1 1 1   17 5  o 477.0127 22.89132 44.39211       4.240614      46.96018       6.688174      42.66565       5.483825  487.7493 35.55362 465.8289 30.48110 21.92047       46.83116 
1 1 1 1   17 6  o 591.8226 19.17101 68.22427       4.406202      77.27164       5.294940      47.85126       7.945611  629.5714 21.65649 491.0082 42.07519 138.5632       47.32151 
1 1 1 1   17 7  o 345.8021 24.11053 23.43981       3.217631      21.98947       3.583051      29.48206       7.313352  334.3412 27.84858 382.6672 50.44084 -48.32605      57.61789 
1 1 1 1   17 8  o 1061.884 14.70743 219.3086       6.065155      222.3584       6.922281      209.2302       12.58366  1068.995 16.67422 1034.240 31.32981 34.75537       35.49066 
1 1 1 1   17 9  o 238.8379 35.15701 11.40536       3.163384      8.330521       3.540074      23.59085       7.047299  201.6934 46.18932 340.8864 55.11430 -139.1930      71.90994 
1 1 1 1   17 10 o 442.6925 21.61792 38.17155       3.716584      38.41630       4.216418      37.31896       7.869664  443.2349 24.59175 432.6754 47.62295 10.55951       53.59757 
1 1 1 1   17 11 o 1314.664 15.20254 336.0809       7.761734      339.9100       11.10105      332.4186       10.85654  1321.171 21.63600 1306.572 21.39586 14.59863       30.42859 
1 1 1 1   17 12 o 186.1364 45.51231 7.076619       3.262483      3.250810       4.974866      9.963517       4.321510  154.4343 59.20930 220.5215 51.40928 -66.08714      78.41336 
1 1 1 1   17 13 o 624.8843 18.17329 75.96355       4.410228      67.57355       6.361652      83.72674       6.119408  588.6309 27.82908 655.5817 24.03558 -66.95074      36.77182 
1 1 1 1   17 14 o 709.1273 17.63888 97.81785       4.857615      95.88594       7.135144      99.48682       6.631844  701.3395 26.19669 714.6216 23.89627 -13.28217      35.45840 
1 1 1 1   17 15 o 545.3835 21.35202 57.91663       4.522401      55.57691       6.649546      59.93025       6.168764  532.3452 32.31697 553.4189 28.80176 -21.07373      43.28889 
1 1 1 1   17 16 o 136.4080 52.97742 2.353387       4.020783      1.650321       6.036236      2.914144       5.390832  153.2922 63.04462 155.5684 61.08071 -2.276230      87.78085 
1 1 1 1   17 17 o 1426.452 16.77978 395.9364       9.295474      406.0077       13.35116      386.4618       12.94961  1442.942 23.82551 1407.815 23.68552 35.12622       33.59551 
1 1 1 1   17 18 o 966.1381 17.96687 181.7231       6.741236      181.5159       9.323404      181.9501       9.758574  964.4317 24.89288 965.3594 26.02971 -0.9276733     36.01668 
1 1 1 1   17 19 o 439.8280 31.85302 38.08279       5.403939      42.03042       7.345675      33.42618       7.978082  460.0596 41.56280 407.2664 51.59925 52.79321       66.25669 
1 1 1 1   17 20 o 210.7321 74.31716 8.172538       7.569147      12.77153       9.748928      1.192713       12.01013  252.7890 84.50868 202.2791 86.38817 50.50987       120.8496 
1 1 1 1   17 21 o 229.8802 64.47323 11.02402       5.988981      11.84452       9.167013      10.41302       7.910600  243.4713 81.94497 228.6973 76.11629 14.77393       111.8422 
1 1 1 1   17 22 o 419.1263 34.78508 34.85236       5.610781      44.67134       7.678198      23.60130       8.219070  472.6328 42.27839 334.7227 65.57357 137.9101       78.02151 
1 1 1 1   17 23 o 358.4192 41.44035 25.90097       5.661871      28.47379       7.682208      22.84170       8.377027  371.1346 54.96157 326.4976 68.26323 44.63705       87.63928 
1 1 1 1   17 24 o 430.5009 42.41673 37.47173       6.999384      44.13433       11.05315      33.01141       9.043726  456.7469 64.07664 395.7200 60.79250 61.02686       88.32635 
1 1 1 1   17 25 o 259.4426 62.88974 14.68054       6.270567      14.85807       7.698931      14.33072       10.80755  257.8771 73.37326 254.4872 88.86932 3.389862       115.2449 
1 1 1 1   17 26 o 402.3624 37.74826 32.84195       5.829555      48.85076       8.111372      15.73954       8.383849  488.3208 43.21852 261.0492 77.25829 227.2716       88.52505 
1 1 1 1   17 27 o 325.1814 44.74277 22.13741       5.500703      24.92617       7.773702      19.34079       7.784647  335.0221 62.03302 289.2676 70.04318 45.75449       93.56358 
1 1 1 1   17 28 o 535.4427 28.50551 57.48289       5.906130      55.11192       8.256528      59.96743       8.451960  515.2061 41.62103 538.2573 40.73500 -23.05127      58.23787 
1 1 1 1   18 0  o 600.8085 19.96739 70.32947       4.658922      69.59651       5.504799      72.17996       8.746754  597.2540 23.73310 604.9905 37.41164 -7.736450      44.30452 
1 1 1 1   18 1  o 833.8727 18.10356 135.3921       5.862620      142.7989       10.35220      131.8951       7.113208  854.0649 31.21143 822.4532 22.27032 31.61176       38.34214 
1 1 1 1   18 2  o 454.7441 20.87924 40.29893       3.687311      40.92299       4.937684      39.51217       5.544137  456.7614 27.97069 448.0752 32.07278 8.686188       42.55611 
1 1 1 1   18 3  o 422.0833 25.23930 34.89389       4.118206      34.58464       6.486595      35.10272       5.330245  417.3831 40.52882 422.1119 32.77250 -4.728851      52.12123 
1 1 1 1   18 4  o 467.6883 24.29799 42.78141       4.398011      37.07231       6.681284      47.14668       5.842265  432.4297 40.24682 489.9886 30.85971 -57.55890      50.71616 
1 1 1 1   18 5  o 453.8398 21.47581 40.13260       3.785124      36.12228       4.995180      45.54043       5.800612  428.8111 30.18821 481.5504 31.18481 -52.73929      43.40300 
1 1 1 1   18 6  o 297.5399 34.24516 17.55741       3.884873      15.98130       4.591990      21.52580       7.286425  281.8623 43.33828 323.9638 60.12862 -42.10147      74.11922 
1 1 1 1   18 7  f 792.1033 15.39499 122.0284       4.735754      121.0521       5.326808      125.7099       10.34400  788.7532 17.38993 801.6078 33.22755 -12.85461      37.50307 
1 1 1 1   18 8  o 1126.203 14.85693 246.6333       6.497910      239.2993       7.238711      277.0639       14.74498  1109.110 16.80577 1190.597 31.88977 -81.48706      36.04708 
1 1 1 1   18 9  o 282.4803 31.34498 15.77577       3.380643      14.72012       3.817637      19.61121       7.276820  271.7319 37.14956 308.7989 62.81707 -37.06699      72.97996 
1 1 1 1   18 10 o 846.0806 15.99807 139.2089       5.256628      140.4935       5.994869      134.9355       10.93410  849.7930 18.16513 830.8449 33.88714 18.94806       38.44880 
1 1 1 1   18 11 o 597.4104 21.83675 69.48751       5.066275      75.02174       6.114874      57.37208       9.047492  620.4539 25.37757 538.9852 43.59721 81.46863       50.44539 
1 1 1 1   18 12 o 734.6996 16.91226 104.9821       4.825468      108.9934       7.130533      101.5929       6.554307  747.9399 24.54863 722.2164 23.36854 25.72357       33.89283 
1 1 1 1   18 13 o 423.3285 24.26246 35.03038       3.972149      33.55748       5.942178      36.22023       5.340763  412.3721 37.51494 429.4062 32.26213 -17.03415      49.47945 
1 1 1 1   18 14 o 378.3242 27.86635 28.07670       4.065408      22.59943       6.185994      32.24092       5.393791  335.2910 48.94993 404.5077 34.67023 -69.21671      59.98434 
1 1 1 1   18 15 o 1147.333 16.30959 256.0807       7.267092      258.5261       10.54520      253.8691       10.02868  1151.644 23.57809 1141.398 22.62448 10.24597       32.67710 
1 1 1 1   18 16 o 117.6037 50.50344 -0.1917318     4.145616      -2.571203      6.122487      1.822874       5.633556  130.2922 58.42640 149.9321 61.19550 -19.63994      84.60812 
1 1 1 1   18 17 o 400.7312 45.15597 32.07743       6.904934      32.07743       6.904934      0.000000       0.000000  400.7312 45.15597 ?        ?        0.000000       45.15597 
1 1 1 1   18 18 o 903.0742 18.71402 158.8347       6.563243      156.4793       9.182717      161.2946       9.384216  895.0257 26.41847 908.6569 26.59317 -13.63123      37.48510 
1 1 1 1   18 19 o 671.7397 31.14388 88.40532       8.124595      89.84593       11.13567      86.76561       11.88027  673.2463 42.81311 660.3060 46.62875 12.94031       63.30247 
1 1 1 1   18 20 o 526.7021 32.86603 54.67577       6.689085      62.75394       10.60759      49.34288       8.618705  559.4584 49.32746 496.9485 45.15106 62.50989       66.87164 
1 1 1 1   18 21 o 349.9395 41.01393 24.57820       5.468099      27.23160       7.260215      21.10013       8.312226  364.9331 52.75964 314.8163 69.81728 50.11676       87.51019 
1 1 1 1   18 22 o 288.5779 52.32780 17.27718       5.648442      9.760174       7.620740      26.44118       8.414291  220.1007 74.71173 354.1834 63.50625 -134.0826      98.05553 
1 1 1 1   18 23 o 375.3571 48.41805 28.88044       6.893430      31.72900       11.17081      27.12858       8.760347  378.9709 78.48425 356.0613 65.77619 22.90961       102.4026 
1 1 1 1   18 24 o 315.4261 47.47831 20.59577       5.635681      19.93729       7.716385      21.34855       8.250511  301.5105 67.57265 311.0751 69.98798 -9.564575      97.28505 
1 1 1 1   18 25 o 144.3604 61.65219 0.9159778      6.116896      -0.8587370     7.607510      4.161854       10.28831  149.4848 66.19394 193.0105 81.07573 -43.52577      104.6657 
1 1 1 1   18 26 o 124.6601 55.36771 -0.9537642     5.361608      7.001955       7.777310      -8.159306      7.401556  192.4053 73.96852 119.0144 56.88032 73.39092       93.30977 
1 1 1 1   18 27 o 377.9396 37.62437 29.35565       5.448892      33.60269       7.648076      24.97771       7.765048  396.0046 50.90959 333.0884 62.31921 62.91620       80.47031 
1 1 1 1   18 28 o 125.4307 55.11056 -0.7863754E-01 5.176192      -1.723065      7.203613      1.676768       7.442723  137.3091 62.30576 154.9344 67.10408 -17.62529      91.56945 
1 1 1 1   19 0  o 765.5809 23.77247 114.2660       7.067949      116.1652       9.795918      112.2037       10.20799  770.5402 32.73572 756.9300 34.72614 13.61017       47.72349 
1 1 1 1   19 1  o 1178.303 17.61709 270.1839       8.061563      265.2648       9.613659      281.8369       14.79674  1166.956 21.21320 1200.512 31.73742 -33.55615      38.17412 
1 1 1 1   19 2  o 412.5125 26.66444 33.34144       4.248810      29.73985       6.516675      36.00448       5.603611  386.3319 44.23184 427.5736 34.02814 -41.24167      55.80654 
1 1 1 1   19 3  o 389.7386 28.03150 29.80260       4.214416      34.05813       6.679893      26.98857       5.431959  414.2636 42.10595 369.0271 38.46816 45.23648       57.03254 
1 1 1 1   19 4  o 429.2245 35.90375 36.32549       5.929870      0.000000       0.000000      36.32549       5.929870  ?        ?        429.2245 35.90375 0.000000       35.90375 
1 1 1 1   19 5  f 761.5804 18.84677 112.8801       5.574177      116.7255       6.722052      104.4149       9.973537  774.0856 22.36068 730.4122 35.16035 43.67334       41.66833 
1 1 1 1   19 6  o 736.1385 34.51654 105.9975       9.867674      0.000000       0.000000      105.9975       9.867674  ?        ?        736.1385 34.51654 0.000000       34.51654 
1 1 1 1   19 7  o 876.4736 15.43264 149.3790       5.252997      149.7802       5.939028      147.9371       11.25892  877.4792 17.42812 869.9856 33.32396 7.493591       37.60619 
1 1 1 1   19 8  o 310.8121 28.76462 19.00573       3.432670      16.17331       3.830562      30.55423       7.734758  285.4648 35.30540 390.3238 52.34507 -104.8590      63.13857 
1 1 1 1   19 9  o 322.6354 28.48024 20.46030       3.531854      20.73459       3.966796      19.41125       7.757743  324.3141 31.90841 306.6646 67.01190 17.64960       74.22090 
1 1 1 1   19 10 o 315.4692 30.91733 19.61117       3.739117      19.02996       4.237059      21.65716       7.949631  309.9172 35.86668 324.6321 65.31831 -14.71487      74.51778 
1 1 1 1   19 11 o 982.3125 16.35638 187.6556       6.239717      185.8748       7.092399      193.7548       13.12548  977.4126 18.68475 995.6353 33.94586 -18.22272      38.74844 
1 1 1 1   19 12 o 1045.681 18.66777 212.7694       7.580881      215.3063       9.160066      207.2545       13.50554  1051.407 22.43364 1029.587 33.77698 21.81995       40.54815 
1 1 1 1   19 13 o 897.0242 16.49296 156.5248       5.745539      150.5869       8.212523      162.2173       8.041031  878.9595 24.05912 912.4623 22.69179 -33.50281      33.07203 
1 1 1 1   19 14 o 1082.550 16.37186 227.9965       6.882936      225.7181       9.930726      230.1029       9.548409  1075.984 23.76551 1086.590 22.62754 -10.60559      32.81471 
1 1 1 1   19 15 o 845.5286 17.88416 139.1640       5.872523      143.1861       8.707292      135.8080       7.953769  856.4538 26.17889 834.3623 24.54654 22.09149       35.88686 
1 1 1 1   19 16 o 486.1669 35.46024 46.60680       6.648899      0.000000       0.000000      46.60680       6.648899  ?        ?        486.1669 35.46024 0.000000       35.46024 
1 1 1 1   19 17 o 1077.069 17.52681 225.8568       7.331192      232.2446       10.68885      220.1826       10.07417  1090.650 25.23582 1062.134 24.42317 28.51636       35.11892 
1 1 1 1   19 18 o 535.9777 29.42919 56.39705       6.102213      52.00797       7.563141      64.58356       10.32915  512.6766 38.26230 569.0149 47.16790 -56.33832      60.73561 
1 1 1 1   19 19 o 374.5544 40.58501 28.01628       5.809051      23.43612       9.412341      30.83425       7.382885  331.8804 74.81610 390.5555 49.81015 -58.67502      89.88048 
1 1 1 1   19 20 o 720.1563 25.71030 101.5218       7.190547      116.7075       12.23252      93.50423       8.888300  766.2626 41.25850 689.2857 33.20408 76.97693       52.96012 
1 1 1 1   19 21 o 117.6898 53.58556 -2.955374      5.386470      -4.143674      7.387507      -1.606556      7.870667  136.3348 62.33769 152.1401 67.35141 -15.80522      91.77254 
1 1 1 1   19 22 o 271.2464 63.44994 15.81718       6.564807      25.15436       10.87275      10.46039       8.235379  334.2173 83.89597 225.7995 77.64827 108.4178       114.3144 
1 1 1 1   19 23 o 517.1343 30.61353 53.08419       6.120779      50.74213       8.504151      55.60144       8.816472  499.6752 44.28308 523.4713 43.77010 -23.79614      62.26406 
1 1 1 1   19 24 o 184.0679 63.13379 6.887124       5.442609      12.50730       7.504246      0.6499465      7.905439  236.6928 73.72334 159.5295 69.12640 77.16331       101.0623 
1 1 1 1   19 25 o 323.6920 51.29489 22.27475       6.233142      13.23328       7.403339      44.28837       11.55192  240.0440 72.95689 445.1319 69.06253 -205.0879      100.4606 
1 1 1 1   19 26 o 133.1508 55.69342 1.537436       4.822615      0.6581376      7.012516      2.326485       6.642899  148.4007 64.69927 154.4128 65.01975 -6.012054      91.72549 
1 1 1 1   19 27 o 133.7755 56.06091 1.662809       4.900197      7.846107       7.438312      -3.078228      6.513299  192.3511 72.71873 125.3866 57.77223 66.96455       92.87434 
1 1 1 1   20 0  o 265.1994 41.41799 14.11826       4.126232      22.44506       6.329280      7.963431       5.441557  333.8594 50.38395 200.7186 62.82151 133.1408       80.53002 
1 1 1 1   20 1  o 450.5888 31.80982 39.85895       5.530581      44.70709       7.382022      33.65608       8.349956  475.8419 40.32638 409.4301 53.81806 66.41180       67.25028 
1 1 1 1   20 2  o 183.5043 58.85401 6.534225       4.750910      8.188578       5.973288      3.685754       7.837999  204.9954 66.01832 183.4795 73.13625 21.51588       98.52578 
1 1 1 1   20 3  o 248.0520 42.99042 12.41379       3.991291      10.31629       4.711251      17.74683       7.512289  224.1497 54.62165 292.8082 67.45271 -68.65842      86.79512 
1 1 1 1   20 4  o 429.0617 26.54241 36.02790       4.400988      39.66581       5.238427      27.29924       8.114262  449.7936 30.16351 366.9697 58.93094 82.82388       66.20190 
1 1 1 1   20 5  o 933.7172 16.23095 169.5418       5.885552      173.8872       8.047132      164.5437       8.630287  945.0262 21.92650 919.0162 24.18099 26.01001       32.64187 
1 1 1 1   20 6  o 965.3413 16.14602 181.2140       6.053051      175.6721       8.066444      188.3568       9.157620  949.8894 21.86659 983.3203 23.98058 -33.43091      32.45329 
1 1 1 1   20 7  o 888.2729 15.75598 153.4231       5.435256      154.6360       6.142242      149.0455       11.66901  891.6125 17.73874 873.2401 34.40902 18.37250       38.71231 
1 1 1 1   20 8  o 880.9247 16.04024 150.9043       5.487540      144.1119       6.086047      180.4327       12.68950  860.6920 18.20789 960.8499 34.00641 -100.1578      38.57412 
1 1 1 1   20 9  o 1657.812 16.64637 534.5142       10.71724      524.3032       11.96987      575.7842       24.06421  1641.546 18.77622 1715.576 36.11884 -74.02979      40.70770 
1 1 1 1   20 10 o 1259.667 15.77406 308.5739       7.716621      305.6811       8.702242      319.2184       16.69291  1253.482 17.87660 1277.826 33.63815 -24.34412      38.09328 
1 1 1 1   20 11 o 465.2306 24.12807 42.29790       4.344356      43.06483       4.974876      39.83456       8.915954  469.0047 27.43299 446.0745 52.47031 22.93024       59.20897 
1 1 1 1   20 12 o 112.3512 49.10080 -0.7994738     4.060572      -1.766947      4.745161      1.846696       7.847663  116.4037 51.87085 172.3041 71.46945 -55.90043      88.30894 
1 1 1 1   20 13 o 584.8392 24.83838 66.72208       5.641410      63.16305       6.796735      74.60429       10.11482  567.4814 30.95741 614.2581 42.66598 -46.77667      52.71383 
1 1 1 1   20 14 o 441.0473 26.23249 38.11019       4.472902      33.75320       6.603921      41.80305       6.079809  412.0397 41.85088 460.6137 34.23263 -48.57404      54.06819 
1 1 1 1   20 15 o 673.5889 20.57812 88.41219       5.383051      88.09219       8.023463      88.67415       7.259330  670.9136 30.79408 673.6209 27.74936 -2.707275      41.45241 
1 1 1 1   20 16 o 130.3638 54.13669 0.9368945      4.510381      -8.699253      6.826870      8.401241       6.008497  115.0225 54.87656 205.9095 66.20212 -90.88701      85.98928 
1 1 1 1   20 17 o 460.8092 33.55570 41.88713       5.963781      46.97666       7.688185      34.19783       9.449925  486.3217 41.09196 408.3460 61.49740 77.97574       73.96269 
1 1 1 1   20 18 o 187.0606 71.27106 5.353650       7.180174      5.353650       7.180174      0.000000       0.000000  187.0606 71.27106 ?        ?        0.000000       71.27106 
1 1 1 1   20 19 o 199.2289 64.44407 7.969111       5.687074      17.94047       9.336113      2.086213       7.171082  287.8905 80.41183 165.1737 68.39961 122.7168       105.5678 
1 1 1 1   20 20 o 261.5186 59.86609 14.48293       5.948880      3.571260       10.19579      20.11489       7.324956  196.0460 81.40218 307.9981 63.35359 -111.9521      103.1503 
1 1 1 1   20 21 o 463.3178 36.65626 42.88846       6.541757      40.07576       11.48726      44.23845       7.958287  431.8205 70.96504 467.6065 44.35456 -35.78601      83.68610 
1 1 1 1   20 22 o 229.1986 66.30867 11.40632       6.238346      11.33775       10.60038      11.44265       7.715990  236.6421 87.34185 230.4544 75.10130 6.187729       115.1903 
1 1 1 1   20 23 o 441.8090 33.60701 39.11193       5.723001      40.59695       7.817334      37.39677       8.401268  444.3472 45.96556 422.9416 52.26064 21.40564       69.59890 
1 1 1 1   20 24 o 372.6401 39.52481 28.40535       5.632567      37.66973       8.205962      20.15194       7.745290  423.0404 50.97471 298.5220 68.28994 124.5184       85.21700 
1 1 1 1   20 25 o 190.9781 67.78168 7.758399       6.306073      8.806316       7.801371      5.782934       10.71129  203.0908 74.93447 197.2875 82.79131 5.803238       111.6673 
1 1 1 1   20 26 o 106.6215 49.66956 -3.546472      5.018513      -4.683807      7.508535      -2.628166      6.746902  129.4100 60.44242 129.8035 59.43302 -0.3934784     84.76775 
1 1 1 1   21 0  o 897.5999 19.11083 156.7667       6.661780      156.4962       10.78351      156.9336       8.471720  895.3293 31.01340 897.5104 24.30548 -2.181030      39.40288 
1 1 1 1   21 1  o 139.5190 54.14836 2.452462       4.198250      -3.678940      6.452710      6.953007       5.528341  129.7332 58.90692 191.6169 63.62436 -61.88373      86.70689 
1 1 1 1   21 2  o 280.7612 40.30704 15.75164       4.268820      20.44930       5.033777      3.721922       8.055290  320.4019 41.42488 185.7160 74.10680 134.6859       84.89899 
1 1 1 1   21 3  o 609.8286 21.77110 72.40373       5.156039      74.84370       6.185463      66.84789       9.333743  619.6971 25.70187 582.5064 41.53186 37.19073       48.84139 
1 1 1 1   21 4  o 480.5903 25.03865 45.12689       4.657027      47.30457       5.560467      40.01044       8.523110  491.5379 29.26141 448.1841 49.81076 43.35388       57.76973 
1 1 1 1   21 5  o 879.0767 17.06950 150.3023       5.827410      137.2160       7.450340      170.9249       9.352757  839.3900 22.85516 936.4706 25.71683 -97.08069      34.40515 
1 1 1 1   21 6  o 1339.338 16.21268 348.8463       8.432828      348.8014       11.62400      348.8961       12.25244  1338.341 22.36457 1338.310 23.57425 0.3125000E-01  32.49492 
1 1 1 1   21 7  o 1209.513 15.68786 284.4797       7.368893      287.0150       8.420517      276.1887       15.22747  1214.630 17.85118 1188.803 32.98298 25.82715       37.50389 
1 1 1 1   21 8  o 879.1448 18.68578 150.4037       6.379692      144.8691       7.391609      166.5682       12.63219  862.4498 22.06872 922.6332 35.25507 -60.18347      41.59265 
1 1 1 1   21 9  o 807.4500 17.11226 126.8427       5.366005      126.6874       6.032804      127.4313       11.74204  806.7488 19.25541 806.3778 37.49530 0.3710327      42.15055 
1 1 1 1   21 10 o 207.5549 48.33186 8.834856       3.823102      9.164868       4.299578      7.588562       8.355481  211.1355 52.62403 212.2060 77.66464 -1.070511      93.81410 
1 1 1 1   21 11 o 552.7665 22.26943 59.54908       4.780560      60.02766       5.465031      57.98945       9.865644  554.6808 25.37006 539.9965 47.52854 14.68427       53.87580 
1 1 1 1   21 12 o 540.8305 23.37372 57.03873       4.909272      57.55748       5.660253      55.46367       9.863044  542.9163 26.84571 527.4664 48.69896 15.44989       55.60828 
1 1 1 1   21 13 o 592.8331 23.06057 68.53959       5.309217      63.55625       6.094919      84.21652       10.81031  570.3533 27.51668 652.3408 42.91078 -81.98749      50.97551 
1 1 1 1   21 14 o 285.6400 50.71064 16.64013       5.419263      12.58079       6.617970      24.90231       9.441587  245.8377 67.33508 344.5360 72.84161 -98.69830      99.19633 
1 1 1 1   21 15 o 426.7242 29.61748 35.80515       4.877821      42.50051       7.419631      30.70871       6.473350  462.4222 41.76655 392.1347 43.22570 70.28751       60.10745 
1 1 1 1   21 16 o 1141.438 19.97028 253.9821       8.852471      252.7668       11.37429      255.8492       14.09836  1137.231 25.75417 1142.210 31.78298 -4.978760      40.90764 
1 1 1 1   21 17 f 724.2740 24.71854 102.5528       6.952703      105.6726       9.128310      98.24221       10.72994  733.5240 32.04410 704.1946 39.39322 29.32941       50.78041 
1 1 1 1   21 18 o 373.7019 40.28347 27.98372       5.753870      34.08804       9.707930      24.67810       7.143893  404.2950 63.95808 346.0431 54.99932 58.25192       84.35379 
1 1 1 1   21 19 o 626.0967 26.77744 76.93419       6.510861      81.89475       11.08245      74.31966       8.045756  638.3812 44.98992 612.5016 33.95745 25.87958       56.36667 
1 1 1 1   21 20 o 612.7772 35.44754 74.73570       8.399583      0.000000       0.000000      74.73570       8.399583  ?        ?        612.7772 35.44754 0.000000       35.44754 
1 1 1 1   21 21 o 218.6081 65.83115 10.28833       6.048193      4.027884       11.28292      12.81260       7.164517  201.4396 84.77531 241.5541 71.40092 -40.11455      110.8375 
1 1 1 1   21 22 o 351.7214 39.62745 25.18077       5.318496      28.60946       7.552161      21.80721       7.491189  368.1335 54.46912 316.2308 63.20841 51.90268       83.43973 
1 1 1 1   21 23 o 497.7605 29.54939 49.43074       5.686521      53.46160       8.146950      45.60119       7.940917  511.3171 41.38252 470.4792 43.97108 40.83792       60.38186 
1 1 1 1   21 24 o 189.1184 62.38651 7.782968       5.318494      17.88461       7.647209      -1.680641      7.401767  276.7184 70.85398 141.4334 63.76096 135.2849       95.31918 
1 1 1 1   21 25 o 575.0822 31.50571 66.75439       7.009573      72.28433       8.300097      53.00221       13.08906  595.0087 36.09021 474.9424 73.32539 120.0663       81.72586 
1 1 1 1   22 0  o 863.8187 19.87272 145.2318       6.666654      140.7265       7.748433      158.0722       13.08109  849.9214 23.47508 898.5083 37.48814 -48.58691      44.23167 
1 1 1 1   22 1  o 1075.558 16.52340 224.9940       6.901785      234.9778       9.624278      214.4239       9.902879  1098.393 22.56226 1049.000 24.30849 49.39282       33.16562 
1 1 1 1   22 2  o 478.2925 27.51429 44.76781       5.089150      46.30446       7.879853      43.66819       6.665815  483.9452 42.35342 470.9293 36.73827 13.01593       56.06703 
1 1 1 1   22 3  o 248.0028 42.13343 12.39657       3.912809      10.30402       5.104539      15.37781       6.092797  223.9392 58.17111 273.4828 59.09188 -49.54356      82.92001 
1 1 1 1   22 4  o 877.1175 19.18998 149.7291       6.536727      151.2274       7.877245      146.4159       11.71403  881.0532 23.02206 865.0891 34.86725 15.96411       41.78206 
1 1 1 1   22 5  o 137.5690 53.91198 2.257802       4.192832      1.092688       4.963344      5.161091       7.834933  137.5255 56.92381 192.6359 74.19302 -55.11032      93.51429 
1 1 1 1   22 6  o 835.4671 19.70845 135.8870       6.394548      131.6881       7.683276      145.3506       11.53474  821.9371 24.07021 861.7864 34.46516 -39.84924      42.03834 
1 1 1 1   22 7  o 157.5860 56.96775 4.146992       4.475630      4.814632       5.393002      2.669763       8.022015  171.0298 62.42567 178.5725 72.97088 -7.542694      96.02975 
1 1 1 1   22 8  o 1033.460 16.32721 207.7886       6.552903      210.6274       7.453743      198.1276       13.75046  1040.219 18.45108 1005.625 35.20895 34.59369       39.75063 
1 1 1 1   22 9  o 249.4475 42.31083 12.57116       3.952345      9.761554       4.379596      24.90009       9.174326  217.7142 52.42556 345.8714 70.68857 -128.1572      88.00746 
1 1 1 1   22 10 o 229.6535 47.47272 10.79136       4.094039      11.14436       4.613271      9.482696       8.882563  232.6436 52.32891 227.5830 80.48059 5.060623       95.99709 
1 1 1 1   22 11 o 430.5326 27.71195 36.36373       4.608798      37.33395       5.260686      33.16057       9.558644  435.6563 31.30221 402.3874 63.25518 33.26892       70.57653 
1 1 1 1   22 12 o 762.9630 19.46321 113.3921       5.766946      109.1460       6.518606      128.6841       12.37065  748.1522 22.43555 808.8286 39.38293 -60.67633      45.32515 
1 1 1 1   22 13 o 731.2318 23.12182 104.3155       6.566063      116.3317       8.131842      81.80473       11.13015  771.5168 27.14036 641.8961 44.93202 129.6207       52.49271 
1 1 1 1   22 14 o 531.2051 26.12279 55.14652       5.389020      60.85982       6.344350      40.34420       10.21195  556.8035 29.44447 444.4578 60.75396 112.3457       67.51311 
1 1 1 1   22 15 o 487.8553 30.80901 46.85223       5.807112      49.57780       7.875076      43.60375       8.597371  499.3504 40.96988 465.9525 48.20841 33.39792       63.26596 
1 1 1 1   22 16 f 322.5126 47.51335 21.14136       5.772703      17.10407       7.775184      26.10053       8.617273  283.1496 70.87359 352.9617 65.26991 -69.81204      96.34950 
1 1 1 1   22 17 o 1148.877 20.33908 257.7388       9.074710      269.2330       16.42350      252.6873       10.88769  1167.144 36.23373 1136.064 24.67772 31.08057       43.83917 
1 1 1 1   22 18 o 691.5954 25.02957 93.78225       6.722542      111.1839       12.14047      86.08718       8.073220  745.3776 42.11263 660.7652 31.46094 84.61237       52.56676 
1 1 1 1   22 19 o 521.5405 38.78508 54.51097       7.799430      0.000000       0.000000      54.51097       7.799430  ?        ?        521.5405 38.78508 0.000000       38.78508 
1 1 1 1   22 20 o 517.5232 33.27543 53.39153       6.652318      63.80873       12.52881      49.30170       7.850308  551.0884 59.48434 493.7620 41.31919 57.32648       72.42694 
1 1 1 1   22 21 o 364.4922 39.44376 27.02637       5.494287      23.26809       7.862051      30.61381       7.681293  326.0633 64.37255 381.4467 53.30954 -55.38339      83.58069 
1 1 1 1   22 22 o 344.3531 41.27754 24.40657       5.410074      24.96229       7.756355      23.88005       7.549824  337.4412 61.45175 330.0668 61.15082 7.374390       86.69337 
1 1 1 1   22 23 o 378.0436 38.75742 29.35748       5.609723      28.72590       8.023480      29.96144       7.846181  361.4702 59.20646 371.4002 56.15139 -9.930023      81.59892 
1 1 1 1   22 24 o 188.2426 66.02573 7.720496       5.968669      12.39577       7.219757      -2.373923      10.60864  228.4233 72.47739 162.4570 74.43604 65.96628       103.8927 
1 1 1 1   23 0  o 1044.517 20.14181 212.4519       8.170377      193.5396       13.25862      224.0305       10.37422  994.2629 34.33755 1071.797 24.92384 -77.53400      42.42953 
1 1 1 1   23 1  o 371.2383 37.10503 27.28016       5.277853      25.65974       8.339385      28.36287       6.816750  353.7412 63.01460 376.3438 47.71211 -22.60260      79.03977 
1 1 1 1   23 2  o 310.4480 35.16443 19.11275       4.164786      13.36581       5.432395      27.30668       6.486635  254.7228 56.40388 369.4854 46.21681 -114.7626      72.92045 
1 1 1 1   23 3  o 142.2771 53.85709 2.924818       4.083376      3.939770       5.300954      1.443718       6.403590  162.7876 61.42533 155.7088 64.57069 7.078842       89.12041 
1 1 1 1   23 4  o 995.5175 20.05490 193.0037       7.753494      174.8559       11.78587      206.8504       10.29493  945.4056 32.10077 1029.636 25.74611 -84.23053      41.14999 
1 1 1 1   23 5  o 748.0215 19.01373 108.9413       5.523437      112.6935       7.375282      104.1490       8.335128  760.0536 24.98656 730.0232 29.40002 30.03040       38.58353 
1 1 1 1   23 6  o 379.6906 34.42635 28.47145       5.021123      30.05002       5.950130      24.56674       9.358142  389.0619 39.94736 342.9357 72.53222 46.12622       82.80528 
1 1 1 1   23 7  o 431.2723 30.83742 36.56598       5.130776      39.30460       6.195542      30.58800       9.153576  446.2327 36.05926 386.3633 63.19019 59.86942       72.75486 
1 1 1 1   23 8  o 656.7565 23.64499 84.12953       6.030753      83.17671       7.250841      86.26804       10.86273  652.3503 28.62065 660.4456 42.57889 -8.095276      51.30403 
1 1 1 1   23 9  o 605.2789 25.03588 71.50480       5.884998      71.44373       7.006874      71.65105       10.84277  604.3691 29.85342 600.3411 46.87834 4.028015       55.57702 
1 1 1 1   23 10 o 651.8380 24.39113 82.91923       6.174469      76.87704       7.323092      97.77726       11.48359  626.8231 30.08303 703.1153 42.25161 -76.29224      51.86702 
1 1 1 1   23 11 o 1107.041 20.09189 238.8195       8.637982      237.5608       10.34524      241.7173       15.69707  1103.250 24.14564 1109.238 36.43895 -5.988281      43.71280 
1 1 1 1   23 12 o 713.9478 21.03117 99.38709       5.831200      104.6481       6.784449      84.51178       11.40813  732.1657 23.86037 651.9756 45.33829 80.19006       51.23356 
1 1 1 1   23 13 o 777.2339 23.47933 117.9594       7.087049      105.6422       8.438503      147.4441       13.05590  734.3315 29.59002 864.7649 38.87592 -130.4334      48.85598 
1 1 1 1   23 14 o 479.4410 41.54958 45.82662       7.659747      45.82662       7.659747      0.000000       0.000000  479.4410 41.54958 ?        ?        0.000000       41.54958 
1 1 1 1   23 15 o 313.5469 61.63439 20.62330       7.237483      20.62330       7.237483      0.000000       0.000000  313.5469 61.63439 ?        ?        0.000000       61.63439 
1 1 1 1   23 16 o 416.9247 34.86745 34.57508       5.593718      23.11860       10.24456      39.44153       6.676888  323.7962 81.52246 444.1788 39.10564 -120.3826      90.41661 
1 1 1 1   23 17 o 189.7858 62.66386 7.251626       5.365438      26.90942       9.751429      -1.283615      6.425527  351.4286 73.79900 137.9504 60.97290 213.4782       95.72871 
1 1 1 1   23 18 o 229.3172 69.22168 11.34139       6.681365      0.000000       0.000000      11.34139       6.681365  ?        ?        229.3172 69.22168 0.000000       69.22168 
1 1 1 1   23 19 o 377.9214 50.19723 29.63768       7.185039      0.000000       0.000000      29.63768       7.185039  ?        ?        377.9214 50.19723 0.000000       50.19723 
1 1 1 1   23 20 o 296.6129 47.41259 18.39272       5.277562      23.45616       7.432595      13.24390       7.494995  329.1936 60.36263 242.4428 73.34495 86.75076       94.99014 
1 1 1 1   23 21 o 326.2912 42.06039 22.01224       5.205661      27.66395       7.331337      16.26524       7.392881  359.7222 54.15855 266.2675 70.41481 93.45465       88.83352 
1 1 1 1   23 22 o 452.5673 47.39373 43.05242       8.206207      43.05242       8.206207      0.000000       0.000000  452.5673 47.39373 ?        ?        0.000000       47.39373 
1 1 1 1   23 23 o 232.2921 57.15179 12.13886       5.120465      18.33477       7.110845      5.465957       7.379485  280.8716 66.26235 177.1486 70.84733 103.7230       97.00538 
1 1 1 1   24 0  o 796.1011 21.49177 123.5156       6.644595      127.0094       8.014427      115.8338       11.88378  806.6687 25.58287 766.4889 40.06190 40.17981       47.53356 
1 1 1 1   24 1  o 334.3417 42.50283 22.35334       5.393966      21.17408       8.493847      23.15032       6.982696  318.1882 70.58434 337.1598 55.24224 -18.97159      89.63177 
1 1 1 1   24 2  o 915.7165 35.82080 164.4855       12.73868      164.4855       12.73868      0.000000       0.000000  915.7165 35.82080 ?        ?        0.000000       35.82080 
1 1 1 1   24 3  o 1089.541 17.09136 231.0463       7.231831      221.6426       9.597338      243.4005       11.00033  1066.096 23.18071 1116.727 25.36476 -50.63110      34.36155 
1 1 1 1   24 4  o 471.1649 26.82578 43.49501       4.888244      35.06128       6.181072      57.57699       7.987038  420.7795 38.24276 540.0305 38.33278 -119.2509      54.14712 
1 1 1 1   24 5  o 489.9146 30.40743 47.13345       5.756756      40.96390       8.710994      51.91714       7.670477  452.0040 50.48716 512.5231 38.82553 -60.51913      63.68968 
1 1 1 1   24 6  o 249.3211 55.61945 12.84355       5.248464      15.88986       7.671875      10.16354       7.195869  275.2432 71.22568 225.6545 72.43803 49.58865       101.5892 
1 1 1 1   24 7  o 728.2536 22.37207 103.4183       6.327275      97.63503       7.488203      117.8540       11.83065  706.8737 27.27771 772.9979 39.54198 -66.12427      48.03792 
1 1 1 1   24 8  o 219.2765 50.53652 9.912243       4.215208      9.116768       4.774003      12.72602       8.978720  210.2154 57.02949 250.7711 80.95919 -40.55576      99.02905 
1 1 1 1   24 9  f 393.1968 35.48863 30.60215       5.360695      35.86666       6.400362      18.22957       9.811951  425.0892 39.21208 292.9964 82.64709 132.0927       91.47747 
1 1 1 1   24 10 o 968.0971 20.89037 182.7474       7.854037      174.7064       9.264851      203.2850       14.80672  945.6556 25.22769 1016.343 37.51376 -70.68744      45.20750 
1 1 1 1   24 11 o 341.7254 42.42068 23.42865       5.508582      16.07909       6.605877      40.20562       9.980599  277.0128 62.84732 443.5136 59.44126 -166.5008      86.50462 
1 1 1 1   24 12 o 506.8905 31.16903 50.62492       6.105978      44.54438       7.296560      64.83207       11.15322  473.0608 40.09393 567.3599 51.16967 -94.29913      65.00661 
1 1 1 1   24 13 o 1017.484 26.54453 202.8121       10.48891      202.8121       10.48891      0.000000       0.000000  1017.484 26.54453 ?        ?        0.000000       26.54453 
1 1 1 1   24 14 o 511.5157 38.96291 52.17186       7.681744      52.17186       7.681744      0.000000       0.000000  511.5157 38.96291 ?        ?        0.000000       38.96291 
1 1 1 1   24 15 o 497.7034 57.12149 51.11118       10.84074      0.000000       0.000000      51.11118       10.84074  ?        ?        497.7034 57.12149 0.000000       57.12149 
1 1 1 1   24 16 o 225.1751 70.63768 10.79091       6.875440      13.41949       9.615402      8.040902       9.834996  249.9584 83.92614 215.8423 83.12678 34.11606       118.1256 
1 1 1 1   24 17 o 458.6049 39.87987 42.41076       7.031940      0.000000       0.000000      42.41076       7.031940  ?        ?        458.6049 39.87987 0.000000       39.87987 
1 1 1 1   24 18 o 280.4703 63.72393 17.21770       6.783132      0.000000       0.000000      17.21770       6.783132  ?        ?        280.4703 63.72393 0.000000       63.72393 
1 1 1 1   24 19 o 204.2715 71.62587 8.741591       7.023846      8.741591       7.023846      0.000000       0.000000  204.2715 71.62587 ?        ?        0.000000       71.62587 
1 1 1 1   24 20 o 250.6012 52.88809 13.60499       4.985460      18.69688       6.995721      8.350420       7.106597  288.7726 64.05695 199.5330 71.83380 89.23959       96.24650 
1 1 1 1   24 21 o 252.6062 52.89713 13.94862       5.022906      15.07637       7.006927      12.75650       7.204099  254.2213 69.14253 233.3269 72.16163 20.89436       99.93993 
1 1 1 1   24 22 o 383.9054 35.70119 30.18954       5.261747      34.16623       7.382111      26.08286       7.501801  400.2326 48.48328 342.2870 58.53852 57.94562       76.00912 
1 1 1 1   25 0  o 290.9806 42.19589 17.02231       4.629186      11.60696       5.929482      25.47481       7.407912  236.3352 63.32439 353.5454 55.80530 -117.2102      84.40504 
1 1 1 1   25 1  f 968.5214 18.25791 182.6674       6.867333      191.8799       9.302872      171.6356       10.18005  991.5792 24.15804 937.0151 27.97534 54.56409       36.96255 
1 1 1 1   25 2  o 278.3518 63.80252 16.15772       6.749528      22.09234       8.839720      7.860577       10.45217  324.2324 72.07089 225.0199 85.92904 99.21249       112.1517 
1 1 1 1   25 3  o 966.9822 21.67064 182.3103       8.138009      191.9887       13.70811      177.0428       10.11293  988.8668 35.69538 951.7573 27.36042 37.10950       44.97502 
1 1 1 1   25 4  o 168.1863 58.34767 5.151952       4.655098      3.318793       5.929237      8.097579       7.516013  163.0851 64.04990 210.1229 74.06086 -47.03780      97.91527 
1 1 1 1   25 5  o 1114.453 17.75525 241.8580       7.684514      245.5134       10.39256      237.4486       11.41424  1121.556 23.86016 1102.278 26.66417 19.27832       35.78107 
1 1 1 1   25 6  o 400.6422 31.95280 31.65915       4.930223      29.23244       6.299496      35.49529       7.920323  382.3875 43.17647 420.0754 49.50011 -37.68787      65.68462 
1 1 1 1   25 7  o 579.1288 32.91101 66.01450       7.371364      75.48708       9.955110      54.51698       10.96766  616.9508 41.79625 519.5856 55.19902 97.36517       69.23769 
1 1 1 1   25 8  o 645.7855 21.06941 81.34763       5.284071      77.93795       5.945896      94.15702       11.52458  631.6443 24.23911 688.4790 43.32383 -56.83472      49.64362 
1 1 1 1   25 9  o 1153.756 17.04401 259.3001       7.636843      257.3608       8.614626      266.4180       16.50375  1148.919 19.30719 1162.884 36.54420 -13.96484      41.33094 
1 1 1 1   25 10 o 391.2984 31.14191 30.25610       4.693232      29.32607       5.259636      33.88997       10.39657  384.1637 35.66098 401.7895 69.12164 -17.62573      77.77857 
1 1 1 1   25 11 o 679.4531 21.41899 90.17504       5.651794      88.80483       6.373138      95.22089       12.23002  673.6884 24.35938 689.5221 45.93499 -15.83368      51.99426 
1 1 1 1   25 12 o 463.6994 40.39967 43.01833       7.202471      43.01833       7.202471      0.000000       0.000000  463.6994 40.39967 ?        ?        0.000000       40.39967 
1 1 1 1   25 13 o 461.1180 42.12638 42.75100       7.460550      42.75100       7.460550      0.000000       0.000000  461.1180 42.12638 ?        ?        0.000000       42.12638 
1 1 1 1   25 14 f 286.0178 54.22967 17.16294       5.803193      18.61749       7.154105      14.36446       9.923194  294.3091 64.38354 257.3602 85.23149 36.94894       106.8159 
1 1 1 1   25 15 o 490.3452 33.97065 47.93008       6.429086      47.91032       7.845360      47.97050       11.21783  486.9985 41.88944 476.6881 62.06836 10.31033       74.88128 
1 1 1 1   25 16 o 211.6651 60.91671 9.649356       5.277428      14.05850       6.287570      -0.8623035     9.708259  253.5701 63.87993 168.8186 74.76501 84.75153       98.33846 
1 1 1 1   25 17 o 301.0626 60.13960 19.65520       6.785404      13.19121       8.768302      29.30499       10.71332  242.3049 80.11227 357.1502 79.30618 -114.8453      112.7273 
1 1 1 1   25 18 f 450.4519 28.88687 40.45088       5.026683      34.82820       7.012218      46.39437       7.209493  410.4311 44.71698 477.4642 39.22768 -67.03314      59.48461 
1 1 1 1   25 19 o 270.6021 47.53487 15.56423       4.813133      17.16376       6.885597      14.03587       6.730644  274.9314 65.43483 247.1817 67.98969 27.74971       94.36268 
1 1 1 1   25 20 o 221.3482 54.79259 10.87018       4.684856      5.352519       6.564415      16.59771       6.688090  173.0178 67.55318 268.8775 64.81001 -95.85971      93.61501 
1 1 1 1   25 21 f 103.8334 47.95004 -2.750591      4.524307      -2.799504      6.337058      -2.699739      6.461428  124.9398 57.35061 126.6414 58.05016 -1.701645      81.60216 
1 1 1 1   26 0  o 604.9121 22.86222 71.42545       5.370796      73.70795       7.116125      68.40440       8.186833  613.3713 29.87391 588.6623 35.98425 24.70898       46.76876 
1 1 1 1   26 1  f 827.8926 19.43746 133.5957       6.249444      126.0053       8.186977      144.1941       9.674102  802.7773 26.26035 858.1096 29.02953 -55.33221      39.14485 
1 1 1 1   26 2  o 588.5808 23.65488 67.65073       5.406981      72.44871       7.100803      61.02980       8.341385  608.0372 30.07110 555.0629 38.94271 52.97424       49.20169 
1 1 1 1   26 3  o 190.3319 69.05446 6.311232       6.584874      0.6520186      8.335282      15.70713       10.74018  168.9912 72.06480 274.4855 88.53781 -105.4943      114.1590 
1 1 1 1   26 4  o 186.7654 65.33427 6.432641       5.842466      2.919528       8.474072      9.615561       8.066012  182.0070 74.75803 223.0971 76.83842 -41.09006      107.2050 
1 1 1 1   26 5  o 459.8350 34.91533 41.83717       6.188581      36.65992       9.305526      45.94285       8.286750  423.2262 58.15290 479.1315 45.06451 -55.90533      73.57017 
1 1 1 1   26 6  f 459.6377 29.10918 41.58439       5.169224      35.99366       6.554846      50.78031       8.406713  424.8109 40.21033 504.2157 43.35369 -79.40475      59.13048 
1 1 1 1   26 7  o 187.3586 61.55336 6.921036       5.179344      6.728559       5.949018      7.523860       10.52812  189.3259 65.94437 220.7162 85.72426 -31.39027      108.1541 
1 1 1 1   26 8  o 915.8082 18.22172 163.5561       6.480700      156.8550       7.200899      192.1188       14.86669  896.2980 20.68742 985.1191 38.85953 -88.82111      44.02309 
1 1 1 1   26 9  o 878.1397 21.24403 150.6716       7.244836      145.9731       8.532992      162.8058       13.71267  863.1718 25.45518 906.1851 38.96522 -43.01324      46.54304 
1 1 1 1   26 10 f 164.2910 56.54256 5.103510       4.367309      7.095083       4.911225      -2.423337      9.547689  187.1664 59.81879 164.3096 73.37157 22.85680       94.66612 
1 1 1 1   26 11 o 223.9776 59.16132 10.65634       5.222677      10.65634       5.222677      0.000000       0.000000  223.9776 59.16132 ?        ?        0.000000       59.16132 
1 1 1 1   26 12 o 176.3714 61.75936 5.926641       5.221207      5.926641       5.221207      0.000000       0.000000  176.3714 61.75936 ?        ?        0.000000       61.75936 
1 1 1 1   26 13 o 284.7344 46.09277 16.74396       4.922640      17.45533       5.653214      14.51290       10.01160  288.5109 52.38451 256.8141 85.63719 31.69672       100.3886 
1 1 1 1   26 14 o 396.7535 34.48529 31.54647       5.260673      32.36803       6.124800      29.23549       10.27233  399.8316 39.98048 361.8379 75.54111 37.99371       85.46870 
1 1 1 1   26 15 o 450.6286 31.91909 40.55587       5.549808      29.18640       6.274939      81.39609       11.89278  377.2239 43.63906 628.3702 49.12568 -251.1464      65.70921 
1 1 1 1   26 16 o 565.1052 29.54893 63.58546       6.462310      57.34758       7.604225      79.80324       12.26118  532.8604 36.97510 618.2645 51.53531 -85.40411      63.42748 
1 1 1 1   26 17 o 226.5733 55.16646 11.24390       4.808729      6.846671       5.446535      26.78938       10.24077  181.7926 63.11050 336.0869 79.67411 -154.2943      101.6410 
1 1 1 1   26 18 o 201.3547 59.35707 9.022015       4.957293      9.379890       5.801410      8.053605       9.543264  204.5950 64.97485 204.1668 80.91533 0.4281464      103.7739 
1 1 1 1   26 19 o 332.6797 56.15310 24.34385       6.996565      24.34385       6.996565      0.000000       0.000000  332.6797 56.15310 ?        ?        0.000000       56.15310 
1 1 1 1   27 0  o 334.4109 37.78897 22.37471       4.821549      20.70646       6.198741      24.93004       7.671784  317.3862 52.09892 346.4484 59.14333 -29.06223      78.81771 
1 1 1 1   27 1  o 644.1651 22.58011 81.09911       5.648735      80.41030       7.440581      82.03621       8.678593  639.8529 29.94324 644.1099 34.82394 -4.257019      45.92716 
1 1 1 1   27 2  o 302.9112 42.49729 18.55976       4.861680      15.78026       6.078148      23.49639       8.100319  274.2213 58.83657 333.9781 64.79099 -59.75677      87.51922 
1 1 1 1   27 3  o 647.0369 22.84861 81.85307       5.741388      79.23065       7.318577      86.04980       9.258288  635.0991 29.67271 659.0416 36.31359 -23.94250      46.89505 
1 1 1 1   27 4  o 395.7087 33.88586 31.09260       5.157184      38.88240       6.536187      18.24429       8.394301  441.4973 38.50682 290.4948 74.15488 151.0025       83.55670 
1 1 1 1   27 5  f 574.8091 37.79538 65.70808       8.390001      66.83919       10.52964      63.74119       13.88510  575.8716 47.50660 553.1284 65.93865 22.74323       81.26981 
1 1 1 1   27 6  o 940.8124 23.01883 173.2023       8.410353      172.6547       13.20984      173.5755       10.90648  933.9461 36.42064 939.3503 29.89711 -5.404175      47.12006 
1 1 1 1   27 7  o 919.3513 27.71540 166.0525       9.895338      162.6236       13.30671      170.2943       14.80041  905.2639 37.85013 924.5208 41.22201 -19.25684      55.96326 
1 1 1 1   27 8  o 540.4019 24.08649 57.24089       5.054967      53.98321       5.583133      72.05624       11.90637  523.3450 27.56743 594.2191 52.12121 -70.87408      58.96257 
1 1 1 1   27 9  o 261.4762 45.35962 14.09795       4.439062      12.40741       4.961096      20.88647       9.941498  242.3780 54.07894 305.1504 82.09344 -62.77243      98.30495 
1 1 1 1   27 10 o 116.2336 52.40726 -2.098341      5.002348      -2.098341      5.002348      0.000000       0.000000  116.2336 52.40726 ?        ?        0.000000       52.40726 
1 1 1 1   27 11 o 328.3138 50.98940 22.43771       6.290342      22.43771       6.290342      0.000000       0.000000  328.3138 50.98940 ?        ?        0.000000       50.98940 
1 1 1 1   27 12 o 160.1746 57.61269 4.729136       4.570338      2.136893       5.143660      14.45161       9.961452  143.4211 58.49882 254.2445 85.42272 -110.8234      103.5333 
1 1 1 1   27 13 o 498.9851 31.36670 49.64874       6.047402      49.50738       7.267641      49.96695       10.90357  495.2290 38.08031 485.0193 59.10972 10.20972       70.31407 
1 1 1 1   27 14 o 499.8524 33.02319 50.08770       6.374334      66.27200       7.985615      21.66670       10.58232  573.5903 36.03220 300.4705 86.19926 273.1199       93.42715 
1 1 1 1   27 15 o 205.1065 64.24233 9.270467       5.689302      12.36713       6.910305      2.755095       10.02350  232.9913 70.41267 182.3958 78.43452 50.59554       105.4036 
1 1 1 1   27 16 o 242.6437 52.34800 12.81392       4.787995      11.42443       5.483264      17.27445       9.824370  225.4636 61.09959 265.1324 84.59088 -39.66878      104.3493 
1 1 1 1   27 17 o 194.6104 58.01161 8.422345       4.714347      3.014795       5.307829      28.62806       10.26015  147.9198 59.75674 344.2292 78.49146 -196.3094      98.64977 
1 1 1 1   27 18 o 419.4529 33.34628 35.76587       5.387149      28.90267       6.258658      55.39058       10.58326  370.4615 44.38586 504.6721 54.88335 -134.2105      70.58531 
1 1 1 1   28 0  o 730.7006 21.45579 104.4488       6.088524      111.8784       8.061899      94.58571       9.288804  754.4445 27.51580 690.3876 34.75615 64.05682       44.32956 
1 1 1 1   28 1  o 151.2877 57.49566 3.530213       4.665402      4.049023       5.944850      2.698376       7.527588  166.1542 64.44911 170.3064 70.26492 -4.152191      95.34592 
1 1 1 1   28 2  o 501.7530 27.41328 49.62837       5.321474      45.90056       6.786376      55.58008       8.574958  479.6186 36.71341 525.7907 42.35349 -46.17215      56.05081 
1 1 1 1   28 3  o 129.7317 54.94294 0.5838624      4.787580      7.263542       6.065390      -10.45623      7.797714  192.7045 66.61642 119.4572 57.43182 73.24731       87.95545 
1 1 1 1   28 4  o 275.0269 48.55689 15.67411       4.996634      16.35564       6.240129      14.45636       8.341196  277.2091 59.72623 257.0906 77.28470 20.11844       97.67368 
1 1 1 1   28 5  o 448.9944 30.39742 39.95316       5.269136      36.53284       6.570096      46.11852       8.820994  426.0244 40.18562 475.4912 48.44582 -49.46686      62.94348 
1 1 1 1   28 6  o 415.9338 33.61292 34.49363       5.383084      39.17024       6.936816      27.41400       8.534925  440.7010 41.00140 358.4684 63.63949 82.23254       75.70403 
1 1 1 1   28 7  o 291.8512 79.97677 19.19848       9.333559      19.19848       9.333559      0.000000       0.000000  291.8512 79.97677 ?        ?        0.000000       79.97677 
1 1 1 1   28 8  o 205.7345 61.86581 9.017418       5.344322      5.887844       6.041602      20.27628       11.45926  179.7142 66.00037 295.2992 90.95891 -115.5850      112.3814 
1 1 1 1   28 9  o 347.9658 47.67554 25.03320       6.273170      25.03320       6.273170      0.000000       0.000000  347.9658 47.67554 ?        ?        0.000000       47.67554 
1 1 1 1   28 10 o 182.7610 56.86582 7.017837       4.466086      10.54394       4.957915      -8.156134      10.28493  220.8003 57.31682 148.2257 69.71182 72.57462       90.24941 
1 1 1 1   28 11 o 75.51346 37.57640 -10.45560      4.337023      -8.401784      4.869939      -18.32916      9.535157  88.58399 43.23588 117.3901 57.93076 -28.80607      72.28633 
1 1 1 1   28 12 o 141.2389 58.09679 2.035083       5.126976      3.969008       6.083947      -2.703209      9.523059  163.0467 64.61021 157.7372 71.59924 5.309464       96.44134 
1 1 1 1   28 13 o 169.4034 62.09222 5.491084       5.343565      3.013773       6.394337      11.22622       9.729199  158.1761 64.95113 226.1825 83.63712 -68.00638      105.8953 
1 1 1 1   28 14 o 177.8294 63.02834 6.494740       5.450836      5.959878       6.551134      7.698129       9.826486  178.4344 68.05536 203.9099 81.68179 -25.47548      106.3177 
1 1 1 1   28 15 o 137.5540 55.64672 2.426305       4.609736      2.854007       5.298804      1.095173       9.347990  146.7741 59.56139 167.9913 73.92969 -21.21722      94.93765 
1 1 1 1   28 16 o 216.7848 55.14818 10.49404       4.653956      6.691649       5.286762      23.58624       9.809975  177.4877 62.14611 307.8731 80.96761 -130.3854      102.0681 
1 1 1 1   29 0  o 273.5859 46.79092 15.54288       4.792790      18.48903       6.425537      11.84812       7.195721  294.3124 58.27946 233.1775 72.12036 61.13496       92.72455 
1 1 1 1   29 1  o 840.2522 19.55617 138.1557       6.381479      118.0223       8.343863      166.5291       9.905214  773.5998 27.77300 918.9323 27.75571 -145.3325      39.26473 
1 1 1 1   29 2  o 296.1431 43.14344 17.99893       4.816074      17.46561       6.336731      18.72832       7.410554  285.4218 59.11268 292.5151 66.71230 -7.093292      89.13383 
1 1 1 1   29 3  o 487.2583 27.80843 46.98651       5.240339      41.64727       6.881009      54.35920       8.085846  454.3181 39.38977 518.9472 40.44052 -64.62912      56.45343 
1 1 1 1   29 4  o 118.9196 52.35239 -0.7948604     4.691199      0.4363227      6.178843      -2.470421      7.208185  143.1474 61.56990 139.4669 62.89364 3.680527       88.01398 
1 1 1 1   29 5  o 273.6305 47.13885 15.61358       4.828434      10.54722       6.175358      23.58294       7.745078  220.2567 66.56282 330.2660 62.67845 -110.0093      91.42864 
1 1 1 1   29 6  f 104.1695 48.12046 -3.182024      4.561859      -2.696684      5.900215      -3.903363      7.193080  123.6809 56.22420 132.9651 61.05918 -9.284195      83.00231 
1 1 1 1   29 7  o 301.9264 54.49109 19.41525       6.154221      19.41525       6.154221      0.000000       0.000000  301.9264 54.49109 ?        ?        0.000000       54.49109 
1 1 1 1   29 8  o 148.3663 57.08996 3.474517       4.635688      3.474517       4.635688      0.000000       0.000000  148.3663 57.08996 ?        ?        0.000000       57.08996 
1 1 1 1   29 9  o 684.9228 27.37260 92.92505       7.280910      92.92505       7.280910      0.000000       0.000000  684.9228 27.37260 ?        ?        0.000000       27.37260 
1 1 1 1   29 10 o 201.3767 58.63741 8.889192       4.864326      9.216675       5.719503      8.033070       9.247658  204.6737 64.46248 205.6218 80.20829 -0.9481201     102.9018 
1 1 1 1   29 11 o 432.6700 32.76024 37.73484       5.463860      42.40108       6.541139      26.96336       9.938201  456.3950 37.22929 337.9780 77.38446 118.4170       85.87418 
1 1 1 1   29 12 o 286.3655 60.67805 18.33043       6.538344      16.43453       8.825941      20.63643       9.733809  260.3918 79.76354 289.4414 82.55326 -29.04953      114.7923 
1 1 1 1   29 13 o 162.7996 65.06062 4.183357       6.218179      4.559401       8.338223      3.712199       9.333343  178.0618 73.74799 179.4431 76.38310 -1.381302      106.1751 
1 1 1 1   29 14 o 169.6900 62.60415 5.737215       5.444923      2.258447       6.511116      13.82791       9.929690  152.1405 64.23365 237.3203 84.96685 -85.17989      106.5145 
1 1 1 1   30 0  f 583.0322 24.08470 66.98477       5.453330      70.25999       7.275338      62.78494       8.238503  593.1751 31.69694 557.1016 38.31194 36.07355       49.72424 
1 1 1 1   30 1  o 308.0471 41.50404 19.53289       4.838807      31.91481       6.496721      4.106628       7.251546  394.1101 43.15238 172.6986 69.81848 221.4115       82.07770 
1 1 1 1   30 2  o 190.7918 57.90424 7.817450       4.665988      15.78817       6.217142      -2.462150      7.060412  267.9442 61.10221 136.6924 61.88819 131.2518       86.96912 
1 1 1 1   30 3  o 492.5480 27.29247 48.16889       5.200186      53.68267       7.046541      41.57485       7.705967  516.2838 35.35760 449.1562 44.77430 67.12759       57.05171 
1 1 1 1   30 4  o 232.4529 52.38780 11.65150       4.616025      10.76888       6.036537      12.89434       7.163191  220.1086 65.65173 238.3451 71.61299 -18.23647      97.15231 
1 1 1 1   30 5  o 733.1606 21.20337 105.6807       6.037150      110.0638       8.138018      100.3164       9.002998  744.7165 28.13842 708.2854 32.73037 36.43109       43.16304 
1 1 1 1   30 6  o 308.3611 46.84584 19.97982       5.433455      20.36178       6.111518      18.53935       11.86843  308.2634 52.95868 273.5783 93.23489 34.68515       107.2258 
1 1 1 1   30 7  o 427.4324 39.94193 37.44596       6.553321      37.44596       6.553321      0.000000       0.000000  427.4324 39.94193 ?        ?        0.000000       39.94193 
1 1 1 1   30 8  o 236.1732 47.92453 11.95347       4.245354      9.884450       4.752560      20.12429       9.444495  211.3870 56.71498 287.9288 81.03820 -76.54178      98.91299 
1 1 1 1   30 9  f 123.2458 51.43870 1.214924       4.101288      0.1557137      4.601182      5.310380       9.047520  121.7067 52.73712 186.9025 77.06307 -65.19588      93.38052 
1 1 1 1   30 10 o 314.8694 40.86873 20.62535       4.879602      20.62535       4.879602      0.000000       0.000000  314.8694 40.86873 ?        ?        0.000000       40.86873 
1 1 1 1   30 11 o 392.1583 43.08484 32.13572       6.453507      32.93361       8.200264      30.83748       10.46003  388.0421 56.03909 357.6950 77.53609 30.34711       95.66725 
1 1 1 1   31 0  o 143.0375 56.27727 3.074183       4.585193      -4.970819      5.906076      15.27950       7.274622  112.5868 52.91082 255.9989 70.79456 -143.4121      88.38227 
1 1 1 1   31 1  o 330.6069 38.03992 22.45060       4.795012      23.08302       6.309961      21.58628       7.376638  328.4334 51.13515 310.0098 63.40913 18.42365       81.45871 
1 1 1 1   31 2  o 308.6838 40.69951 19.76212       4.760033      18.20466       6.220845      21.96204       7.393389  287.2714 57.76324 312.9041 63.02145 -25.63272      85.48856 
1 1 1 1   31 3  o 119.0608 51.95433 -0.1356555     4.530941      -4.393737      6.046661      5.316703       6.842279  116.3232 54.29991 175.1147 68.79517 -58.79144      87.64277 
1 1 1 1   31 4  o 282.6704 43.82803 16.80534       4.655505      16.17197       6.246337      17.59688       6.982807  268.0338 61.33512 277.1779 65.84563 -9.144135      89.98691 
1 1 1 1   31 5  o 319.8754 46.09518 21.62125       5.560856      22.72429       6.353746      18.01064       11.49543  324.5588 52.17685 265.3136 91.70995 59.24524       105.5137 
1 1 1 1   31 6  o 269.1905 53.16909 15.84282       5.361176      11.59961       6.028143      31.89786       11.72580  224.6671 65.23521 357.3173 85.62127 -132.6502      107.6412 
1 1 1 1   31 7  o 140.1515 57.17739 2.433402       4.915219      3.914956       5.869801      -1.043316      8.991857  158.3630 63.23864 156.2996 70.38714 2.063370       94.62280 
1 1 1 1   31 8  o 104.1266 47.13113 -1.597083      4.091593      -1.089929      4.601305      -3.513259      8.943936  113.6903 50.83940 146.5401 67.58289 -32.84981      84.57004 
1 1 1 2   0  0  o 49.81957 28.89791 0.5903073      0.9142688     0.5903073      0.9142688     0.5903073      0.9142688 49.81957 28.89791 49.81957 28.89791 0.000000       0.000000 
1 1 1 2   0  1  o 2132.084 24.10278 886.4662       19.95145      886.4662       19.95145      886.4662       19.95145  2132.084 24.10278 2132.084 24.10278 0.000000       0.000000 
1 1 1 2   0  2  o 773.3174 14.57942 116.3974       4.374996      116.3974       4.374996      116.3974       4.374996  773.3174 14.57942 773.3174 14.57942 0.000000       0.000000 
1 1 1 2   0  3  o 514.9012 14.02662 51.65182       2.800113      51.65182       2.800113      51.65182       2.800113  514.9012 14.02662 514.9012 14.02662 0.000000       0.000000 
1 1 1 2   0  4  o 1362.188 18.18984 361.0492       9.618768      361.0492       9.618768      361.0492       9.618768  1362.188 18.18984 1362.188 18.18984 0.000000       0.000000 
1 1 1 2   0  5  o 70.57879 37.32650 1.402029       1.369858      1.402029       1.369858      1.402029       1.369858  70.57879 37.32650 70.57879 37.32650 0.000000       0.000000 
1 1 1 2   0  6  o 208.3622 23.48165 8.759849       1.837980      8.759849       1.837980      8.759849       1.837980  208.3622 23.48165 208.3622 23.48165 0.000000       0.000000 
1 1 1 2   0  7  o 54.66544 35.31461 -0.4690766E-01 1.751938      -0.4690766E-01 1.751938      -0.4690766E-01 1.751938  54.66544 35.31461 54.66544 35.31461 0.000000       0.000000 
1 1 1 2   0  8  o 772.1951 16.57046 116.0185       4.964070      116.0185       4.964070      116.0185       4.964070  772.1951 16.57046 772.1951 16.57046 0.000000       0.000000 
1 1 1 2   0  9  o 2143.080 24.79664 893.4370       20.63138      893.4370       20.63138      893.4370       20.63138  2143.080 24.79664 2143.080 24.79664 0.000000       0.000000 
1 1 1 2   0  10 o 1154.407 18.41572 259.1876       8.251382      259.1876       8.251382      259.1876       8.251382  1154.407 18.41572 1154.407 18.41572 0.000000       0.000000 
1 1 1 2   0  11 o 133.2438 55.24954 4.873164       2.844631      4.873164       2.844631      4.873164       2.844631  133.2438 55.24954 133.2438 55.24954 0.000000       0.000000 
1 1 1 2   0  12 o 630.7437 19.77491 77.57959       4.833121      77.57959       4.833121      77.57959       4.833121  630.7437 19.77491 630.7437 19.77491 0.000000       0.000000 
1 1 1 2   0  13 o 275.6689 36.12512 15.57136       3.683450      15.57136       3.683450      15.57136       3.683450  275.6689 36.12512 275.6689 36.12512 0.000000       0.000000 
1 1 1 2   0  14 o 597.2863 21.81918 69.72002       5.045824      69.72002       5.045824      69.72002       5.045824  597.2863 21.81918 597.2863 21.81918 0.000000       0.000000 
1 1 1 2   0  15 o 149.0888 75.58871 6.565818       5.459839      6.565818       5.459839      6.565818       5.459839  149.0888 75.58871 149.0888 75.58871 0.000000       0.000000 
1 1 1 2   0  16 o 250.0364 51.14688 13.72366       4.390990      13.72366       4.390990      13.72366       4.390990  250.0364 51.14688 250.0364 51.14688 0.000000       0.000000 
1 1 1 2   0  17 o 110.6567 63.70094 3.120913       4.390470      3.120913       4.390470      3.120913       4.390470  110.6567 63.70094 110.6567 63.70094 0.000000       0.000000 
1 1 1 2   0  18 o 126.8960 68.63555 4.582985       4.726026      4.582985       4.726026      4.582985       4.726026  126.8960 68.63555 126.8960 68.63555 0.000000       0.000000 
1 1 1 2   0  19 o 113.3817 71.56718 1.281180       6.705884      1.281180       6.705884      1.281180       6.705884  113.3817 71.56718 113.3817 71.56718 0.000000       0.000000 
1 1 1 2   0  20 o 1362.010 22.87525 361.3510       12.09199      361.3510       12.09199      361.3510       12.09199  1362.010 22.87525 1362.010 22.87525 0.000000       0.000000 
1 1 1 2   0  21 o 1554.688 23.61933 470.6946       14.25321      470.6946       14.25321      470.6946       14.25321  1554.688 23.61933 1554.688 23.61933 0.000000       0.000000 
1 1 1 2   0  22 o 1692.790 24.61408 558.0305       16.17364      558.0305       16.17364      558.0305       16.17364  1692.790 24.61408 1692.790 24.61408 0.000000       0.000000 
1 1 1 2   0  23 o 289.0456 62.12358 18.48900       6.120996      18.48900       6.120996      18.48900       6.120996  289.0456 62.12358 289.0456 62.12358 0.000000       0.000000 
1 1 1 2   0  24 o 123.4054 73.63160 3.325722       6.229254      3.325722       6.229254      3.325722       6.229254  123.4054 73.63160 123.4054 73.63160 0.000000       0.000000 
1 1 1 2   0  25 o 326.4359 58.76093 22.91746       6.731785      22.91746       6.731785      22.91746       6.731785  326.4359 58.76093 326.4359 58.76093 0.000000       0.000000 
1 1 1 2   0  26 o 542.6196 37.94675 58.50103       7.906645      58.50103       7.906645      58.50103       7.906645  542.6196 37.94675 542.6196 37.94675 0.000000       0.000000 
1 1 1 2   0  27 o 159.6546 95.63390 6.036821       10.59225      6.036821       10.59225      6.036821       10.59225  159.6546 95.63390 159.6546 95.63390 0.000000       0.000000 
1 1 1 2   0  28 o 222.3760 94.04872 14.35503       8.214359      14.35503       8.214359      14.35503       8.214359  222.3760 94.04872 222.3760 94.04872 0.000000       0.000000 
1 1 1 2   0  29 o 793.2856 31.85578 124.1863       9.778035      124.1863       9.778035      124.1863       9.778035  793.2856 31.85578 793.2856 31.85578 0.000000       0.000000 
1 1 1 2   0  30 o 109.4995 72.50986 -0.8894223     8.088450      -0.8894223     8.088450      -0.8894223     8.088450  109.4995 72.50986 109.4995 72.50986 0.000000       0.000000 
1 1 1 2   0  31 o 541.9570 70.46436 64.62827       14.13824      64.62827       14.13824      64.62827       14.13824  541.9570 70.46436 541.9570 70.46436 0.000000       0.000000 
1 1 1 2   0  32 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 2   0  33 o 80.83817 58.11098 -12.21073      8.856503      -12.21073      8.856503      -12.21073      8.856503  80.83817 58.11098 80.83817 58.11098 0.000000       0.000000 
1 1 1 2   1  0  o 396.1485 13.25953 30.54623       2.039924      0.000000       0.000000      30.54623       2.039924  ?        ?        396.1485 13.25953 0.000000       13.25953 
1 1 1 2   1  1  o 577.2935 13.78092 64.87436       3.089604      68.44726       4.614168      61.97049       4.159792  592.1530 20.06464 563.5933 19.00543 28.55969       27.63687 
1 1 1 2   1  2  o 1080.406 13.27592 227.1398       5.570314      229.5841       6.863719      222.4239       9.533796  1085.624 16.27991 1066.868 23.01056 18.75610       28.18725 
1 1 1 2   1  3  f 914.0571 15.32901 162.6399       5.441458      162.6399       5.441458      0.000000       0.000000  914.0571 15.32901 ?        ?        0.000000       15.32901 
1 1 1 2   1  4  o 937.2509 11.03688 170.7563       4.017261      174.5531       5.782984      167.2152       5.584731  947.0901 15.72290 926.9960 15.51302 20.09406       22.08763 
1 1 1 2   1  5  o 216.9335 14.09789 9.189556       1.181262      9.507997       1.689779      8.885205       1.651975  220.0677 19.98983 212.6439 20.24882 7.423813       28.45361 
1 1 1 2   1  6  o 987.4888 11.58989 189.4921       4.444670      185.1863       6.188813      194.0786       6.387311  975.8412 16.33053 998.9832 16.46387 -23.14197      23.18933 
1 1 1 2   1  7  o 470.2802 11.89112 42.97380       2.171738      40.68067       3.042658      45.35535       3.100768  457.3955 17.12905 482.9841 16.53135 -25.58865      23.80526 
1 1 1 2   1  8  o 924.3419 11.96945 166.0096       4.296697      164.5063       5.997957      167.5943       6.158102  919.8704 16.78992 928.4444 17.07902 -8.573975      23.94983 
1 1 1 2   1  9  o 471.4596 13.37001 43.19361       2.447959      39.31577       3.380572      47.46862       3.549473  449.6099 19.36094 494.0674 18.49906 -44.45746      26.77800 
1 1 1 2   1  10 o 1708.901 15.34760 567.6782       10.18557      554.7160       13.97281      582.3763       14.87900  1688.431 21.30947 1729.870 22.14789 -41.43921      30.73471 
1 1 1 2   1  11 o 549.3508 14.05255 58.66012       2.998009      60.58033       4.243700      56.74691       4.235961  558.0004 19.58313 540.0231 20.19815 17.97736       28.13298 
1 1 1 2   1  12 o 725.3498 13.45179 102.2747       3.789269      103.4553       5.358158      101.0935       5.359515  729.1342 18.92257 720.7446 19.14768 8.389648       26.92020 
1 1 1 2   1  13 o 930.1498 13.56698 168.2247       4.900768      157.4167       6.684348      180.7872       7.206537  899.1738 19.14200 963.5961 19.25767 -64.42224      27.15279 
1 1 1 2   1  14 o 1173.826 16.26789 268.1920       7.415885      263.3015       8.989271      278.6119       13.12138  1162.382 19.91351 1193.520 28.30883 -31.13818      34.61124 
1 1 1 2   1  15 o 276.5024 32.40889 15.20930       3.414083      19.20901       4.227690      7.710908       5.788592  310.4619 35.71519 197.9343 65.07519 112.5276       74.23177 
1 1 1 2   1  16 o 641.0977 18.81712 80.12780       4.684956      89.00037       8.349857      76.05125       5.659799  673.1382 31.94088 623.9036 23.35907 49.23462       39.57102 
1 1 1 2   1  17 o 122.0034 46.46998 2.108504       3.051911      3.506116       4.281974      0.6654952      4.350960  148.8985 55.40106 125.9466 52.80526 22.95185       76.53544 
1 1 1 2   1  18 o 1018.759 17.58484 202.1258       6.957256      198.5863       11.93982      203.9453       8.560752  1006.817 30.53651 1022.578 21.55696 -15.76099      37.37889 
1 1 1 2   1  19 o 787.5232 23.31124 120.9566       7.129460      124.3264       10.05277      117.5465       10.11266  796.7768 32.48785 774.5143 33.62080 22.26245       46.75274 
1 1 1 2   1  20 o 848.1483 19.43929 140.0464       6.402949      141.4019       7.894204      137.4399       10.94681  851.6815 23.86729 838.0499 33.63488 13.63159       41.24261 
1 1 1 2   1  21 o 684.7951 18.97305 91.25600       5.045750      89.57800       7.088866      92.97915       7.183612  677.7250 26.93366 690.4873 26.78916 -12.76233      37.98791 
1 1 1 2   1  22 o 1454.104 16.73085 411.2155       9.448030      419.0179       13.67166      404.0830       13.07160  1466.619 24.00357 1440.366 23.36835 26.25305       33.50002 
1 1 1 2   1  23 o 400.9979 29.73936 31.55492       4.598286      28.20320       6.497216      34.91851       6.508717  376.2277 45.38461 420.1810 40.38442 -43.95325      60.75084 
1 1 1 2   1  24 o 257.2646 47.60652 13.44800       4.581176      13.96598       6.539563      12.94885       6.419624  259.5103 65.02171 250.0611 65.37122 9.449219       92.20206 
1 1 1 2   1  25 o 300.2694 43.26075 18.10954       4.899086      19.45494       6.816021      16.67164       7.046431  307.5308 59.21947 282.9593 65.42934 24.57144       88.24934 
1 1 1 2   1  26 o 569.3176 30.20911 63.59757       6.655237      72.51683       11.28760      58.84463       8.239831  603.2753 48.59100 545.6178 39.14696 57.65747       62.39848 
1 1 1 2   1  27 o 793.3158 21.73383 122.7540       6.695920      121.8288       9.384377      123.7135       9.556901  788.5815 30.64297 794.5825 30.97064 -6.001038      43.56802 
1 1 1 2   1  28 o 236.9338 59.50101 11.77228       5.467317      5.048743       7.476257      19.50130       8.015819  186.7010 72.31527 303.0154 69.58463 -116.3143      100.3569 
1 1 1 2   1  29 o 713.6392 28.12668 100.0373       7.795162      96.73228       9.325085      107.7048       14.20326  699.7961 34.31257 729.7418 50.42701 -29.94568      60.99373 
1 1 1 2   1  30 o 111.1880 52.19942 -5.343338      5.723167      -0.2953577     7.849547      -11.07239      8.362329  156.6181 68.36212 123.4309 59.37553 33.18723       90.54742 
1 1 1 2   1  31 o 96.81055 48.68374 -23.32476      8.213350      -23.32476      8.213350      0.000000       0.000000  96.81055 48.68374 ?        ?        0.000000       48.68374 
1 1 1 2   1  32 o 115.8233 55.36695 -7.943033      7.020686      -22.22758      12.60896      -1.524505      8.452083  134.9774 66.61122 152.6998 68.54906 -17.72241      95.58258 
1 1 1 2   1  33 f 132.5651 59.35676 -1.133359      6.293953      -7.515075      8.784579      5.598220       9.022164  132.9218 63.08326 187.0240 77.01543 -54.10222      99.55338 
1 1 1 2   2  0  o 909.1315 15.32224 160.9672       5.409745      152.7228       7.548434      169.6733       7.756894  884.1608 21.98354 932.0768 21.42931 -47.91608      30.70002 
1 1 1 2   2  1  o 907.0923 15.63322 160.2473       5.507164      171.8442       8.149313      150.4995       7.471383  937.8853 22.37398 877.8152 21.91643 60.07007       31.31972 
1 1 1 2   2  2  o 594.6121 20.75010 68.99039       4.791614      0.000000       0.000000      68.99039       4.791614  ?        ?        594.6121 20.75010 0.000000       20.75010 
1 1 1 2   2  3  o 828.5215 21.85483 133.9141       7.032007      0.000000       0.000000      133.9141       7.032007  ?        ?        828.5215 21.85483 0.000000       21.85483 
1 1 1 2   2  4  o 366.1271 10.65035 26.05308       1.514341      29.16229       2.167624      23.08881       2.116494  387.2114 14.41477 344.4798 15.82069 42.73157       21.40280 
1 1 1 2   2  5  o 436.8061 10.80583 37.07745       1.833052      36.63683       2.601429      37.51196       2.583319  434.0291 15.43353 439.1950 15.14581 -5.165863      21.62382 
1 1 1 2   2  6  o 1150.977 12.17778 257.4402       5.443308      252.5702       7.577008      262.6342       7.824980  1139.597 17.12058 1162.056 17.33917 -22.45923      24.36721 
1 1 1 2   2  7  o 727.2211 11.35559 102.7516       3.207038      97.01864       4.419150      109.1304       4.661414  706.4304 16.10799 749.2341 16.02036 -42.80371      22.71825 
1 1 1 2   2  8  o 579.7010 12.01087 65.29427       2.704000      63.97665       3.769221      66.69143       3.881310  573.6474 16.91915 585.6858 17.06419 -12.03839      24.03007 
1 1 1 2   2  9  o 1195.438 12.98760 277.6948       6.029535      274.6236       8.401176      280.9572       8.658756  1188.392 18.20340 1201.985 18.54935 -13.59290      25.98927 
1 1 1 2   2  10 o 1104.438 12.91307 237.0388       5.538582      227.1419       7.547226      248.5891       8.153315  1080.740 17.98201 1130.555 18.57011 -49.81531      25.84960 
1 1 1 2   2  11 o 307.0845 19.47482 18.42128       2.310499      17.13276       3.252053      19.73464       3.283247  295.0128 28.75036 317.0610 26.91890 -22.04822      39.38541 
1 1 1 2   2  12 o 741.1974 13.48272 106.7959       3.880961      112.0036       5.598254      101.9773       5.384973  758.6335 19.00171 723.8689 19.15559 34.76459       26.98151 
1 1 1 2   2  13 o 715.4661 14.14794 99.54773       3.931066      97.94328       5.514871      101.2050       5.604958  709.1408 20.02511 720.8526 20.02156 -11.71179      28.31727 
1 1 1 2   2  14 o 1343.243 16.68337 351.2593       8.702950      350.2245       10.70073      353.2811       14.95766  1340.369 20.55708 1343.729 28.66317 -3.359985      35.27280 
1 1 1 2   2  15 o 492.8310 17.53623 47.31826       3.356312      45.10373       4.706379      49.61004       4.787751  479.6424 25.35637 503.8383 24.46878 -24.19595      35.23729 
1 1 1 2   2  16 o 617.0570 18.94112 74.23476       4.538987      82.78487       8.310347      70.59969       5.418622  648.1183 33.12763 601.1506 23.21013 46.96765       40.44935 
1 1 1 2   2  17 o 592.7078 20.42683 68.52077       4.701858      71.37585       8.380456      67.20920       5.680070  601.0624 36.06892 586.3654 24.94350 14.69702       43.85368 
1 1 1 2   2  18 o 870.8312 18.05763 147.7056       6.106927      140.6921       10.06635      151.7902       7.682097  847.4849 30.58525 882.0582 22.42614 -34.57336      37.92611 
1 1 1 2   2  19 o 406.8460 24.20685 32.40415       3.807420      32.67083       5.352172      32.13092       5.417432  406.8937 34.18733 403.3538 34.92912 3.539856       48.87552 
1 1 1 2   2  20 o 440.7963 28.47437 38.09243       4.848329      36.78579       5.914101      40.77016       8.466296  431.9696 35.57012 452.0182 49.01446 -20.04865      60.56113 
1 1 1 2   2  21 o 712.9973 19.09822 98.92784       5.288209      90.60799       7.275949      108.2441       7.699311  681.5641 27.48874 745.0526 26.60951 -63.48853      38.25830 
1 1 1 2   2  22 o 1449.786 16.81291 408.7823       9.466181      414.3228       13.50401      403.4296       13.27337  1458.414 23.84262 1439.132 23.74940 19.28198       33.65270 
1 1 1 2   2  23 o 1332.542 16.86841 345.3726       8.729375      344.0766       12.30249      346.6868       12.38836  1328.931 23.83760 1333.948 23.91372 -5.016968      33.76532 
1 1 1 2   2  24 o 744.5130 20.96332 107.9575       6.061223      114.1394       8.869327      102.5406       8.302453  764.3460 29.87946 724.5240 29.50704 39.82202       41.99342 
1 1 1 2   2  25 o 335.9736 46.02331 22.67358       5.847120      29.63874       10.20008      19.26455       7.135979  377.3957 72.22621 305.1951 62.31483 72.20059       95.39268 
1 1 1 2   2  26 o 164.6400 60.25942 4.465912       5.030176      10.49563       6.961709      -2.120875      7.276195  227.6700 71.02397 145.6097 64.59454 82.06032       96.00448 
1 1 1 2   2  27 o 971.1298 19.80540 183.8162       7.469454      175.9130       10.23972      192.8042       10.91987  948.2991 27.80446 992.6453 28.32665 -44.34613      39.69241 
1 1 1 2   2  28 o 602.8561 26.46943 71.15042       6.197068      72.54209       8.631234      69.66972       8.903040  605.3375 36.89138 592.5533 38.90471 12.78418       53.61483 
1 1 1 2   2  29 o 170.1193 63.38088 4.823188       5.608002      14.05435       7.749069      -5.328337      8.126190  255.3121 73.91403 139.6295 64.40402 115.6826       98.03654 
1 1 1 2   2  30 o 410.7894 53.82151 34.99865       8.379682      34.99865       8.379682      0.000000       0.000000  410.7894 53.82151 ?        ?        0.000000       53.82151 
1 1 1 2   2  31 o 224.0667 66.17375 11.00266       6.156288      14.67938       8.462118      6.868648       8.972930  254.5701 78.12257 201.0660 78.84777 53.50409       110.9960 
1 1 1 2   2  32 o 398.0295 50.14959 33.38739       7.579864      33.43607       13.47240      33.36485       9.168657  364.0056 94.47956 389.7200 62.70620 -25.71436      113.3951 
1 1 1 2   2  33 o 256.8256 73.31622 15.79012       7.673877      0.7253855E-02  14.01051      22.55422       9.172041  190.2876 86.55568 304.6616 77.37466 -114.3740      116.0979 
1 1 1 2   3  0  o 1021.492 13.21966 203.0161       5.244250      208.9431       9.462040      200.3882       6.300487  1034.065 23.56183 1014.393 15.99337 19.67212       28.47715 
1 1 1 2   3  1  o 260.3024 18.32235 13.26911       1.840383      11.12961       2.573076      15.51004       2.633361  236.7022 28.56896 280.6847 24.40094 -43.98251      37.57115 
1 1 1 2   3  2  o 1187.759 13.85321 274.4545       6.390088      275.2383       7.756598      272.7991       11.27313  1188.929 16.79915 1181.797 24.56254 7.131958       29.75785 
1 1 1 2   3  3  o 1075.250 11.46153 224.7527       4.786081      226.7070       6.811314      222.8469       6.726564  1079.303 16.25023 1070.084 16.18629 9.218506       22.93613 
1 1 1 2   3  4  o 870.0298 12.72051 147.1565       4.298004      143.1068       5.094665      157.1540       8.004811  857.7492 15.29422 897.9025 22.95588 -40.15326      27.58415 
1 1 1 2   3  5  o 159.0209 17.64716 4.979625       1.071447      5.639695       1.523202      4.333152       1.507432  168.4703 23.95604 146.7043 27.46812 21.76602       36.44708 
1 1 1 2   3  6  o 824.7113 11.19259 132.1515       3.584764      131.3353       5.047956      132.9818       5.091569  821.9061 15.81486 827.0394 15.85249 -5.133301      22.39221 
1 1 1 2   3  7  o 121.1923 29.10591 2.977643       1.352667      2.361413       1.871594      3.651530       1.957195  112.4957 37.00366 134.5445 36.52145 -22.04884      51.99123 
1 1 1 2   3  8  o 572.5032 12.05321 63.68296       2.679839      64.98575       3.780764      62.36755       3.799033  578.1589 16.83854 566.3746 17.27195 11.78430       24.12170 
1 1 1 2   3  9  o 855.2096 12.15757 142.1100       4.037823      142.1907       5.709627      142.0293       5.711061  855.1753 17.19193 854.6888 17.20603 0.4864502      24.32303 
1 1 1 2   3  10 o 293.2756 18.85214 16.79892       2.135785      16.90597       3.026165      16.69268       3.014779  293.3379 26.86250 291.4574 26.93979 1.880493       38.04400 
1 1 1 2   3  11 o 1031.714 13.05957 206.8821       5.232582      207.3676       7.396111      206.3956       7.403871  1032.443 18.44629 1030.014 18.50920 2.429321       26.13152 
1 1 1 2   3  12 o 1221.116 13.73998 289.8938       6.515847      289.8759       9.217213      289.9117       9.212388  1220.335 19.44879 1220.412 19.43738 -0.7702637E-01 27.49667 
1 1 1 2   3  13 o 924.2383 15.52683 166.1848       5.573073      160.1188       6.718760      179.5635       9.977981  906.7744 19.07928 958.9221 26.79362 -52.14764      32.89250 
1 1 1 2   3  14 o 400.3773 19.33822 31.23884       3.006865      35.17479       4.251979      27.30153       4.252719  423.4614 25.98083 372.2453 29.66400 51.21606       39.43294 
1 1 1 2   3  15 o 148.0483 44.59031 4.392381       2.774708      3.137257       3.852962      5.744576       3.999181  141.2777 52.55509 170.2221 53.93468 -28.94437      75.30596 
1 1 1 2   3  16 o 346.9134 23.72766 23.62509       3.177526      27.08916       4.459852      20.05382       4.528332  370.1865 31.31584 316.7500 37.54308 53.43655       48.88931 
1 1 1 2   3  17 o 415.0657 32.05826 34.00992       5.127501      0.000000       0.000000      34.00992       5.127501  ?        ?        415.0657 32.05826 0.000000       32.05826 
1 1 1 2   3  18 o 1000.478 15.35742 194.7840       5.966969      188.2710       8.295845      201.7653       8.588923  982.5430 21.74108 1017.145 21.74342 -34.60205      30.74818 
1 1 1 2   3  19 o 493.4332 21.35136 47.44443       4.091495      45.39957       5.824577      49.43633       5.748663  480.7043 31.37230 502.0130 29.61773 -21.30872      43.14431 
1 1 1 2   3  20 o 811.3198 16.88508 128.0584       5.320141      128.8039       7.456636      127.2853       7.592844  812.9399 23.61873 808.0593 24.19542 4.880615       33.81217 
1 1 1 2   3  21 o 1104.839 18.80841 237.5186       8.070098      237.8296       9.821994      236.8726       14.15774  1105.010 22.88787 1100.939 33.11330 4.071045       40.25351 
1 1 1 2   3  22 o 379.5725 30.14221 28.29263       4.406647      29.32091       6.142578      27.20226       6.325321  384.5125 41.80885 369.5641 45.00130 14.94836       61.42554 
1 1 1 2   3  23 o 1334.187 19.77697 346.4545       10.24718      341.4233       17.58677      349.0406       12.60861  1321.379 34.27131 1338.370 24.25845 -16.99023      41.98804 
1 1 1 2   3  24 o 874.3262 26.49431 149.1670       8.996098      149.1670       8.996098      0.000000       0.000000  874.3262 26.49431 ?        ?        0.000000       26.49431 
1 1 1 2   3  25 o 680.3057 22.31870 90.22291       5.896591      85.93109       8.100691      95.05983       8.599746  662.6407 31.47864 696.8984 31.77519 -34.25763      44.72770 
1 1 1 2   3  26 o 867.9180 20.11634 146.7782       6.780404      147.3338       9.418358      146.1804       9.769137  868.1649 27.93476 864.5157 29.09748 3.649231       40.33626 
1 1 1 2   3  27 o 709.6367 23.04223 98.29070       6.350216      101.1267       8.814658      95.23061       9.156199  718.1739 31.60442 696.4282 33.85406 21.74567       46.31347 
1 1 1 2   3  28 o 497.7907 35.36842 49.07268       6.792892      61.18056       8.322730      24.91219       11.75668  555.0219 38.85760 336.4816 88.70842 218.5403       96.84573 
1 1 1 2   3  29 f 619.0504 30.42644 75.45562       7.314845      84.91061       8.708049      52.79271       13.48181  654.5936 34.37507 498.5221 71.69932 156.0715       79.51376 
1 1 1 2   3  30 o 484.9878 37.31158 47.12177       6.973598      48.93376       8.353651      42.95585       12.66640  491.2602 44.26144 442.2307 76.52254 49.02945       88.40121 
1 1 1 2   3  31 o 598.3887 28.88852 70.88669       6.713309      81.90021       9.486790      59.83937       9.501333  637.4405 38.50303 540.4351 45.69857 97.00537       59.75652 
1 1 1 2   3  32 o 363.4910 53.56665 28.24950       7.334960      25.65289       8.854142      33.92976       13.09567  335.4852 70.21250 368.6005 91.82381 -33.11530      115.5916 
1 1 1 2   3  33 o 131.6967 62.06154 -6.167723      8.225322      0.000000       0.000000      -6.167723      8.225322  ?        ?        131.6967 62.06154 0.000000       62.06154 
1 1 1 2   4  0  o 437.9246 12.66693 37.29416       2.154263      41.69460       4.063737      35.57416       2.540633  462.2896 22.63515 427.5615 15.30084 34.72818       27.32153 
1 1 1 2   4  1  o 524.7796 15.78543 53.59401       3.217076      49.12143       4.487142      58.32472       4.614810  501.7781 23.02661 546.9085 21.72757 -45.13037      31.65932 
1 1 1 2   4  2  f 811.7287 12.41245 128.1025       3.912879      131.3425       4.756708      121.3218       6.881396  821.7047 14.90606 788.8433 22.46249 32.86133       26.95837 
1 1 1 2   4  3  o 827.5769 16.07187 133.2372       5.165384      135.2335       7.388079      131.3282       7.224578  832.9623 22.83906 820.8708 22.66260 12.09155       32.17477 
1 1 1 2   4  4  o 941.9359 13.06902 172.4607       4.780708      172.9175       5.756466      171.4455       8.582523  942.9644 15.71928 938.0682 23.55877 4.896179       28.32157 
1 1 1 2   4  5  o 552.8470 12.76542 59.39851       2.740742      63.04672       3.293514      51.18279       4.942455  569.4847 14.89188 512.5879 24.82826 56.89685       28.95187 
1 1 1 2   4  6  o 488.7572 11.37453 46.41336       2.159009      47.69416       3.067359      45.15578       3.039433  495.3127 15.94620 481.9413 16.23942 13.37140       22.75961 
1 1 1 2   4  7  o 816.0729 11.54199 129.3917       3.657948      126.0564       5.099388      132.9271       5.250145  805.2554 16.30634 826.9067 16.34883 -21.65131      23.09071 
1 1 1 2   4  8  o 498.6163 12.52433 48.30845       2.425209      53.76499       3.492474      43.22695       3.370313  525.8702 17.10120 471.4797 18.40684 54.39050       25.12494 
1 1 1 2   4  9  o 1305.103 13.41829 331.0113       6.800956      331.1208       9.595300      330.9008       9.640870  1304.789 18.93608 1304.345 19.03250 0.4443359      26.84793 
1 1 1 2   4  10 o 1090.799 12.98411 231.2374       5.500280      227.5184       7.693609      235.1254       7.866410  1081.535 18.31731 1099.456 18.42345 -17.92102      25.97974 
1 1 1 2   4  11 o 1545.648 14.76873 464.4816       8.865063      457.3677       12.29715      472.1792       12.79165  1532.839 20.65759 1557.369 21.14984 -24.52954      29.56437 
1 1 1 2   4  12 o 470.3373 18.12532 43.05222       3.310724      42.93953       4.123703      43.25660       5.553249  469.4269 22.61994 469.4941 30.62485 -0.6719971E-01 38.07286 
1 1 1 2   4  13 o 560.0454 17.53831 61.06247       3.814512      59.25169       4.692768      64.58888       6.548803  551.2765 21.91955 573.8906 29.48315 -22.61407      36.73857 
1 1 1 2   4  14 o 404.4360 19.11132 31.87811       3.001708      26.37036       4.181037      37.73659       4.312109  365.7238 29.69402 438.6939 25.41941 -72.97009      39.08812 
1 1 1 2   4  15 o 562.8481 16.71873 61.70664       3.654454      58.77731       5.062723      64.89341       5.280510  548.4565 23.76917 576.3120 23.59339 -27.85541      33.49061 
1 1 1 2   4  16 o 286.1089 33.38715 16.30260       3.639931      14.20387       6.053789      17.49093       4.555325  260.1739 60.97807 294.7365 40.90002 -34.56262      73.42436 
1 1 1 2   4  17 o 405.5132 32.95952 32.49268       5.145642      0.000000       0.000000      32.49268       5.145642  ?        ?        405.5132 32.95952 0.000000       32.95952 
1 1 1 2   4  18 o 698.2858 19.77744 95.01086       5.363291      91.36235       9.226175      96.87305       6.591398  681.3698 34.98466 704.5050 24.09159 -23.13519      42.47742 
1 1 1 2   4  19 o 588.7107 18.91667 67.47832       4.324885      66.80343       6.135565      68.14480       6.097237  584.9479 27.00905 590.8428 26.57254 -5.894958      37.88916 
1 1 1 2   4  20 o 924.8423 16.36906 166.3763       5.879218      163.9888       8.293243      168.7885       8.335859  917.3651 23.27846 930.7231 23.06226 -13.35809      32.76819 
1 1 1 2   4  21 o 1347.986 19.20821 353.5820       10.05542      348.4009       12.14145      364.8960       17.94174  1337.391 23.37674 1366.347 33.81237 -28.95544      41.10655 
1 1 1 2   4  22 o 1277.077 23.85994 317.6990       11.83353      317.4009       16.56772      318.0095       16.90774  1274.516 33.47260 1275.580 34.13107 -1.063110      47.80528 
1 1 1 2   4  23 o 429.3086 28.57156 36.12326       4.736355      38.01266       6.528960      34.02440       6.881361  438.7862 38.71130 414.0232 43.44542 24.76297       58.18995 
1 1 1 2   4  24 o 662.2504 21.61002 85.44610       5.557831      88.87939       7.643849      81.59511       8.095503  674.4994 29.18116 645.8315 32.27726 28.66791       43.51277 
1 1 1 2   4  25 o 456.7126 30.60777 40.98646       5.397378      39.66758       7.473884      42.42399       7.802827  446.5417 43.65636 461.8361 44.03825 -15.29437      62.01004 
1 1 1 2   4  26 o 673.9289 23.86874 88.62868       6.247000      102.9672       8.732105      73.59670       8.940775  725.1719 31.00630 610.7105 37.88438 114.4614       48.95525 
1 1 1 2   4  27 f 202.4812 66.24866 8.084610       6.001925      15.03677       7.409313      -5.183768      10.23592  266.9314 70.44648 162.6480 73.98319 104.2834       102.1578 
1 1 1 2   4  28 o 563.9004 27.75868 62.33462       6.078959      67.25058       8.317326      56.69713       8.906808  582.4814 36.95974 532.5209 43.44691 49.96057       57.04083 
1 1 1 2   4  29 o 396.6551 43.66464 31.79962       6.614821      33.10991       7.794312      28.42619       12.50633  402.0342 51.07394 354.1584 90.57128 47.87579       103.9793 
1 1 1 2   4  30 f 152.8574 61.41850 2.799157       5.574347      9.725959       7.534069      -5.579531      8.286119  216.8450 74.28235 138.9884 64.43259 77.85664       98.33324 
1 1 1 2   4  31 o 435.9849 36.64095 38.34210       6.146390      49.37741       8.594972      26.79234       8.793031  490.3173 45.66274 348.5324 67.40102 141.7849       81.41243 
1 1 1 2   4  32 o 238.7028 68.28959 13.03917       6.650325      15.64376       10.88631      11.48848       8.399883  254.3667 89.17196 225.1254 78.36256 29.24130       118.7111 
1 1 1 2   4  33 o 305.5070 91.02946 24.65295       11.60982      0.000000       0.000000      24.65295       11.60982  ?        ?        305.5070 91.02946 0.000000       91.02946 
1 1 1 2   5  0  o 340.4685 11.94220 22.53288       1.579027      24.12201       2.220602      20.90752       2.245773  352.1099 16.23919 327.2709 17.73597 24.83899       24.04737 
1 1 1 2   5  1  o 648.0499 12.45969 81.63892       3.135766      77.16123       5.560238      83.72726       3.797244  629.2124 22.75454 656.1295 14.90222 -26.91705      27.20010 
1 1 1 2   5  2  o 1151.041 14.01637 257.5936       6.265475      260.2796       7.636528      252.0617       10.95934  1156.678 17.00026 1137.062 24.81830 19.61548       30.08250 
1 1 1 2   5  3  o 796.7465 10.60780 123.3455       3.282265      120.1209       3.632084      137.7083       7.665352  786.1962 11.89589 840.7825 23.47580 -54.58630      26.31778 
1 1 1 2   5  4  o 884.2608 10.96912 151.9252       3.766866      156.5913       5.427263      147.5883       5.232386  897.4528 15.57189 871.2795 15.46373 26.17328       21.94563 
1 1 1 2   5  5  o 837.0696 13.06939 136.1657       4.248590      136.9801       5.078069      134.2657       7.756711  839.4281 15.57712 830.4184 24.05208 9.009705       28.65570 
1 1 1 2   5  6  o 491.2893 11.36039 46.89410       2.167497      45.99134       3.034669      47.83426       3.096886  486.3999 16.06534 496.0491 16.07580 -9.649170      22.72722 
1 1 1 2   5  7  o 909.0619 11.80436 160.5624       4.167388      158.8292       5.854420      162.3427       5.933531  903.8740 16.67815 913.8138 16.71966 -9.939880      23.61584 
1 1 1 2   5  8  o 505.3407 12.55340 49.62132       2.463620      53.06875       3.509792      46.27306       3.458936  522.4372 17.29893 487.8049 18.25864 34.63226       25.15215 
1 1 1 2   5  9  o 998.7314 12.46793 193.8300       4.835832      194.9145       6.837587      192.7447       6.840211  1001.150 17.58634 995.5534 17.69200 5.597046       24.94567 
1 1 1 2   5  10 o 553.2829 18.93581 59.55662       4.068733      59.55662       4.068733      0.000000       0.000000  553.2829 18.93581 ?        ?        0.000000       18.93581 
1 1 1 2   5  11 o 181.2319 34.96906 6.640636       2.372030      4.822700       2.940032      10.03068       4.014813  155.3022 45.69179 221.5356 48.04831 -66.23338      66.30520 
1 1 1 2   5  12 o 534.9137 17.13565 55.68189       3.559692      57.48092       4.491917      52.64480       5.836365  543.1638 21.29477 518.2521 29.11632 24.91168       36.07252 
1 1 1 2   5  13 o 697.6592 14.23840 94.68511       3.857735      93.28596       5.410774      96.13166       5.501684  691.8512 20.13811 702.3201 20.17123 -10.46893      28.50302 
1 1 1 2   5  14 o 618.9058 15.24202 74.56082       3.663490      74.06284       5.151728      75.07027       5.210690  616.0857 21.53197 620.2476 21.63227 -4.161865      30.52181 
1 1 1 2   5  15 o 199.2274 43.29924 8.162278       3.254434      6.647686       5.582854      8.941868       4.005361  186.9973 63.94443 207.6338 50.22085 -20.63647      81.30820 
1 1 1 2   5  16 o 721.0226 17.82597 101.2997       4.991489      92.23952       8.275709      106.4803       6.257914  685.5970 31.08195 738.5911 21.81713 -52.99402      37.97466 
1 1 1 2   5  17 o 1381.757 15.45894 371.6115       8.295437      362.6561       11.42203      381.6077       12.06761  1363.480 21.57080 1398.457 22.22001 -34.97656      30.96819 
1 1 1 2   5  18 o 163.6629 53.69440 5.136458       3.941709      0.1212087      6.930330      7.534627       4.792338  153.1400 65.51826 193.3579 58.68299 -40.21788      87.95644 
1 1 1 2   5  19 o 1020.959 15.73451 202.7632       6.238634      196.7407       8.583539      209.5072       9.083169  1004.829 21.99613 1036.825 22.55817 -31.99609      31.50715 
1 1 1 2   5  20 o 562.1092 23.84724 61.57247       5.205791      46.95685       8.701518      69.71970       6.496681  486.3070 46.64639 597.7424 27.98656 -111.4354      54.39791 
1 1 1 2   5  21 o 989.9737 16.82806 190.6077       6.469724      183.8258       8.898637      198.2123       9.423006  971.4536 23.58704 1008.688 24.05497 -37.23419      33.68961 
1 1 1 2   5  22 o 381.1743 35.35109 28.65022       5.173498      34.07785       6.249112      16.82644       9.223412  415.3255 39.20763 285.0858 80.03000 130.2397       89.11812 
1 1 1 2   5  23 o 828.8759 19.07504 133.7141       6.140205      126.5355       8.384228      142.0180       9.017430  805.4168 26.80491 853.2099 27.21441 -47.79309      38.19853 
1 1 1 2   5  24 f 754.3584 30.06267 111.2325       8.807107      0.000000       0.000000      111.2325       8.807107  ?        ?        754.3584 30.06267 0.000000       30.06267 
1 1 1 2   5  25 o 480.6367 32.50385 45.44516       6.031418      51.66869       7.379403      32.92139       10.46816  511.6064 37.40051 398.6126 70.18608 112.9937       79.52914 
1 1 1 2   5  26 o 743.5436 22.70457 107.8433       6.556132      126.1180       9.129243      88.38119       9.421190  802.8671 29.27946 669.7832 36.35579 133.0839       46.68008 
1 1 1 2   5  27 o 492.4101 30.46340 47.70879       5.796891      54.42616       7.976579      40.18995       8.439038  523.8088 39.50238 446.8225 49.46256 76.98627       63.30074 
1 1 1 2   5  28 o 618.7321 30.21880 75.21409       7.261192      77.32320       8.628970      70.09763       13.43986  624.9415 35.70238 584.7314 60.03692 40.21002       69.85050 
1 1 1 2   5  29 o 537.3339 32.36002 57.20964       6.721255      54.75102       7.943026      63.40893       12.61279  523.1041 39.38845 553.0894 59.66509 -29.98529      71.49387 
1 1 1 2   5  30 o 478.5364 32.94137 45.63390       6.084589      41.65527       8.218164      50.46079       9.051950  450.8407 47.66047 496.6925 47.50687 -45.85181      67.29356 
1 1 1 2   5  31 o 292.3320 53.79006 18.23417       5.881677      30.07000       8.323967      6.432511       8.311941  374.0760 59.27453 193.8465 75.92359 180.2295       96.32166 
1 1 1 2   5  32 o 232.5219 68.84988 12.41675       6.657004      -2.363484      10.72679      21.67488       8.489666  165.9980 75.59559 304.8543 72.72543 -138.8563      104.8984 
1 1 1 2   5  33 o 108.6377 51.55783 -5.693713      5.867645      -7.556138      8.452784      -3.961637      8.151616  129.2084 61.48350 137.9258 63.92850 -8.717331      88.69653 
1 1 1 2   6  0  o 110.7593 27.54850 2.486750       1.180049      3.337589       1.634938      1.561486       1.704946  128.2713 32.71690 97.69929 35.18340 30.57197       48.04443 
1 1 1 2   6  1  o 719.7792 10.91793 100.6660       3.051882      98.08262       4.250596      103.4148       4.384546  710.2510 15.41026 729.2974 15.48075 -19.04645      21.84330 
1 1 1 2   6  2  o 180.6368 20.50080 6.431240       1.412682      3.959966       3.138916      7.058931       1.581949  145.2686 47.92795 189.1649 21.94143 -43.89636      52.71162 
1 1 1 2   6  3  o 711.6451 16.89547 98.47624       4.669408      108.6806       6.824748      89.49541       6.402536  747.1187 23.52172 677.9123 24.31927 69.20636       33.83339 
1 1 1 2   6  4  o 265.9809 15.55172 13.79932       1.599417      12.89366       1.779855      17.59889       3.645616  256.8712 17.95484 298.6833 31.92352 -41.81213      36.62632 
1 1 1 2   6  5  o 1037.630 13.91760 209.2433       5.608347      207.7621       6.667263      212.8275       10.37123  1033.765 16.60725 1045.430 25.54507 -11.66504      30.46886 
1 1 1 2   6  6  o 790.7585 13.48689 121.5136       4.141750      122.0690       4.922683      120.1675       7.663169  792.4381 15.99590 785.6105 25.11731 6.827576       29.77831 
1 1 1 2   6  7  o 955.6857 11.92201 177.4589       4.424789      171.7352       6.101202      183.8096       6.426670  939.8652 16.71560 972.3224 17.01954 -32.45728      23.85531 
1 1 1 2   6  8  o 1167.883 12.74146 265.0495       5.778920      268.4694       8.237566      261.7354       8.109200  1174.943 18.05319 1160.120 17.99895 14.82361       25.49274 
1 1 1 2   6  9  f 966.4751 12.46582 181.5218       4.678854      175.6705       6.481617      187.8883       6.761022  950.3945 17.56109 982.8751 17.71275 -32.48059      24.94260 
1 1 1 2   6  10 o 548.8013 15.11373 58.56128       3.221179      54.81662       3.983337      65.63734       5.475664  530.7393 19.32582 580.3969 24.29315 -49.65753      31.04262 
1 1 1 2   6  11 o 224.4199 28.57980 9.990343       2.434330      6.385606       3.006831      16.84782       4.147196  176.7444 43.98248 290.8112 37.60168 -114.0668      57.86489 
1 1 1 2   6  12 o 964.6331 13.41993 180.9541       5.027363      177.4565       7.015659      184.6458       7.207761  954.5638 18.92498 973.6875 19.06131 -19.12372      26.86054 
1 1 1 2   6  13 o 923.6178 13.56031 165.9451       4.863959      164.5962       6.835435      167.3286       6.922750  919.0349 19.15165 926.6167 19.23759 -7.581848      27.14536 
1 1 1 2   6  14 o 105.8747 41.90934 1.238691       2.557222      -2.068596      3.627252      4.506905       3.605761  97.16454 44.13677 153.9583 51.39543 -56.79377      67.74618 
1 1 1 2   6  15 o 624.3155 17.89139 75.95728       4.337865      79.38199       7.422692      74.18097       5.345744  636.1583 30.04473 616.3546 22.33312 19.80371       37.43600 
1 1 1 2   6  16 o 380.8419 22.66518 28.41566       3.337065      30.33751       4.676989      26.42262       4.762828  392.0929 30.96696 365.1347 33.97794 26.95822       45.97230 
1 1 1 2   6  17 o 416.7056 21.97319 33.96230       3.543336      40.72491       5.026531      27.28244       4.995680  455.3584 28.56885 371.1189 35.07792 84.23947       45.23980 
1 1 1 2   6  18 o 348.1525 31.03518 23.90076       4.152158      26.29715       7.358006      22.78111       5.029465  360.0639 54.30863 338.3184 38.99340 21.74551       66.85740 
1 1 1 2   6  19 o 265.3065 42.86580 14.17751       4.265995      22.65940       7.789537      10.54365       5.098577  332.0940 62.69628 226.1811 57.82244 105.9129       85.28926 
1 1 1 2   6  20 o 501.5103 22.02926 48.98100       4.290498      44.80634       5.847015      53.85125       6.315375  477.8872 31.68481 524.1766 31.16406 -46.28940      44.44239 
1 1 1 2   6  21 o 1068.557 16.51266 222.0517       6.852401      221.4539       9.532654      222.6910       9.857001  1066.354 23.01890 1069.228 23.73813 -2.874268      33.06612 
1 1 1 2   6  22 o 1302.507 19.47239 330.1464       9.849795      330.2462       11.90814      329.9302       17.52682  1302.047 23.54991 1298.991 34.74313 3.056030       41.97242 
1 1 1 2   6  23 o 1091.500 20.03604 231.9508       8.493048      235.7212       10.30166      223.9500       15.00652  1099.682 24.12194 1069.328 36.13606 30.35376       43.44748 
1 1 1 2   6  24 o 686.8528 24.67855 92.02931       6.582810      98.77927       7.958349      77.40576       11.71382  711.0015 28.82203 623.9884 48.72501 87.01306       56.61127 
1 1 1 2   6  25 o 484.0129 29.42062 45.98135       5.503918      59.26727       7.716978      32.22568       7.852214  548.2859 36.44966 399.8593 51.78202 148.4267       63.32421 
1 1 1 2   6  26 o 802.3073 29.57286 125.9895       9.214295      125.9895       9.214295      0.000000       0.000000  802.3073 29.57286 ?        ?        0.000000       29.57286 
1 1 1 2   6  27 o 371.6831 39.59172 27.57079       5.626884      32.18678       7.572062      21.87830       8.408776  398.9368 49.97083 321.8511 69.32218 77.08566       85.45554 
1 1 1 2   6  28 o 434.3427 40.05199 37.72566       6.679818      37.42374       7.743187      38.60405       13.20731  430.2355 47.11333 420.4455 83.82761 9.789978       96.15993 
1 1 1 2   6  29 o 251.0513 59.26943 13.44086       5.685920      22.03308       7.684607      3.046118       8.452318  321.1786 63.85808 179.3048 74.25584 141.8738       97.93765 
1 1 1 2   6  30 o 471.2380 33.22079 44.31702       6.040719      54.85363       8.243659      32.09863       8.877213  520.9405 41.08115 388.2377 60.87968 132.7028       73.44383 
1 1 1 2   6  31 o 584.1254 33.24355 68.36121       7.510034      75.56448       12.18945      63.95396       9.534607  600.5744 52.79873 558.2852 44.34144 42.28925       68.94831 
1 1 1 2   6  32 o 440.6888 42.75066 40.24722       7.224454      62.25476       11.88324      27.34392       9.099119  535.5724 58.06312 344.4390 70.40038 191.1334       91.25535 
1 1 1 2   6  33 o 464.8040 36.45110 44.30313       6.526986      57.64925       9.652190      33.05849       8.859744  520.5519 48.29575 382.9553 61.66604 137.5966       78.32739 
1 1 1 2   7  0  o 200.3600 18.30530 7.872525       1.408613      7.717865       1.992776      8.026968       1.991385  197.2500 26.70064 201.3249 26.08315 -4.074860      37.32633 
1 1 1 2   7  1  o 1090.649 12.13856 231.1368       5.141385      225.9163       7.104189      236.8782       7.450175  1077.904 16.97096 1103.709 17.38137 -25.80469      24.29249 
1 1 1 2   7  2  o 879.9930 11.44318 150.4584       3.910697      147.1543       5.428696      154.0227       5.638383  870.0242 16.06705 890.0806 16.31162 -20.05646      22.89583 
1 1 1 2   7  3  o 718.0712 13.36781 100.2026       3.727826      101.8592       6.862306      99.50913       4.440094  723.3084 24.42973 715.4596 15.98009 7.848816       29.19203 
1 1 1 2   7  4  o 233.5519 17.85699 10.66817       1.607371      10.73190       1.777601      10.38239       3.764044  234.0667 19.73960 226.4309 44.39141 7.635727       48.58239 
1 1 1 2   7  5  o 1278.350 15.05705 317.6302       7.475113      315.6575       8.920865      322.2802       13.69648  1274.105 18.02909 1286.220 27.41989 -12.11584      32.81613 
1 1 1 2   7  6  o 880.5090 13.88628 150.6726       4.748405      153.9057       5.694686      143.2958       8.601868  889.7516 16.48060 857.7899 25.82164 31.96173       30.63278 
1 1 1 2   7  7  o 806.8273 16.67057 126.5680       5.223468      0.000000       0.000000      126.5680       5.223468  ?        ?        806.8273 16.67057 0.000000       16.67057 
1 1 1 2   7  8  o 928.0927 12.20943 167.3829       4.400630      168.5163       6.232581      166.2562       6.214320  930.8777 17.24040 924.6088 17.30643 6.268860       24.42834 
1 1 1 2   7  9  o 1027.652 14.27962 205.3022       5.698898      207.5706       7.172274      201.4176       9.386033  1032.974 17.87884 1016.842 23.76844 16.13281       29.74209 
1 1 1 2   7  10 o 1064.550 14.67427 220.3620       6.066674      224.8763       7.666671      212.8006       9.922238  1074.974 18.36457 1044.832 24.45317 30.14233       30.58129 
1 1 1 2   7  11 o 705.7774 13.27641 96.85529       3.638954      94.30578       5.038717      99.63468       5.260992  695.9676 18.64245 715.3303 18.93795 -19.36267      26.57418 
1 1 1 2   7  12 o 599.4641 14.38253 69.91179       3.348315      72.20731       4.742039      67.62940       4.728457  608.6795 20.06081 589.0015 20.67164 19.67798       28.80543 
1 1 1 2   7  13 o 141.1475 42.40444 3.983341       2.511672      3.362197       3.532868      4.618155       3.571529  140.6543 50.64677 155.1319 51.12136 -14.47763      71.96172 
1 1 1 2   7  14 o 712.2424 16.60468 98.80968       4.592894      85.14143       7.338163      107.6125       5.889004  659.1313 28.66734 742.7040 20.41729 -83.57269      35.19492 
1 1 1 2   7  15 f 496.1588 18.03738 47.97308       3.475539      45.35181       4.957160      50.50733       4.874198  480.6730 26.66006 508.3005 24.69191 -27.62753      36.33798 
1 1 1 2   7  16 o 367.5016 23.14909 26.46988       3.286972      22.53943       4.564432      30.70376       4.737348  336.7822 35.43006 394.5173 31.17409 -57.73508      47.19230 
1 1 1 2   7  17 o 840.9154 18.27785 137.7119       5.969051      129.7546       10.37146      141.6531       7.299064  813.6221 32.82382 852.2973 22.05200 -38.67523      39.54357 
1 1 1 2   7  18 o 577.4086 18.79214 64.90904       4.213931      64.28737       5.924665      65.54551       5.994750  573.8837 26.58348 579.4658 26.63884 -5.582092      37.63388 
1 1 1 2   7  19 o 589.6401 23.01762 67.74445       5.270786      66.24749       9.129497      68.49287       6.455287  579.5588 40.82304 592.3914 28.05943 -12.83258      49.53637 
1 1 1 2   7  20 o 939.2241 16.36908 171.5575       5.970648      168.8774       8.292940      174.4419       8.603143  931.1647 22.93264 946.3210 23.40942 -15.15631      32.77052 
1 1 1 2   7  21 o 513.8777 22.92395 51.42646       4.574853      49.82159       6.219566      53.31839       6.752934  504.1112 31.93413 521.3212 33.53276 -17.21002      46.30589 
1 1 1 2   7  22 o 386.9722 34.06117 29.50012       5.066627      27.19002       6.098917      34.64515       9.101871  369.7041 43.29869 414.4564 58.14910 -44.75223      72.49893 
1 1 1 2   7  23 o 722.3874 23.36574 101.7134       6.555074      98.49947       7.793181      109.4874       12.12031  710.2643 28.25314 745.2050 42.05211 -34.94061      50.66182 
1 1 1 2   7  24 o 166.2070 59.19288 4.799452       4.813155      6.201473       6.601480      3.208321       7.032617  190.6782 69.14740 172.6816 69.12631 17.99660       97.77428 
1 1 1 2   7  25 o 1011.907 18.93321 199.4319       7.440342      196.6158       10.12515      202.7375       10.97002  1003.398 25.98367 1018.496 27.73449 -15.09790      38.00465 
1 1 1 2   7  26 o 1264.308 18.67171 311.4138       9.167796      315.2696       12.62181      307.1079       13.33827  1270.274 25.58565 1253.153 27.40738 17.12048       37.49386 
1 1 1 2   7  27 o 220.9826 66.89234 10.09737       6.232891      11.51073       7.243055      6.063878       12.23589  235.3796 72.28383 223.6453 90.59550 11.73431       115.8986 
1 1 1 2   7  28 o 301.4486 50.64891 18.73640       5.719131      18.66590       7.510281      18.83371       8.823683  295.3545 67.01372 293.8567 76.55312 1.497742       101.7409 
1 1 1 2   7  29 o 454.9912 34.45876 41.26953       6.043607      45.77087       8.199315      35.91470       8.942919  475.1024 44.97408 415.0177 56.99064 60.08472       72.59890 
1 1 1 2   7  30 o 404.0565 40.67458 33.14583       6.295770      37.35503       8.794612      28.72139       9.016668  421.9931 54.96893 363.1743 66.37571 58.81879       86.18189 
1 1 1 2   7  31 o 273.4402 64.24843 16.69658       6.706974      13.63166       10.66011      18.70477       8.628873  244.2061 87.97237 283.0738 76.62012 -38.86765      116.6610 
1 1 1 2   7  32 o 493.3838 33.73325 49.28852       6.424788      60.72954       9.317000      38.91567       8.871411  539.6774 44.86089 423.9166 55.19600 115.7608       71.12733 
1 1 1 2   7  33 o 188.5342 65.71484 7.873772       5.908176      11.96540       8.670206      4.326738       8.072612  222.7711 79.43399 173.1987 72.21679 49.57233       107.3547 
1 1 1 2   8  0  o 1406.380 13.62970 384.3797       7.444179      380.3388       10.38053      388.6581       10.68123  1398.413 19.11420 1413.582 19.45683 -15.16980      27.27491 
1 1 1 2   8  1  o 683.1561 11.56719 90.67614       3.068851      101.2821       4.525573      81.64737       4.175548  721.8033 16.14458 648.0518 16.59112 73.75153       23.14979 
1 1 1 2   8  2  o 845.7618 11.63333 138.9793       3.821028      135.6297       5.279705      142.6634       5.536969  835.2717 16.27623 856.6339 16.64366 -21.36218      23.27933 
1 1 1 2   8  3  o 1310.729 13.15005 333.8486       6.693728      324.2079       9.159134      344.9008       9.806734  1291.215 18.26535 1331.709 18.96213 -40.49426      26.32841 
1 1 1 2   8  4  o 967.0413 26.00175 182.1264       9.765073      0.000000       0.000000      182.1264       9.765073  ?        ?        967.0413 26.00175 0.000000       26.00175 
1 1 1 2   8  5  f 1835.743 18.35472 655.3644       13.08542      648.6228       15.62592      671.1901       23.94123  1825.663 22.03926 1854.562 33.24123 -28.89856      39.88369 
1 1 1 2   8  6  o 1607.017 14.51947 501.9710       9.061487      492.1356       12.50466      512.8467       13.14939  1590.437 20.24546 1623.460 20.85624 -33.02368      29.06650 
1 1 1 2   8  7  o 444.8773 13.15207 38.46507       2.272282      34.52188       3.183121      42.56242       3.244750  421.2343 19.45814 467.7959 17.86063 -46.56158      26.41253 
1 1 1 2   8  8  o 105.1791 36.87860 1.910426       1.862010      2.356139       2.384640      1.214154       2.980468  117.6879 41.69099 112.4230 45.00245 5.264893       61.34622 
1 1 1 2   8  9  o 675.9490 14.20130 88.83516       3.727949      90.31065       4.725320      86.40297       6.066813  681.2846 17.85972 665.8914 23.46006 15.39325       29.48464 
1 1 1 2   8  10 o 1331.315 13.90026 344.6539       7.186734      363.0398       10.65669      329.3168       9.733133  1365.295 20.09870 1300.495 19.27151 64.79968       27.84509 
1 1 1 2   8  11 o 597.1347 14.11958 69.35950       3.274328      71.97874       4.607897      66.68800       4.653639  607.8188 19.52094 584.9546 20.48531 22.86420       28.29691 
1 1 1 2   8  12 o 626.9160 14.46409 76.47860       3.521506      74.28294       4.906777      78.81071       5.056941  617.1941 20.47136 635.7242 20.48288 -18.53015      28.95902 
1 1 1 2   8  13 o 727.4228 16.06038 103.0417       4.537020      91.39803       7.220397      110.6386       5.832234  683.2707 27.21074 753.1796 19.93923 -69.90887      33.73421 
1 1 1 2   8  14 o 879.1220 15.99934 150.5022       5.462347      159.3110       9.309670      145.8775       6.745503  902.2138 26.57032 864.7963 20.08503 37.41748       33.30751 
1 1 1 2   8  15 o 379.7172 26.36671 28.33569       3.864059      29.50315       7.234928      27.86978       4.570518  381.8033 49.99522 375.5808 31.62974 6.222534       59.16048 
1 1 1 2   8  16 o 251.7310 40.75290 12.79912       3.847861      8.820565       7.064966      14.47701       4.588050  213.4529 71.93837 266.8642 45.92653 -53.41129      85.34855 
1 1 1 2   8  17 o 422.2125 22.60760 34.85545       3.693470      37.50788       5.189116      32.13182       5.258283  436.7777 30.78890 403.5454 33.86554 33.23230       45.76933 
1 1 1 2   8  18 o 815.2098 16.36093 129.2845       5.179708      135.1787       7.318254      123.3678       7.332191  832.8783 22.62549 795.5198 23.73312 37.35852       32.78984 
1 1 1 2   8  19 o 550.8396 23.91193 59.12489       5.115261      56.83113       8.609294      60.37647       6.359496  536.5832 41.64063 555.3474 29.59370 -18.76422      51.08551 
1 1 1 2   8  20 o 141.5228 64.42159 -4.593208      7.779322      -4.593208      7.779322      0.000000       0.000000  141.5228 64.42159 ?        ?        0.000000       64.42159 
1 1 1 2   8  21 o 569.8203 24.62877 63.26413       5.450150      63.92057       6.456561      61.63691       10.16544  571.6411 29.18091 557.9554 47.36102 13.68567       55.62906 
1 1 1 2   8  22 f 260.1020 45.25875 13.67652       4.405622      13.23085       5.999754      14.19800       6.490073  253.1012 61.61775 261.9431 64.27962 -8.841980      89.04278 
1 1 1 2   8  23 f 602.2975 25.50975 70.77341       5.966851      75.79103       7.195326      59.72514       10.67698  622.7545 29.75128 547.2678 50.81671 75.48669       58.88528 
1 1 1 2   8  24 f 285.0037 45.34562 16.40925       4.850814      19.10167       6.479555      12.97624       7.316640  305.1418 56.76760 250.1131 71.65260 55.02867       91.41475 
1 1 1 2   8  25 o 1173.378 18.32386 268.1278       8.349928      287.8495       11.99331      249.5761       11.63213  1214.125 25.43592 1130.260 26.50044 83.86548       36.73227 
1 1 1 2   8  26 o 156.5775 64.10511 2.040593       6.205934      4.229527       7.238945      -4.029353      12.05456  180.1681 70.76735 182.4336 81.88299 -2.265518      108.2259 
1 1 1 2   8  27 o 497.0869 36.03400 48.98833       6.908979      50.84330       8.081009      43.94840       13.32017  504.7587 41.59472 453.8122 78.41582 50.94653       88.76464 
1 1 1 2   8  28 o 174.8204 63.06668 5.503751       5.481098      6.572247       7.145306      3.976113       8.543674  193.3601 71.64066 185.9593 75.56950 7.400787       104.1304 
1 1 1 2   8  29 o 399.7292 37.94150 32.13079       5.819321      38.37499       7.585866      23.20135       9.071491  433.9605 45.69875 323.9603 73.75755 110.0002       86.76723 
1 1 1 2   8  30 o 358.2432 51.08808 26.85873       6.906300      24.97179       10.58091      28.25934       9.115965  327.2940 83.09544 358.3067 67.99924 -31.01273      107.3720 
1 1 1 2   8  31 o 130.1841 58.00673 -1.134199      5.932851      3.519786       8.194566      -6.261057      8.600806  174.1427 72.69799 136.7698 64.13930 37.37289       96.94765 
1 1 1 2   8  32 o 134.3102 58.98980 -0.4639601E-01 5.925652      -9.838954      8.859583      7.880262       7.970953  127.2073 61.17284 195.9863 74.99276 -68.77897      96.77825 
1 1 1 2   9  0  o 638.5469 12.25849 79.22743       3.039889      77.31062       4.217639      81.29975       4.385369  630.5687 17.22301 646.6203 17.46340 -16.05157      24.52758 
1 1 1 2   9  1  o 1191.255 12.89994 275.7593       5.967881      266.9304       8.205215      285.6758       8.695856  1171.613 18.03340 1212.011 18.47472 -40.39734      25.81703 
1 1 1 2   9  2  o 1163.230 12.80636 262.9362       5.785214      266.6319       8.188025      259.2523       8.175049  1170.954 18.00575 1154.615 18.23162 16.33923       25.62419 
1 1 1 2   9  3  o 2217.356 17.93907 956.1183       15.44768      954.5620       21.77619      957.6948       21.91714  2213.924 25.32743 2217.523 25.45000 -3.598389      35.90517 
1 1 1 2   9  4  o 875.3668 12.06465 148.8950       4.101407      145.3290       5.622665      152.9500       5.995831  864.5423 16.74665 886.8730 17.40844 -22.33075      24.15583 
1 1 1 2   9  5  o 940.0709 12.15630 171.7282       4.438029      172.8161       5.001753      167.7019       9.622728  942.9519 13.65855 927.6685 26.71022 15.28345       29.99987 
1 1 1 2   9  6  o 1086.036 12.43853 229.2172       5.246159      221.1778       7.209486      238.2650       7.648325  1066.397 17.40833 1106.783 17.79409 -40.38586      24.89337 
1 1 1 2   9  7  o 1218.547 14.68069 288.6892       6.947308      294.3512       8.882036      279.7661       11.15033  1229.969 18.59475 1198.309 23.96021 31.65967       30.32914 
1 1 1 2   9  8  o 498.8216 14.94973 48.38580       2.896053      49.18425       3.767211      47.23213       4.528292  502.6781 19.29754 492.3010 23.68513 10.37704       30.55127 
1 1 1 2   9  9  o 1086.083 13.01410 229.3357       5.489150      220.4290       7.538628      239.3867       8.008304  1064.138 18.24175 1108.900 18.59602 -44.76245      26.04944 
1 1 1 2   9  10 o 593.6418 13.87214 68.54507       3.198129      74.58099       4.585870      62.82996       4.462336  618.7648 19.08395 567.8182 20.23601 50.94659       27.81534 
1 1 1 2   9  11 o 651.2114 13.84389 82.50310       3.501128      84.21017       4.895756      80.71624       5.008869  657.3387 19.17797 643.4490 20.04461 13.88977       27.74132 
1 1 1 2   9  12 o 715.9478 15.78372 99.80277       4.388525      99.21233       7.088475      100.1697       5.588296  712.2451 25.62686 716.6610 20.07880 -4.415894      32.55601 
1 1 1 2   9  13 o 122.8646 45.40018 2.386075       2.865766      -3.826572      4.488628      6.661011       3.723404  101.5027 47.18111 180.1223 50.94840 -78.61961      69.43916 
1 1 1 2   9  14 o 758.9214 17.40108 112.2066       5.128624      123.4555       9.557184      107.6573       6.077859  793.2250 31.02456 742.8098 21.06906 50.41522       37.50237 
1 1 1 2   9  15 o 457.8659 19.69249 40.86379       3.501604      38.25989       4.884259      43.61737       5.022673  441.1885 28.66204 471.3913 27.55625 -30.20285      39.76002 
1 1 1 2   9  16 o 892.8483 15.11325 155.0978       5.240388      157.1048       7.385898      153.0632       7.436416  897.7581 21.18439 886.0659 21.61074 11.69226       30.26223 
1 1 1 2   9  17 o 519.2370 19.60669 52.50037       3.953647      56.36456       5.544639      48.50330       5.639161  537.3698 26.56881 497.3597 29.32525 40.01013       39.57110 
1 1 1 2   9  18 o 846.3160 16.28981 139.3206       5.353978      142.9156       7.581282      135.7438       7.562089  856.4559 22.79343 834.6225 23.33048 21.83337       32.61674 
1 1 1 2   9  19 o 1002.874 23.70137 195.9327       9.230979      198.0565       13.02237      193.7877       13.08702  1006.698 33.30909 995.6865 33.84467 11.01141       47.48639 
1 1 1 2   9  20 o 652.8313 23.78147 83.01571       6.029311      98.04491       10.41778      75.44617       7.393358  706.7377 38.09747 621.7175 30.62109 85.02026       48.87810 
1 1 1 2   9  21 o 444.2411 26.26922 38.60824       4.511896      28.64300       6.133949      50.35614       6.660036  379.8167 42.30389 506.4116 34.06257 -126.5950      54.31277 
1 1 1 2   9  22 o 880.8788 18.23090 151.0076       6.236663      142.5762       8.373796      161.5106       9.346027  855.0645 25.21712 909.8786 26.44939 -54.81415      36.54413 
1 1 1 2   9  23 o 517.4168 29.25789 52.48764       5.855021      52.27571       7.068569      52.95088       10.45057  515.1970 35.54637 514.1516 53.10333 1.045410       63.90233 
1 1 1 2   9  24 o 1260.823 20.34015 309.7347       9.959469      305.5508       11.85990      319.7428       18.34298  1251.341 24.40493 1276.010 37.01587 -24.66943      44.33706 
1 1 1 2   9  25 o 415.0537 34.38829 34.03392       5.493045      38.56871       7.310750      28.15468       8.324229  439.9156 43.35584 370.5512 59.88802 69.36435       73.93446 
1 1 1 2   9  26 o 503.0967 34.95053 50.01782       6.786247      49.02668       7.886065      52.84644       13.32234  496.3633 41.28486 504.7106 69.84045 -8.347260      81.13031 
1 1 1 2   9  27 o 202.6344 62.99325 8.423066       5.481781      6.820611       7.217144      10.60817       8.427687  196.6030 72.14623 230.0539 78.56544 -33.45090      106.6659 
1 1 1 2   9  28 o 405.3997 37.82891 32.92725       5.886930      36.59958       7.777643      28.00121       9.007952  423.7321 48.11699 362.1680 66.49586 61.56412       82.07889 
1 1 1 2   9  29 o 185.1955 67.82250 6.349608       6.373405      2.205755       9.508452      9.730271       8.588328  181.2395 77.12082 219.6338 78.97898 -38.39429      110.3870 
1 1 1 2   9  30 o 181.2862 68.49509 5.939426       6.596874      6.938838       10.16077      5.211172       8.673530  205.9689 82.86393 188.6004 76.31901 17.36850       112.6544 
1 1 1 2   9  31 o 543.5198 31.90678 59.35964       6.705296      69.04037       9.408991      49.36942       9.558209  579.2531 42.11422 482.4252 51.83009 96.82794       66.78297 
1 1 1 2   9  32 o 255.6404 61.77608 14.94823       6.064789      21.72272       8.790984      8.795676       8.377745  299.1411 75.62923 202.3449 77.01152 96.79626       107.9377 
1 1 1 2   10 0  o 497.0950 13.71227 48.02669       2.647139      48.70205       3.725542      47.33806       3.761963  500.3549 19.17270 493.2763 19.63795 7.078583       27.44525 
1 1 1 2   10 1  o 699.5353 12.40683 95.09351       3.370532      103.4429       4.885794      87.51162       4.655821  729.3383 17.24956 670.7920 17.87230 58.54633       24.83881 
1 1 1 2   10 2  o 931.4901 12.34209 168.6121       4.464726      170.8048       6.297621      166.3964       6.330662  937.1792 17.30318 924.9799 17.62337 12.19934       24.69783 
1 1 1 2   10 3  o 1025.640 12.58894 204.4309       5.014324      204.6343       7.034317      204.2207       7.149741  1025.742 17.65858 1024.675 17.96702 1.066528       25.19205 
1 1 1 2   10 4  o 1257.670 13.36828 307.4338       6.529351      303.8590       9.075713      311.2692       9.400651  1249.758 18.69937 1264.848 19.13778 -15.09033      26.75670 
1 1 1 2   10 5  o 505.6592 12.92778 49.69713       2.538691      50.97912       2.795534      43.66646       6.063243  512.0949 14.05680 471.5555 33.32341 40.53937       36.16688 
1 1 1 2   10 6  o 116.5304 36.44217 2.633830       1.831533      2.633830       1.831533      0.000000       0.000000  116.5304 36.44217 ?        ?        0.000000       36.44217 
1 1 1 2   10 7  o 1149.778 14.53731 257.0707       6.491216      253.2405       8.057454      264.1532       10.95679  1140.715 18.18832 1164.016 24.23798 -23.30066      30.30338 
1 1 1 2   10 8  o 1161.522 13.09056 262.3181       5.904916      258.9020       8.303061      265.8138       8.399398  1153.166 18.54037 1168.463 18.50995 -15.29663      26.19854 
1 1 1 2   10 9  o 442.5522 15.01390 38.10601       2.580394      41.38970       3.732296      35.09921       3.571471  460.7993 20.85625 423.7152 21.77788 37.08408       30.15393 
1 1 1 2   10 10 o 537.5419 14.49230 56.22542       3.025363      60.32570       4.330938      52.31784       4.227940  556.2657 20.04803 517.9285 21.01992 38.33716       29.04756 
1 1 1 2   10 11 o 1566.041 17.19054 477.7487       10.45491      488.0285       17.95443      472.4748       12.86012  1577.986 29.29817 1556.044 21.28114 21.94128       36.21146 
1 1 1 2   10 12 o 815.3748 19.73779 129.6632       6.250056      0.000000       0.000000      129.6632       6.250056  ?        ?        815.3748 19.73779 0.000000       19.73779 
1 1 1 2   10 13 o 499.8676 17.62582 48.68414       3.421624      43.90811       4.726365      53.94379       4.959891  473.1058 25.82176 525.3718 24.30958 -52.26596      35.46433 
1 1 1 2   10 14 o 627.7300 16.17834 76.71791       3.943981      84.21792       5.529185      68.94917       5.627375  657.0070 21.67021 594.0970 24.39049 62.90997       32.62659 
1 1 1 2   10 15 o 467.8165 19.76704 42.64537       3.591247      41.67236       4.895445      43.77913       5.284410  460.8954 27.47511 472.1811 28.95757 -11.28568      39.91770 
1 1 1 2   10 16 f 843.2070 15.40972 138.3135       5.046113      140.9641       7.110410      135.6240       7.162436  850.5054 21.52730 834.1583 22.10978 16.34711       30.85882 
1 1 1 2   10 17 o 681.4882 17.49188 90.36830       4.629380      99.64832       6.579426      81.26936       6.514914  715.0059 23.69465 645.4619 25.99023 69.54407       35.16999 
1 1 1 2   10 18 o 691.1498 20.48536 92.99181       5.498493      96.97375       6.663250      84.49316       9.734512  705.4261 24.32241 655.6318 38.39945 49.79425       45.45435 
1 1 1 2   10 19 o 679.5807 18.39358 89.84580       4.854398      89.88567       6.706365      89.80192       7.035789  679.1499 25.42691 678.7091 26.69323 0.4407959      36.86538 
1 1 1 2   10 20 o 1156.989 19.07965 260.4617       8.572896      261.4148       14.87248      259.9874       10.49123  1156.732 33.10722 1155.343 23.38232 1.388428       40.53173 
1 1 1 2   10 21 o 609.3021 21.68132 72.29890       5.130342      64.60886       6.922751      81.66773       7.641124  574.2660 31.15775 646.6646 30.42637 -72.39862      43.54962 
1 1 1 2   10 22 o 182.6999 57.03526 6.600296       4.488555      5.276987       6.132071      8.127689       6.587974  180.3552 66.45385 206.6581 69.46835 -26.30292      96.13515 
1 1 1 2   10 23 o 744.3610 20.77346 107.9572       6.005102      113.1147       8.232488      102.0926       8.778806  760.8965 27.85977 722.2953 31.29627 38.60114       41.90016 
1 1 1 2   10 24 o 375.0977 41.52637 28.04491       5.947689      41.00131       7.223886      0.7786469      10.47952  454.4079 41.38903 189.1042 80.72700 265.3036       90.71880 
1 1 1 2   10 25 o 249.4963 63.17049 13.02208       6.126842      13.64142       6.936642      10.82439       13.06675  254.9257 68.57024 253.6883 96.26743 1.237350       118.1918 
1 1 1 2   10 26 o 476.8922 32.13927 44.88684       5.917585      55.55218       7.900208      31.25405       8.931894  528.9300 38.72956 388.7241 61.18894 140.2059       72.41592 
1 1 1 2   10 27 o 251.0715 59.02822 13.33404       5.658614      6.563408       7.321060      23.38107       8.918223  194.7348 72.44369 329.4118 71.74428 -134.6770      101.9575 
1 1 1 2   10 28 o 233.8808 62.24913 11.75313       5.753728      10.50265       7.438150      13.61615       9.078948  223.6814 73.77784 250.4653 81.45699 -26.78397      109.9018 
1 1 1 2   10 29 o 312.5327 59.04507 20.93140       6.903865      23.72127       10.38165      18.71940       9.244135  320.5299 82.81124 286.0360 80.05756 34.49396       115.1821 
1 1 1 2   10 30 o 815.9462 24.10840 131.3047       7.639375      141.0105       10.41424      119.9980       11.24041  840.7065 31.89741 771.6044 37.51107 69.10205       49.23947 
1 1 1 2   10 31 o 441.7027 37.78971 39.91931       6.419932      53.34979       9.154917      26.92438       9.005243  504.0867 47.31884 341.3788 70.26746 162.7079       84.71474 
1 1 1 2   10 32 o 207.7589 65.60654 9.970566       5.921223      9.427860       8.739315      10.43112       8.050749  206.4064 78.63230 212.0131 76.44135 -5.606750      109.6646 
1 1 1 2   11 0  o 424.5066 15.38411 35.03924       2.536208      33.00729       3.514981      37.24602       3.663080  411.1294 22.09592 437.3849 21.56525 -26.25552      30.87539 
1 1 1 2   11 1  o 352.0445 16.67898 24.10388       2.280316      25.15217       3.158951      22.96331       3.295061  358.6518 22.79833 342.3764 24.95352 16.27539       33.80003 
1 1 1 2   11 2  o 301.4560 17.84499 17.74064       2.079841      15.12825       2.802579      20.94310       3.102988  277.3240 26.33819 326.9151 24.62166 -49.59109      36.05450 
1 1 1 2   11 3  f 515.4282 13.70143 51.64512       2.742598      56.03926       3.874608      47.23273       3.882643  536.6509 18.59122 492.5836 20.29642 44.06729       27.52414 
1 1 1 2   11 4  o 1412.723 14.15137 388.0306       7.763964      406.7666       11.45718      372.1211       10.55770  1445.433 20.41041 1382.640 19.66221 62.79395       28.34056 
1 1 1 2   11 5  o 113.4165 36.65263 2.445949       1.839963      2.445949       1.839963      0.000000       0.000000  113.4165 36.65263 ?        ?        0.000000       36.65263 
1 1 1 2   11 6  o 202.0616 27.45226 8.116479       2.098448      8.116479       2.098448      0.000000       0.000000  202.0616 27.45226 ?        ?        0.000000       27.45226 
1 1 1 2   11 7  o 1004.399 15.09142 196.2602       5.886600      194.2323       6.921348      201.5622       11.19176  998.8214 17.84329 1015.445 28.38009 -16.62366      33.52332 
1 1 1 2   11 8  o 342.1333 16.96683 22.79012       2.254364      21.51380       3.291064      23.91840       3.094327  330.8506 25.81834 349.3755 22.93315 -18.52490      34.53283 
1 1 1 2   11 9  o 674.3392 13.13498 88.45498       3.439821      85.95801       4.906998      90.86756       4.823364  664.1096 19.02603 682.9208 18.18661 -18.81122      26.32000 
1 1 1 2   11 10 o 603.9927 15.72352 71.02946       3.688157      68.03055       6.035182      72.81697       4.659434  589.6624 26.35475 611.0831 19.63383 -21.42065      32.86427 
1 1 1 2   11 11 f 577.2451 21.28004 65.03263       4.770465      0.000000       0.000000      65.03263       4.770465  ?        ?        577.2451 21.28004 0.000000       21.28004 
1 1 1 2   11 12 o 476.9892 16.99065 44.31945       3.147361      39.26297       4.288774      50.22080       4.633241  447.4855 24.77547 507.0164 23.53070 -59.53088      34.16896 
1 1 1 2   11 13 o 884.6569 20.45996 152.6211       7.029227      0.000000       0.000000      152.6211       7.029227  ?        ?        884.6569 20.45996 0.000000       20.45996 
1 1 1 2   11 14 o 928.8959 14.57846 167.8712       5.259042      165.3238       7.308041      170.6073       7.573900  920.9590 20.43303 935.4866 20.84750 -14.52759      29.19121 
1 1 1 2   11 15 o 211.0349 40.64866 9.048710       3.210565      9.845221       4.330706      8.076776       4.783894  218.5684 51.81016 199.2397 58.18948 19.32869       77.91219 
1 1 1 2   11 16 o 372.9315 28.79875 27.32196       4.138597      25.41355       4.885815      32.16941       7.786765  358.4686 35.56548 400.2735 51.27082 -41.80493      62.39872 
1 1 1 2   11 17 o 805.2803 16.60446 126.1370       5.192778      133.2549       7.201647      118.4285       7.494498  827.1018 22.42048 779.4637 24.75818 47.63806       33.40128 
1 1 1 2   11 18 o 501.2092 21.81262 48.91082       4.245754      53.96452       5.834782      43.22355       6.189734  525.1764 28.71706 469.0266 34.21790 56.14978       44.67141 
1 1 1 2   11 19 o 567.2466 21.03011 62.63295       4.632776      65.74802       6.306174      58.98057       6.828414  580.6375 27.96617 548.6331 32.18961 32.00433       42.64127 
1 1 1 2   11 20 o 335.3141 39.74332 22.33457       5.074671      19.89208       8.545520      23.66511       6.307205  309.3903 72.40485 343.4662 48.64521 -34.07590      87.22855 
1 1 1 2   11 21 o 272.9823 50.09546 15.15599       5.115098      20.53938       8.691131      12.30309       6.326914  313.7284 72.74794 244.0014 65.42641 69.72697       97.84108 
1 1 1 2   11 22 o 247.4131 69.16715 12.68211       6.904385      0.000000       0.000000      12.68211       6.904385  ?        ?        247.4131 69.16715 0.000000       69.16715 
1 1 1 2   11 23 o 670.5326 22.33690 87.66256       5.816621      89.04063       7.920318      86.04917       8.569921  674.6384 30.23038 661.8351 33.45106 12.80328       45.08713 
1 1 1 2   11 24 f 522.9109 38.07867 54.05755       7.679687      54.05755       7.679687      0.000000       0.000000  522.9109 38.07867 ?        ?        0.000000       38.07867 
1 1 1 2   11 25 o 418.7212 38.07310 34.82859       6.123496      43.75740       7.409158      15.58518       10.87711  468.9029 41.10204 273.8348 89.16441 195.0681       98.18182 
1 1 1 2   11 26 o 721.8220 23.56359 101.8928       6.605406      109.2363       8.949796      93.10680       9.789487  745.4799 30.91357 685.5430 36.90622 59.93683       48.14268 
1 1 1 2   11 27 o 527.5972 29.78544 54.97576       6.077927      67.71941       8.156912      39.06829       9.113378  583.4911 36.17511 435.2617 55.15108 148.2294       65.95665 
1 1 1 2   11 28 o 229.4107 68.91259 11.39255       6.633720      1.762526       10.06526      18.78798       8.820492  183.7540 78.79610 289.5604 77.07577 -105.8064      110.2248 
1 1 1 2   11 29 o 308.4868 52.40429 20.11297       6.053545      29.92181       8.233337      8.570873       8.931190  374.2594 58.56709 210.9020 79.69449 163.3574       98.90053 
1 1 1 2   11 30 o 540.3800 31.41022 58.52250       6.563273      62.36118       9.106196      54.37263       9.468120  550.6067 42.92521 510.1152 48.37162 40.49149       64.67137 
1 1 1 2   11 31 o 395.7310 40.87405 32.47171       6.191188      38.38054       8.853403      26.81680       8.661087  419.8300 55.67438 341.2658 67.74091 78.56415       87.68391 
1 1 1 2   12 0  o 863.3181 13.14096 144.8955       4.405812      146.3808       6.197507      143.3779       6.264551  867.2379 18.40140 858.2531 18.79518 8.984741       26.30343 
1 1 1 2   12 1  o 1097.109 13.28574 234.0064       5.660614      234.2163       7.962569      233.7919       8.048762  1096.945 18.69133 1095.920 18.91134 1.025513       26.58956 
1 1 1 2   12 2  o 281.3320 20.64911 15.49749       2.240288      17.58157       3.057081      13.08007       3.292492  298.9885 26.60644 256.3210 33.90837 42.66754       43.10082 
1 1 1 2   12 3  f 540.0934 14.16633 56.72570       2.971352      56.45043       4.074458      57.03839       4.342600  538.4255 19.48571 541.1278 20.66436 -2.702332      28.40262 
1 1 1 2   12 4  o 925.9186 14.70903 166.7553       5.289136      162.6618       6.409822      175.4897       9.363007  914.0912 18.05629 948.2635 25.42484 -34.17236      31.18417 
1 1 1 2   12 5  o 313.8455 27.37037 19.39084       3.302601      19.39084       3.302601      0.000000       0.000000  313.8455 27.37037 ?        ?        0.000000       27.37037 
1 1 1 2   12 6  o 455.6843 14.99863 40.40339       2.654261      38.09554       2.897591      52.43878       6.617045  442.3586 16.86687 516.0428 33.19408 -73.68427      37.23357 
1 1 1 2   12 7  o 866.6326 13.05288 146.0833       4.393082      146.2550       4.926808      145.4170       9.704437  866.9542 14.63328 861.8008 28.99582 5.153381       32.47908 
1 1 1 2   12 8  o 911.5401 12.88952 161.6285       4.562894      163.1996       6.507066      160.1087       6.400079  915.1368 18.30928 906.4517 18.18079 8.685120       25.80253 
1 1 1 2   12 9  o 516.9456 20.33690 52.12991       4.082795      0.000000       0.000000      52.12991       4.082795  ?        ?        516.9456 20.33690 0.000000       20.33690 
1 1 1 2   12 10 o 641.3660 15.75928 80.09847       3.925278      74.62663       6.518551      83.21138       4.916629  617.3702 27.18801 653.2429 19.38049 -35.87274      33.38849 
1 1 1 2   12 11 o 73.75928 34.27561 -2.082493      2.366237      -3.820189      3.439220      -0.5205650     3.260645  84.66804 39.96990 101.3365 44.15085 -16.66850      59.55578 
1 1 1 2   12 12 o 808.0015 14.27375 127.0362       4.478970      124.6254       6.262927      129.5600       6.408005  799.4686 20.17196 815.1306 20.24266 -15.66199      28.57749 
1 1 1 2   12 13 o 802.0071 14.75160 125.1477       4.594575      123.2922       6.336265      127.2052       6.672162  795.2975 20.51520 807.7026 21.27096 -12.40503      29.55211 
1 1 1 2   12 14 o 659.7381 16.28888 84.69803       4.173408      95.26913       5.938276      74.38073       5.866559  699.0969 21.87233 617.4204 24.46664 81.67651       32.81791 
1 1 1 2   12 15 o 234.7968 42.51718 11.16645       3.734163      12.83088       4.462445      7.278522       6.820237  251.0698 47.50674 200.8457 70.57136 50.22409       85.07177 
1 1 1 2   12 16 o 1002.626 15.38894 195.4944       5.992052      201.2042       8.357640      189.4551       8.595446  1016.475 21.17186 986.1758 22.44327 30.29913       30.85365 
1 1 1 2   12 17 o 491.0739 21.82772 46.95564       4.162777      44.94433       5.574358      49.49140       6.259067  478.9146 30.12503 502.3265 32.25503 -23.41183      44.13507 
1 1 1 2   12 18 o 1198.826 15.93830 279.4592       7.420380      278.0015       10.23957      281.0714       10.76840  1194.930 22.06537 1201.358 23.08080 -6.427856      31.93124 
1 1 1 2   12 19 o 1340.263 16.31446 349.3300       8.491620      347.8784       11.79760      350.8905       12.23211  1336.523 22.72945 1342.167 23.46751 -5.643555      32.67035 
1 1 1 2   12 20 o 713.2213 23.43483 99.12209       6.491036      112.9174       11.22848      92.19801       7.954943  758.0897 38.26283 687.1161 29.81116 70.97357       48.50515 
1 1 1 2   12 21 o 187.5199 61.84389 6.745111       5.226499      2.600359       8.175052      9.610321       6.797034  179.3588 73.52045 220.1703 70.37299 -40.81148      101.7724 
1 1 1 2   12 22 o 968.0755 25.35080 182.9093       9.530790      182.9093       9.530790      0.000000       0.000000  968.0755 25.35080 ?        ?        0.000000       25.35080 
1 1 1 2   12 23 o 324.8775 47.42172 21.29865       5.806786      17.94617       6.705560      31.35058       11.61117  294.3846 60.67078 385.0303 80.25385 -90.64566      100.6063 
1 1 1 2   12 24 o 370.5330 51.08451 27.79704       7.155501      27.79704       7.155501      0.000000       0.000000  370.5330 51.08451 ?        ?        0.000000       51.08451 
1 1 1 2   12 25 o 196.5013 66.21167 7.498781       5.984904      10.12337       7.235248      1.811426       10.65069  223.6103 72.71693 193.1359 81.88064 30.47441       109.5089 
1 1 1 2   12 26 o 191.9416 63.96517 7.303734       5.585865      8.505887       7.556165      5.855142       8.294582  210.4233 74.24855 196.0975 76.10998 14.32584       106.3277 
1 1 1 2   12 27 o 356.3163 51.33729 26.22845       6.898868      28.86448       10.72217      24.36620       9.012088  360.9502 78.70863 334.3786 71.56144 26.57159       106.3771 
1 1 1 2   12 28 o 128.7587 58.87707 -3.432213      6.591281      -15.87947      9.933696      6.358450       8.810085  126.7542 61.84034 198.2857 78.01065 -71.53159      99.54843 
1 1 1 2   12 29 o 544.4616 30.60296 59.13223       6.444569      72.61038       9.058538      45.31889       9.170486  598.5620 39.18545 465.0146 51.65340 133.5474       64.83497 
1 1 1 2   12 30 o 522.0132 32.30027 54.85738       6.515937      54.77697       9.146523      54.94025       9.284887  512.1155 46.49644 512.3447 47.19507 -0.2291870     66.25174 
1 1 1 2   12 31 o 103.9869 49.58104 -5.962132      5.554979      3.266523       8.269999      -13.54906      7.498409  169.6388 72.04772 105.0443 51.74889 64.59450       88.70638 
1 1 1 2   13 0  o 441.5977 16.76964 37.95878       2.875932      37.91117       3.978929      38.01086       4.161581  440.2054 23.35822 440.6334 24.41480 -0.4280090     33.78889 
1 1 1 2   13 1  o 733.7783 13.49292 104.7182       3.845021      101.6222       5.292817      108.1780       5.595131  722.2985 18.86871 745.1747 19.33411 -22.87622      27.01548 
1 1 1 2   13 2  o 616.3809 15.64221 73.93439       3.744340      73.08312       4.626207      75.55122       6.375614  612.4568 19.45009 621.8291 26.40116 -9.372314      32.79218 
1 1 1 2   13 3  o 1000.873 15.06876 194.9239       5.857127      197.2182       7.317251      190.8322       9.771755  1006.174 18.72608 988.3986 25.45731 17.77515       31.60286 
1 1 1 2   13 4  o 472.7774 17.80505 43.53500       3.269098      43.60624       3.925368      43.37376       5.905653  472.8458 21.37631 469.1204 32.61857 3.725372       38.99895 
1 1 1 2   13 5  o 190.8269 33.24794 7.351220       2.374399      12.29033       3.220834      1.471674       3.514115  247.8195 34.39330 121.6675 48.80793 126.1519       59.70857 
1 1 1 2   13 6  o 584.1290 17.34941 66.46779       3.935694      64.39776       4.621271      71.93346       7.509222  574.5696 20.71051 604.5016 32.10177 -29.93207      38.20274 
1 1 1 2   13 7  o 655.1957 14.10543 83.54072       3.589098      80.45287       3.962372      97.65203       8.470538  642.7843 15.87311 705.4225 30.91959 -62.63818      34.75596 
1 1 1 2   13 8  o 663.1715 31.71391 86.37051       8.167771      0.000000       0.000000      86.37051       8.167771  ?        ?        663.1715 31.71391 0.000000       31.71391 
1 1 1 2   13 9  o 428.6209 30.73466 36.22973       5.082027      36.22973       5.082027      0.000000       0.000000  428.6209 30.73466 ?        ?        0.000000       30.73466 
1 1 1 2   13 10 o 1043.652 13.65202 211.9245       5.533255      211.0562       7.839550      212.7865       7.810937  1040.450 19.40180 1044.738 19.25163 -4.288696      27.33231 
1 1 1 2   13 11 o 401.0976 18.95727 31.35203       2.952935      29.57012       4.236507      33.03579       4.118167  387.6625 28.33646 410.2738 25.98066 -22.61133      38.44411 
1 1 1 2   13 12 o 449.6250 18.68659 39.37985       3.262936      39.68023       4.644051      39.08701       4.585482  449.8195 26.70430 446.4547 26.56722 3.364838       37.66878 
1 1 1 2   13 13 f 581.6973 19.84846 65.91277       4.483859      64.71873       5.279370      69.00366       8.494037  576.0270 23.59996 591.7127 37.15223 -15.68567      44.01416 
1 1 1 2   13 14 o 859.2727 15.26649 143.6107       5.094460      146.0075       7.018699      140.9419       7.406219  865.7844 20.87463 850.4285 22.42492 15.35590       30.63702 
1 1 1 2   13 15 o 482.0576 20.63724 45.24723       3.863478      51.00510       5.340546      38.92544       5.595964  510.6046 27.02851 445.0331 32.60530 65.57144       42.35146 
1 1 1 2   13 16 f 1696.028 16.70423 559.4646       11.00240      544.1344       14.97198      577.4630       16.22265  1671.396 23.06598 1721.537 24.26484 -50.14136      33.47868 
1 1 1 2   13 17 o 848.7698 16.68335 140.1018       5.499220      142.7792       7.549016      137.0745       8.027128  856.2833 22.70099 838.7908 24.64215 17.49255       33.50478 
1 1 1 2   13 18 f 507.4012 22.20650 50.13017       4.375822      55.06024       5.892320      44.06786       6.533999  530.5114 28.70665 473.3695 35.80759 57.14185       45.89395 
1 1 1 2   13 19 o 1336.246 16.59041 347.2994       8.609372      350.0982       11.84535      344.1652       12.53487  1340.624 22.75165 1328.922 24.28804 11.70203       33.27982 
1 1 1 2   13 20 o 220.3445 52.73799 9.987085       4.452744      9.433527       5.965367      10.68355       6.691215  216.1584 65.44306 229.4558 69.27475 -13.29736      95.29840 
1 1 1 2   13 21 o 1000.853 21.03545 195.1748       8.176174      204.8427       14.11940      190.2973       10.02873  1022.104 35.57076 987.3488 26.15456 34.75494       44.15133 
1 1 1 2   13 22 o 1196.519 20.29898 278.9435       9.432396      278.6066       11.26748      279.7327       17.24396  1194.922 24.28059 1193.434 37.20580 1.487793       44.42768 
1 1 1 2   13 23 o 747.1382 25.14851 109.0153       7.296947      108.7836       8.488496      109.6712       14.28196  745.5801 29.31625 741.6375 49.87700 3.942627       57.85462 
1 1 1 2   13 24 f 174.9604 61.51716 5.556662       5.182860      17.16420       7.050604      -8.089560      7.644735  285.7151 65.00666 126.1622 59.56852 159.5529       88.17184 
1 1 1 2   13 25 o 204.4691 64.60047 8.528142       5.740451      9.855921       7.158197      6.135514       9.609005  220.3866 72.36095 206.8594 81.44318 13.52721       108.9454 
1 1 1 2   13 26 o 436.1851 40.77022 38.21606       6.826149      42.78806       10.44398      34.80637       9.019238  453.0034 60.90931 409.0467 58.43760 43.95673       84.40911 
1 1 1 2   13 27 o 397.4460 44.97218 32.21555       6.819302      35.85604       10.78128      29.78781       8.804218  406.2416 70.91747 373.7641 62.88776 32.47745       94.78480 
1 1 1 2   13 28 o 408.5177 39.13700 33.83322       6.133074      45.17939       8.405218      20.91340       8.969176  468.5617 46.81738 302.7827 76.30540 165.7790       89.52307 
1 1 1 2   13 29 o 212.5152 65.30539 10.04197       5.910931      20.00826       8.240094      -0.5227302     8.483872  294.3722 72.54597 157.0810 69.71322 137.2912       100.6124 
1 1 1 2   13 30 o 373.6908 43.55999 29.19050       6.202986      24.95171       9.037413      32.96608       8.529314  325.0011 73.34449 387.0013 58.58348 -62.00024      93.86926 
1 1 1 2   14 0  o 333.0437 21.46391 21.73110       2.761337      22.52977       3.789208      20.82664       4.032362  337.8901 29.16225 324.1322 32.47055 13.75784       43.64371 
1 1 1 2   14 1  o 182.4209 38.41830 6.802038       2.635717      5.166050       3.193635      10.29656       4.667551  160.0807 47.75353 222.5086 54.45713 -62.42786      72.42913 
1 1 1 2   14 2  o 922.7178 15.33264 165.7397       5.494317      164.7528       6.764735      167.6526       9.418086  919.3591 18.94687 925.8019 26.19489 -6.442810      32.32888 
1 1 1 2   14 3  f 277.0216 24.11176 15.10704       2.568133      16.67467       3.464519      13.19509       3.826123  289.8730 31.27086 255.6034 39.84364 34.26958       50.64960 
1 1 1 2   14 4  o 799.0301 13.81119 124.2347       4.285703      123.2973       5.861788      125.3112       6.281785  795.2640 18.97976 801.5240 20.18081 -6.260010      27.70373 
1 1 1 2   14 5  o 603.5352 15.01217 70.90990       3.518633      68.37839       4.780626      73.90238       5.197692  591.9742 20.79477 615.2806 21.75251 -23.30634      30.09309 
1 1 1 2   14 6  o 479.9655 25.72404 45.19506       4.777424      47.14299       6.857245      43.35775       6.659682  487.7519 36.46496 467.5173 36.98175 20.23459       51.93595 
1 1 1 2   14 7  o 165.7484 41.26114 5.647321       2.645571      3.382593       2.950181      14.94666       5.978147  135.7162 46.48315 267.3477 59.14585 -131.6315      75.22575 
1 1 1 2   14 8  o 438.5084 19.78103 37.49856       3.368642      39.59785       3.848838      30.62506       6.964381  450.3873 22.00470 389.8537 46.94313 60.53354       51.84462 
1 1 1 2   14 9  o 234.3142 35.73419 11.03941       3.148787      10.94821       3.643518      11.30849       6.258516  231.9318 41.99755 232.8131 66.12392 -0.8813171     78.33369 
1 1 1 2   14 10 f 257.9913 26.30384 13.14297       2.598570      12.46346       3.939124      13.66651       3.457639  247.8953 42.44330 261.5316 34.91487 -13.63635      54.95891 
1 1 1 2   14 11 o 247.1520 29.67360 12.12042       2.791210      13.98785       4.179669      10.61724       3.749938  263.1783 42.32936 228.2260 43.90287 34.95226       60.98555 
1 1 1 2   14 12 o 507.9233 21.93524 50.28529       4.326818      47.07885       5.105060      58.46333       8.152916  490.2681 26.91562 544.1453 38.83574 -53.87726      47.25109 
1 1 1 2   14 13 o 170.1812 45.00559 5.907225       3.020041      5.438376       4.256128      6.382677       4.285995  169.0995 55.81019 179.5329 55.68222 -10.43335      78.83710 
1 1 1 2   14 14 o 383.3896 23.62681 28.75160       3.500682      28.24781       4.824960      29.31157       5.086837  378.6592 33.14461 385.5770 34.33017 -6.917847      47.71924 
1 1 1 2   14 15 o 304.7708 30.58622 18.31380       3.571319      18.92555       4.810741      17.56277       5.330347  308.0107 41.25421 295.0841 48.17649 12.92657       63.42621 
1 1 1 2   14 16 o 447.5666 23.34406 39.11880       4.043475      40.83954       5.486969      37.07379       5.981681  456.3450 31.14680 433.9760 35.81181 22.36905       47.46166 
1 1 1 2   14 17 o 486.8699 22.94217 46.16280       4.337858      51.80292       5.925089      39.64760       6.368161  514.3935 29.78751 448.6946 36.87175 65.69888       47.40065 
1 1 1 2   14 18 o 1173.065 16.22727 267.6250       7.392568      271.2702       10.24036      263.6578       10.68302  1180.194 22.34261 1163.309 23.64674 16.88538       32.53245 
1 1 1 2   14 19 f 478.5304 26.04229 44.80054       4.821463      50.82843       6.518133      37.51725       7.164806  508.6684 33.17760 434.7919 42.99556 73.87656       54.30811 
1 1 1 2   14 20 o 710.8267 20.22279 98.41573       5.582552      105.9095       7.613607      89.70221       8.209916  736.5629 26.61660 677.1898 31.21766 59.37305       41.02421 
1 1 1 2   14 21 o 256.9086 58.23849 13.66691       5.676464      27.81741       8.901412      3.968270       7.369335  367.3950 64.75355 180.3612 71.22347 187.0339       96.25905 
1 1 1 2   14 22 o 483.4395 34.19611 46.06706       6.378751      47.62429       7.307151      41.08034       13.07614  490.5817 38.66729 442.3976 79.00839 48.18408       87.96298 
1 1 1 2   14 23 o 143.6268 58.24028 1.893313       5.062252      6.576705       6.786091      -3.982845      7.601270  193.8313 70.13564 140.6767 63.89867 53.15456       94.87912 
1 1 1 2   14 24 o 345.5538 63.20511 24.94552       8.169382      0.000000       0.000000      24.94552       8.169382  ?        ?        345.5538 63.20511 0.000000       63.20511 
1 1 1 2   14 25 o 471.8518 34.57254 44.20855       6.291162      43.48664       7.751981      45.60131       10.76746  465.0244 43.42751 468.9970 60.53001 -3.972626      74.49718 
1 1 1 2   14 26 o 351.2080 56.65194 25.82891       7.464011      24.47420       10.12550      27.44108       11.04586  331.0675 79.70959 349.4041 82.69027 -18.33664      114.8534 
1 1 1 2   14 27 o 461.9072 51.44118 44.19885       9.070958      0.000000       0.000000      44.19885       9.070958  ?        ?        461.9072 51.44118 0.000000       51.44118 
1 1 1 2   14 28 o 232.8303 61.68447 11.97510       5.666648      16.12310       7.731897      7.161597       8.329086  265.5682 72.79919 197.9342 76.42290 67.63399       105.5471 
1 1 1 2   14 29 o 166.2738 63.56190 4.943062       5.722730      7.321678       8.185989      2.669361       8.003423  195.1883 75.65115 167.2365 70.94419 27.95184       103.7120 
1 1 1 2   14 30 o 116.3412 53.29890 -2.537363      5.436551      -5.233054      7.679652      0.1707104      7.697268  129.3996 60.65885 150.7800 66.68445 -21.38043      90.14606 
1 1 1 2   15 0  o 228.6592 34.35480 10.51028       2.956415      9.639739       3.648185      12.17565       5.045894  216.4916 44.86592 241.6496 55.00333 -25.15799      70.98111 
1 1 1 2   15 1  o 289.0708 27.48428 16.51135       3.048307      16.17875       3.694418      17.22078       5.395523  284.7960 34.07981 289.9411 49.70662 -5.145111      60.26758 
1 1 1 2   15 2  o 246.3774 28.11448 12.04443       2.641869      10.74183       3.494549      13.78195       4.036008  229.7930 40.64558 260.8765 41.20546 -31.08350      57.87878 
1 1 1 2   15 3  o 324.1305 22.32812 20.61291       2.793463      20.43727       3.743514      20.83360       4.196243  321.3410 30.35713 323.7305 33.87894 -2.389496      45.48998 
1 1 1 2   15 4  o 167.4459 47.79171 5.727841       3.261090      0.7837467      5.668338      8.173905       3.987000  142.4332 60.02289 198.5241 51.33332 -56.09096      78.98010 
1 1 1 2   15 5  o 426.0059 23.52965 35.56422       3.877681      33.69733       6.699853      36.50459       4.755032  410.3391 42.66699 430.6942 28.59116 -20.35504      51.36075 
1 1 1 2   15 6  o 867.2665 15.35745 146.4271       5.172490      145.2680       5.995387      149.8015       10.22961  863.4326 17.87972 874.0042 30.13822 -10.57159      35.04278 
1 1 1 2   15 7  o 1054.557 15.55390 216.4892       6.369968      212.2926       7.356215      229.0677       12.73573  1043.810 18.14701 1080.940 30.33852 -37.12964      35.35166 
1 1 1 2   15 8  o 557.8344 18.06761 60.61890       3.914117      57.77396       4.482289      69.75516       8.032434  544.2565 21.20646 594.7956 34.92699 -50.53912      40.86084 
1 1 1 2   15 9  o 583.4913 16.48060 66.27361       3.734524      67.11810       4.215468      63.19320       8.051006  587.0095 18.49153 565.8299 36.83922 21.17957       41.21971 
1 1 1 2   15 10 o 225.3020 41.01025 10.29346       3.456078      11.76723       4.095630      6.648650       6.440856  240.3151 45.55169 193.0334 68.50317 47.28175       82.26567 
1 1 1 2   15 11 o 363.0422 21.69754 25.77384       3.045111      29.09459       4.492693      22.95185       4.141577  384.5879 30.32644 341.0953 31.62495 43.49252       43.81587 
1 1 1 2   15 12 o 1473.683 15.28999 422.3787       8.750631      416.4058       12.24835      428.6057       12.50620  1462.068 21.57159 1483.301 21.71042 -21.23279      30.60516 
1 1 1 2   15 13 o 626.0097 16.98365 76.23357       4.128954      82.31226       6.117349      71.14706       5.595881  649.8802 24.23829 604.2339 23.84709 45.64630       34.00262 
1 1 1 2   15 14 o 952.1439 15.31661 176.2751       5.663610      175.4949       8.026255      177.0488       7.992956  949.3799 21.76932 953.5956 21.58317 -4.215698      30.65512 
1 1 1 2   15 15 o 510.0237 20.53270 50.62717       4.066908      51.92511       5.646983      49.22850       5.861995  515.2130 28.33176 501.3527 30.24912 13.86026       41.44512 
1 1 1 2   15 16 o 972.2499 15.96293 183.8091       6.027239      190.9810       8.462092      176.4240       8.586884  990.4081 22.00065 951.7679 23.23146 38.64020       31.99578 
1 1 1 2   15 17 o 465.7632 24.57028 42.39154       4.428574      39.43368       5.871416      46.29499       6.744953  447.8423 34.01315 485.0990 36.06092 -37.25674      49.57100 
1 1 1 2   15 18 f 329.2976 33.89266 21.43684       4.272431      23.42563       5.704491      18.89597       6.447821  342.4413 43.90579 304.0740 56.68710 38.36728       71.70178 
1 1 1 2   15 19 o 620.1376 21.86662 74.93983       5.266203      64.49861       6.901315      89.49432       8.148071  573.4546 31.10516 676.4781 31.01509 -103.0236      43.92569 
1 1 1 2   15 20 f 498.7224 26.31094 48.69692       5.077894      46.46346       6.655275      51.80859       7.855497  485.4570 35.54822 511.8091 39.83569 -26.35214      53.39062 
1 1 1 2   15 21 o 744.3384 30.29284 108.4237       8.756660      96.58772       11.12998      127.6530       14.18646  699.0819 41.17753 802.4528 45.71178 -103.3708      61.52362 
1 1 1 2   15 22 o 259.8303 82.66547 13.90298       9.387301      13.90298       9.387301      0.000000       0.000000  259.8303 82.66547 ?        ?        0.000000       82.66547 
1 1 1 2   15 23 o 416.6599 33.85176 34.35934       5.430249      29.68930       7.198778      40.52498       8.271561  382.8639 49.58017 448.6432 48.23174 -65.77930      69.17003 
1 1 1 2   15 24 o 201.8896 62.16943 8.392927       5.353702      3.639059       7.126595      14.55105       8.111152  173.8308 69.58652 260.2578 75.70069 -86.42708      102.8245 
1 1 1 2   15 25 o 353.3604 53.83149 25.89070       7.153829      37.13288       10.34024      15.56938       9.907702  418.6435 65.76841 266.5581 84.93864 152.0853       107.4247 
1 1 1 2   15 26 f 846.9742 42.02994 144.1630       13.82474      0.000000       0.000000      144.1630       13.82474  ?        ?        846.9742 42.02994 0.000000       42.02994 
1 1 1 2   15 27 o 177.2319 63.37675 6.086294       5.522956      9.356978       7.547035      2.315096       8.103949  211.4645 74.24010 169.5024 71.61773 41.96210       103.1537 
1 1 1 2   15 28 o 367.2633 41.16880 27.77123       5.770782      31.15765       8.102799      24.28554       8.220715  380.2364 56.59778 328.7183 66.67616 51.51810       87.45867 
1 1 1 2   15 29 o 505.5158 31.51896 51.50031       6.156960      59.98965       8.706939      43.00974       8.707575  538.3448 41.97813 448.9302 50.84112 89.41461       65.93166 
1 1 1 2   16 0  o 926.2097 14.43101 166.9702       5.190795      168.3464       7.249495      165.5224       7.435838  928.9940 20.09402 921.0217 20.78893 7.972290       28.91278 
1 1 1 2   16 1  o 415.2978 19.44936 33.63228       3.136844      42.49746       4.351091      24.03817       4.526438  465.6907 24.14157 348.0197 33.92199 117.6710       41.63552 
1 1 1 2   16 2  o 1029.260 14.31448 206.1727       5.721744      216.6202       8.176450      196.1471       8.009663  1053.886 19.97759 1002.716 20.56877 51.17035       28.67366 
1 1 1 2   16 3  o 1080.441 16.98700 227.3822       7.127638      223.4177       12.43326      229.3228       8.698974  1067.462 29.99196 1084.232 20.65941 -16.77014      36.41880 
1 1 1 2   16 4  o 621.6221 16.00524 75.23544       3.863819      73.84148       5.259477      76.86982       5.695002  615.0975 22.01763 627.3813 23.37407 -12.28375      32.11111 
1 1 1 2   16 5  o 320.9410 28.13313 20.31212       3.471089      15.96834       5.026763      24.27100       4.798884  279.8439 47.98041 349.5087 35.86345 -69.66483      59.90248 
1 1 1 2   16 6  o 1224.997 20.50796 292.5643       9.756310      294.2318       13.16514      290.5329       14.53073  1226.468 27.64020 1217.687 30.72724 8.780762       41.32970 
1 1 1 2   16 7  o 1248.977 17.19448 303.7164       8.340102      310.3222       10.17995      290.2315       14.54472  1261.712 20.77578 1217.362 30.76505 44.35022       37.12306 
1 1 1 2   16 8  o 232.2178 31.54322 10.74709       2.771036      8.653712       3.046140      20.79144       6.672481  206.4340 39.43422 318.7352 55.94577 -112.3013      68.44696 
1 1 1 2   16 9  o 433.7128 19.60090 36.63422       3.301461      35.35192       3.657366      42.27755       7.672551  425.3016 22.22049 461.3406 43.33205 -36.03900      48.69719 
1 1 1 2   16 10 o 154.4373 46.34293 4.750959       3.001194      4.803097       3.356116      4.542827       6.705448  156.7749 49.37992 179.2681 68.73816 -22.49316      84.63634 
1 1 1 2   16 11 o 1001.031 14.50662 194.8469       5.639515      195.8961       8.107457      193.8633       7.849742  1002.989 20.81423 997.8466 20.25646 5.142822       29.04404 
1 1 1 2   16 12 o 466.2062 26.23633 42.51291       4.730859      0.000000       0.000000      42.51291       4.730859  ?        ?        466.2062 26.23633 0.000000       26.23633 
1 1 1 2   16 13 o 775.9447 15.78764 117.0767       4.757468      113.4750       6.871427      120.3927       6.593337  763.2963 23.18066 786.3760 21.58972 -23.07965      31.67742 
1 1 1 2   16 14 o 1045.255 15.26502 212.4207       6.196519      206.6580       8.699704      218.3548       8.828109  1030.304 21.74258 1059.095 21.46371 -28.79102      30.55210 
1 1 1 2   16 15 o 351.1357 28.83590 24.21185       3.897482      26.26206       5.524322      22.18001       5.499507  364.0640 39.71706 333.4966 43.49815 30.56738       58.90274 
1 1 1 2   16 16 o 1043.663 15.93495 211.8244       6.458609      217.5079       9.202213      206.3066       9.066993  1056.789 22.42210 1029.181 22.68524 27.60742       31.89625 
1 1 1 2   16 17 o 186.4662 53.70998 7.038616       4.101039      8.862471       5.606051      4.938957       6.015010  209.8188 63.42312 176.9682 65.69819 32.85060       91.31673 
1 1 1 2   16 18 o 514.8619 24.50106 51.70077       4.898956      56.67691       6.647511      45.78554       7.247670  537.3042 32.00244 481.3435 39.10994 55.96069       50.53458 
1 1 1 2   16 19 o 635.8810 28.75961 79.02959       7.102100      79.02959       7.102100      0.000000       0.000000  635.8810 28.75961 ?        ?        0.000000       28.75961 
1 1 1 2   16 20 o 1051.760 20.29971 215.5428       8.291531      205.0061       9.695903      244.2192       15.99548  1024.953 24.35883 1115.101 36.93644 -90.14856      44.24537 
1 1 1 2   16 21 f 720.0732 26.45160 101.3348       7.397018      110.8503       11.96996      95.45596       9.408504  748.5689 41.33512 697.2466 34.74611 51.32227       53.99893 
1 1 1 2   16 22 o 511.3709 34.99847 51.67586       6.908662      45.69507       11.06881      55.49275       8.842525  471.9853 61.87777 527.5529 43.54939 -55.56763      75.66643 
1 1 1 2   16 23 o 412.5789 33.96404 33.76353       5.393604      39.06733       7.099270      26.52268       8.294965  441.7027 41.88704 356.3033 62.21048 85.39938       74.99778 
1 1 1 2   16 24 o 569.1469 32.56807 64.13667       7.168649      63.15108       11.17382      64.82611       9.345438  556.3973 52.32636 568.3325 42.65287 -11.93518      67.50789 
1 1 1 2   16 25 o 392.3993 38.67656 31.00111       5.817275      46.81678       8.140798      14.49843       8.315729  480.5921 44.10992 256.3105 77.19288 224.2816       88.90684 
1 1 1 2   16 26 o 249.8733 62.55662 13.65506       6.056586      19.88103       7.550202      2.417602       10.14353  300.6304 66.43808 185.4911 79.30945 115.1392       103.4602 
1 1 1 2   16 27 o 211.3288 62.54768 9.836617       5.494960      14.46116       7.718120      5.083010       7.825079  250.8564 74.09618 181.7657 72.86244 69.09073       103.9191 
1 1 1 2   16 28 o 254.1352 58.52617 14.38347       5.656964      25.11338       8.103289      4.182943       7.900861  333.7050 64.86391 174.3975 71.97285 159.3075       96.88869 
1 1 1 2   16 29 o 514.5090 30.86263 53.38698       6.138223      70.79658       9.059506      38.61217       8.345859  585.4922 40.08452 423.1127 51.87784 162.3795       65.55973 
1 1 1 2   17 0  o 796.0515 15.15038 123.3310       4.683741      124.4448       6.502430      122.1300       6.752250  798.8054 20.96074 791.1703 21.97610 7.635132       30.36942 
1 1 1 2   17 1  o 577.5947 20.44023 65.04651       4.584975      62.78942       8.002850      66.14935       5.594074  563.7680 36.75344 581.9156 24.75370 -18.14764      44.31209 
1 1 1 2   17 2  o 1162.632 14.66553 263.0157       6.621677      260.1089       9.144286      266.2203       9.601357  1155.077 20.38501 1168.387 21.16011 -13.31018      29.38195 
1 1 1 2   17 3  o 718.4443 17.63473 100.5179       4.920282      101.8340       7.797798      99.64734       6.342235  721.5776 27.82665 714.6239 22.85266 6.953674       36.00787 
1 1 1 2   17 4  o 220.2103 41.04913 9.855142       3.381353      10.39927       4.949172      9.378803       4.630618  223.9305 56.81842 212.9240 55.45128 11.00659       79.39255 
1 1 1 2   17 5  o 798.3094 15.25263 123.9950       4.728725      119.1831       6.317057      130.1281       7.131650  781.9982 20.80085 816.8632 22.48085 -34.86493      30.62783 
1 1 1 2   17 6  o 457.8449 22.15791 40.86555       3.939810      40.70292       4.629550      41.29268       7.502345  455.8239 26.26371 455.8409 42.88359 -0.1705933E-01 50.28702 
1 1 1 2   17 7  o 549.0962 16.69864 58.66956       3.560882      58.21553       3.950559      60.63644       8.222464  546.8282 18.60286 554.4329 38.42485 -7.604736      42.69116 
1 1 1 2   17 8  o 560.6023 16.84462 61.14835       3.667279      60.75613       4.046800      62.95014       8.673530  558.6740 18.65200 564.8448 39.79460 -6.170776      43.94891 
1 1 1 2   17 9  o 1527.959 15.65898 454.0761       9.291872      454.1453       10.53643      453.8341       19.70815  1527.720 17.75914 1523.189 33.31686 4.531250       37.75447 
1 1 1 2   17 10 o 370.7056 24.56533 26.90094       3.516508      28.83028       3.993027      20.23383       7.422786  383.5190 26.98130 313.6457 63.12489 69.87323       68.64941 
1 1 1 2   17 11 o 347.0022 30.97022 23.69527       4.129676      24.82022       4.930160      21.04984       7.560327  354.3478 36.34061 320.3093 63.02228 34.03851       72.74921 
1 1 1 2   17 12 o 1113.259 14.93153 240.9499       6.455482      237.0473       9.181634      244.7650       9.078108  1103.487 21.42520 1121.382 20.84557 -17.89539      29.89276 
1 1 1 2   17 13 o 511.8601 19.78745 50.98349       3.933410      57.00553       6.055972      46.58927       5.173132  539.8173 28.99360 488.0658 27.40361 51.75153       39.89470 
1 1 1 2   17 14 o 641.3551 18.04569 80.01862       4.494694      77.97079       6.647236      81.74360       6.100778  632.3720 27.06702 647.7532 24.25201 -15.38123      36.34259 
1 1 1 2   17 15 o 773.9693 16.98025 116.5217       5.103824      114.1160       7.314201      118.8048       7.125299  765.2000 24.61296 780.8896 23.49554 -15.68964      34.02702 
1 1 1 2   17 16 o 352.1079 30.83432 24.41057       4.173874      33.39421       6.212133      17.01753       5.635419  410.7191 39.43111 289.2018 52.09209 121.5173       65.33298 
1 1 1 2   17 17 o 489.9693 24.27122 46.81911       4.618368      51.55959       6.533273      42.08419       6.529447  512.1954 33.02077 461.8345 36.70792 50.36090       49.37452 
1 1 1 2   17 18 o 323.1151 56.02670 21.32716       6.775581      0.000000       0.000000      21.32716       6.775581  ?        ?        323.1151 56.02670 0.000000       56.02670 
1 1 1 2   17 19 f 273.6108 55.89303 15.42516       5.738368      12.57065       6.634190      23.90577       11.43498  245.8164 67.45406 334.2779 87.17889 -88.46143      110.2280 
1 1 1 2   17 20 o 258.0972 59.73217 13.86258       5.868605      15.77252       6.658354      7.213617       12.42322  274.7565 63.64966 232.5052 92.26560 42.25125       112.0902 
1 1 1 2   17 21 o 754.0070 25.61839 111.1543       7.501624      111.0383       12.16541      111.2255       9.528913  748.1852 42.03906 752.6574 32.60003 -4.472168      53.19816 
1 1 1 2   17 22 o 301.2358 54.78381 18.78702       6.172857      25.19790       9.750668      14.49923       7.974296  342.3994 75.37061 260.5769 74.84830 81.82254       106.2215 
1 1 1 2   17 23 o 430.0790 40.45848 37.09495       6.678067      21.12987       10.10663      49.46717       8.897017  308.8532 82.63883 494.6642 46.87263 -185.8110      95.00642 
1 1 1 2   17 24 o 443.3691 39.06996 39.48412       6.658475      42.20589       10.16978      37.44193       8.809123  448.9658 59.81532 425.0567 54.62956 23.90909       81.00779 
1 1 1 2   17 25 f 433.2818 34.76947 37.60596       5.801268      45.09010       7.982140      29.22679       8.445957  470.4356 44.20951 369.9763 60.90196 100.4593       75.25642 
1 1 1 2   17 26 o 255.3597 63.51250 14.45444       6.272353      11.78519       7.661544      19.87965       10.92268  229.8055 74.83322 287.4709 88.84628 -57.66533      116.1623 
1 1 1 2   17 27 o 170.6834 63.01537 5.589844       5.518638      3.759314       7.791481      7.432689       7.817648  172.1248 71.28911 194.9444 74.34548 -22.81960      103.0019 
1 1 1 2   17 28 f 232.4964 59.45004 12.22643       5.388814      20.24809       7.808776      4.932730       7.446027  293.9675 69.49590 174.7678 70.71575 119.1997       99.14837 
1 1 1 2   18 0  o 575.2545 21.49524 64.50288       4.802090      69.37885       8.453608      62.17990       5.834913  593.3010 36.87172 564.2255 26.62893 29.07550       45.48212 
1 1 1 2   18 1  o 176.9238 43.82929 6.414559       2.995929      3.449640       3.906047      10.65103       4.669101  145.4456 53.12114 227.1082 53.77079 -81.66257      75.58540 
1 1 1 2   18 2  o 460.7049 22.64519 41.38359       4.051601      36.78549       6.139008      44.93192       5.392887  431.3513 37.00536 478.5357 29.15786 -47.18445      47.11239 
1 1 1 2   18 3  o 625.4920 19.32403 76.19051       4.694048      72.66954       7.162879      78.84081       6.214460  609.5885 30.25679 635.6367 25.17483 -26.04816      39.36045 
1 1 1 2   18 4  o 159.8757 46.47282 5.145522       3.057776      4.759153       3.956651      5.718480       4.818234  159.7984 53.83567 175.1849 59.40681 -15.38643      80.17137 
1 1 1 2   18 5  o 210.4044 44.17993 9.035119       3.495078      11.19737       4.043997      2.652585       6.947916  234.4357 46.06096 168.6167 68.28055 65.81900       82.36411 
1 1 1 2   18 6  o 370.8685 24.29967 26.92937       3.480492      28.93977       4.518377      23.99588       5.458007  383.6309 30.58187 347.1534 41.29424 36.47757       51.38545 
1 1 1 2   18 7  o 679.1458 15.78517 89.70816       4.163324      90.50539       4.686520      86.72372       9.067562  682.0143 17.69412 664.6859 35.25343 17.32849       39.44473 
1 1 1 2   18 8  o 672.0157 17.85338 87.86391       4.659378      81.84674       5.234677      110.8137       10.22312  648.3703 20.78925 752.5995 34.97774 -104.2292      40.68950 
1 1 1 2   18 9  o 1160.420 14.84382 261.8109       6.689425      266.8722       7.614831      244.7010       14.00072  1171.378 16.73922 1119.193 32.21197 52.18518       36.30169 
1 1 1 2   18 10 o 1564.986 15.99622 476.2533       9.722002      476.5811       11.03654      475.1180       20.54012  1565.203 18.15660 1559.240 33.92049 5.962524       38.47417 
1 1 1 2   18 11 o 173.6852 50.20864 6.065661       3.577994      7.942820       4.045014      -0.6845745     7.670594  197.2677 52.04625 157.7929 68.23293 39.47478       85.81693 
1 1 1 2   18 12 o 977.9445 18.50793 186.0576       7.029107      187.6297       8.432643      182.4784       12.72397  981.6702 22.11923 966.3450 33.90491 15.32526       40.48214 
1 1 1 2   18 13 o 704.2744 25.50590 96.67468       6.976065      96.67468       6.976065      0.000000       0.000000  704.2744 25.50590 ?        ?        0.000000       25.50590 
1 1 1 2   18 14 o 1014.322 15.82333 200.0950       6.233067      200.3070       9.033332      199.9024       8.611562  1013.977 22.93991 1013.103 21.88770 0.8740234      31.70664 
1 1 1 2   18 15 o 817.8691 17.28704 130.1558       5.490760      131.7654       8.098420      128.7864       7.469829  821.9319 25.37093 812.8223 23.66394 9.109680       34.69389 
1 1 1 2   18 16 o 840.4194 24.18566 137.7492       7.893726      0.000000       0.000000      137.7492       7.893726  ?        ?        840.4194 24.18566 0.000000       24.18566 
1 1 1 2   18 17 o 889.6594 17.88984 154.0808       6.180993      164.9093       9.070359      144.6929       8.445537  919.2050 25.40880 861.0466 25.25647 58.15845       35.82592 
1 1 1 2   18 18 o 388.2330 36.63432 29.84935       5.458127      40.31264       6.734158      9.813437       9.318667  451.2001 38.80907 231.5167 82.37240 219.6834       91.05688 
1 1 1 2   18 19 o 721.9309 23.89341 101.7297       6.698873      101.3066       8.146564      102.6130       11.77177  719.5167 29.15450 719.9073 42.29107 -0.3906860     51.36652 
1 1 1 2   18 20 o 241.4237 54.88219 12.11071       5.029083      9.148633       6.816017      15.65009       7.450677  214.6834 70.61616 271.9810 70.09786 -57.29758      99.50051 
1 1 1 2   18 21 o 773.3568 25.23625 117.0448       7.579362      114.2140       12.30282      118.7764       9.622222  757.6713 41.97543 777.2565 31.87741 -19.58521      52.70774 
1 1 1 2   18 22 o 699.1151 34.86509 96.59502       9.466020      0.000000       0.000000      96.59502       9.466020  ?        ?        699.1151 34.86509 0.000000       34.86509 
1 1 1 2   18 23 o 731.2667 26.25049 105.0755       7.454891      100.9070       11.96679      107.7192       9.530065  708.0287 43.73513 737.7798 33.26144 -29.75110      54.94620 
1 1 1 2   18 24 f 107.1852 49.87751 -4.038713      5.038540      -2.596537      6.869693      -5.717733      7.412352  135.5981 61.25089 129.1552 60.23290 6.442856       85.90503 
1 1 1 2   18 25 o 439.7989 32.35711 38.70672       5.487710      38.72001       7.548584      38.69183       7.991970  433.7397 45.49068 431.9611 48.47777 1.778595       66.47929 
1 1 1 2   18 26 o 146.1752 61.96678 1.475256       6.099302      8.300535       7.397240      -13.01928      10.77982  200.2610 73.10859 137.8729 66.59502 62.38818       98.89268 
1 1 1 2   18 27 o 277.8306 59.79401 17.29145       6.260454      22.10412       7.739492      8.182013       10.64793  310.7626 66.15848 207.8117 84.39680 102.9509       107.2370 
1 1 1 2   19 0  o 196.3701 57.43407 7.807804       4.657506      14.71877       5.815842      -4.549544      7.776887  267.3250 57.71074 141.2512 64.34184 126.0738       86.43148 
1 1 1 2   19 1  o 110.2171 46.85773 0.7785177E-01  3.504492      5.401722       5.204068      -4.339792      4.740505  174.8582 61.62688 103.4717 48.22628 71.38651       78.25374 
1 1 1 2   19 2  o 300.8899 33.57618 17.92839       3.856534      13.00206       5.781392      21.87783       5.176527  250.8393 60.12999 331.3272 41.11382 -80.48790      72.84203 
1 1 1 2   19 3  o 494.5240 20.34242 47.61719       3.906772      47.50026       5.124912      47.77941       6.036309  492.6900 26.88619 493.4097 31.66909 -0.7197266     41.54273 
1 1 1 2   19 4  o 683.4767 19.20137 90.92268       5.096640      94.20981       6.007992      82.48555       9.625383  695.4410 22.24545 647.5888 38.44513 47.85217       44.41720 
1 1 1 2   19 5  o 1036.078 15.28824 208.7423       6.151457      213.0540       8.496272      203.9919       8.917990  1046.066 20.91420 1023.369 22.43917 22.69739       30.67442 
1 1 1 2   19 6  o 478.4454 20.89373 44.56454       3.882185      42.97945       5.006694      46.95455       6.147837  468.6003 27.63420 489.1431 32.54955 -20.54288      42.69804 
1 1 1 2   19 7  o 1076.099 16.69277 225.2133       6.976033      219.8210       8.065826      241.2217       13.89743  1062.825 19.54156 1111.282 32.20194 -48.45776      37.66746 
1 1 1 2   19 8  o 813.9495 15.42884 128.8152       4.877067      130.3326       5.474358      122.9778       10.73740  818.5965 17.22009 793.1447 34.85929 25.45178       38.88061 
1 1 1 2   19 9  o 528.7139 19.16695 54.38928       3.935516      54.14869       4.374826      55.40996       9.010887  527.4150 21.35897 529.5728 44.21859 -2.157776      49.10692 
1 1 1 2   19 10 o 202.3938 44.69376 8.351460       3.419099      10.78125       3.791914      -2.214345      7.907246  230.6792 43.93188 153.0331 67.63904 77.64607       80.65388 
1 1 1 2   19 11 o 1435.967 16.08948 400.9840       8.972519      405.3727       10.25218      386.6222       18.54612  1443.493 18.28831 1406.444 33.95491 37.04895       38.56680 
1 1 1 2   19 12 o 837.4780 17.22065 136.4355       5.600812      136.6335       6.370396      135.7612       11.75494  837.8650 19.57782 832.8204 36.34470 5.044556       41.28230 
1 1 1 2   19 13 o 565.4382 20.24710 62.25096       4.446066      59.62702       6.804569      64.20572       5.873134  551.3822 31.91398 573.7076 26.36036 -22.32544      41.39288 
1 1 1 2   19 14 o 715.7667 18.24298 99.71827       5.071019      115.0997       7.862611      88.76318       6.635533  767.9982 26.36202 674.5623 25.32945 93.43591       36.55868 
1 1 1 2   19 15 o 498.0236 23.21445 48.35963       4.489895      48.96437       6.801098      47.89247       5.977645  498.5653 35.35531 493.8105 31.33264 4.754791       47.24121 
1 1 1 2   19 16 f 621.3124 21.16785 75.22733       5.107574      78.94280       7.509295      72.02866       6.967496  635.2579 30.43835 606.9285 29.56046 28.32935       42.43011 
1 1 1 2   19 17 o 446.3758 31.35657 39.19868       5.401231      42.65622       7.127312      34.53434       8.278234  463.9286 39.94868 413.7968 52.71057 50.13190       66.13850 
1 1 1 2   19 18 o 279.7393 78.51340 16.54229       8.878076      0.000000       0.000000      16.54229       8.878076  ?        ?        279.7393 78.51340 0.000000       78.51340 
1 1 1 2   19 19 o 628.1098 23.27457 77.04186       5.677344      65.57156       7.764939      90.21673       8.321920  576.4406 34.84995 678.0855 31.60175 -101.6450      47.04455 
1 1 1 2   19 20 o 961.4039 19.15066 180.2890       7.150189      201.3648       10.31386      160.7868       9.921345  1014.061 26.18962 905.5357 28.21220 108.5254       38.49448 
1 1 1 2   19 21 o 682.2197 28.12818 91.41319       7.452361      94.48764       12.93066      89.88408       9.119217  684.1776 48.99001 673.5449 34.98330 10.63275       60.19844 
1 1 1 2   19 22 o 472.2760 46.58219 45.29469       8.432370      0.000000       0.000000      45.29469       8.432370  ?        ?        472.2760 46.58219 0.000000       46.58219 
1 1 1 2   19 23 f 327.4866 43.98863 21.96474       5.453053      21.69048       7.337066      22.30317       8.150475  317.9591 61.64388 319.6198 67.76575 -1.660645      91.60876 
1 1 1 2   19 24 o 551.6675 26.52031 60.07857       5.681774      59.18217       8.181466      60.91363       7.896589  541.0607 39.20234 550.0312 37.18630 -8.970459      54.03373 
1 1 1 2   19 25 o 364.0569 37.29819 26.98944       5.198889      32.34966       7.870100      22.83939       6.924935  390.0668 53.35199 324.8403 56.97046 65.22644       78.05170 
1 1 1 2   19 26 o 170.1339 64.45539 5.403615       5.851666      -4.402023      6.815124      32.91649       11.41573  124.6128 57.99421 368.2308 81.93996 -243.6180      100.3867 
1 1 1 2   19 27 o 220.0780 65.72442 11.23961       6.047123      19.62372       7.173882      -9.341068      11.23972  291.6377 65.00114 147.1636 70.26688 144.4740       95.72137 
1 1 1 2   20 0  o 531.4728 28.63557 55.27686       5.888565      60.16352       7.481530      47.32093       9.546179  553.5112 34.98455 487.2668 51.21326 66.24438       62.02191 
1 1 1 2   20 1  o 690.8099 20.29672 92.89262       5.445182      90.41474       6.373810      99.58656       10.47612  681.1925 24.09358 712.0921 38.01981 -30.89960      45.01118 
1 1 1 2   20 2  o 198.5427 50.63744 8.065097       3.916682      12.57052       4.533029      -5.205930      7.779884  248.5542 48.70298 139.0536 63.72433 109.5006       80.20456 
1 1 1 2   20 3  o 349.7408 27.03924 23.99239       3.644030      24.52813       4.781806      23.25031       5.627805  352.4054 35.41945 341.5316 43.41158 10.87381       56.02769 
1 1 1 2   20 4  o 1041.393 15.55869 210.8733       6.292390      210.4521       8.572765      211.3654       9.265070  1039.739 21.23091 1041.776 22.90057 -2.036987      31.22799 
1 1 1 2   20 5  o 447.7228 22.80764 39.13712       3.952543      38.19439       5.150539      40.48761       6.164635  441.3663 30.23081 453.7189 35.26287 -12.35257      46.44752 
1 1 1 2   20 6  o 558.6273 19.56114 60.72377       4.243697      59.49380       5.494406      62.54243       6.681128  552.5255 25.60592 565.2618 30.54832 -12.73633      39.86055 
1 1 1 2   20 7  o 1257.668 15.28327 307.5310       7.464667      307.4144       8.419787      307.9593       16.13601  1257.209 17.24510 1255.570 33.09233 1.639038       37.31616 
1 1 1 2   20 8  o 144.3258 48.75790 3.822308       3.245557      1.950589       3.568740      12.77491       7.804935  127.5038 49.80148 250.6845 74.62387 -123.1807      89.71572 
1 1 1 2   20 9  o 1136.936 15.35117 251.3382       6.778060      247.6255       7.540777      266.9564       15.46629  1128.311 17.20915 1168.623 34.07876 -40.31165      38.17744 
1 1 1 2   20 10 o 934.3142 17.92018 169.8366       6.502244      160.8956       7.372424      201.1465       13.79615  909.0712 20.88259 1014.010 35.03384 -104.9385      40.78545 
1 1 1 2   20 11 o 1484.537 16.32438 428.6833       9.411434      426.7670       10.63446      435.6062       20.21343  1480.851 18.49168 1491.853 34.88880 -11.00220      39.48634 
1 1 1 2   20 12 o 670.2028 19.31280 87.44694       5.026658      86.05296       5.693934      92.37064       10.70113  664.5753 22.06177 684.6464 40.42647 -20.07111      46.05454 
1 1 1 2   20 13 o 244.9785 47.94530 12.24504       4.398127      11.34744       5.039450      15.11371       9.009118  234.4422 56.10020 270.0632 80.12443 -35.62097      97.81184 
1 1 1 2   20 14 o 552.0932 21.71459 59.40509       4.655776      65.01231       7.229708      55.43209       6.085635  575.3588 32.48880 531.6673 29.59113 43.69147       43.94493 
1 1 1 2   20 15 f 770.5429 18.73538 115.6198       5.606441      116.0576       8.389024      115.2663       7.536697  770.6408 28.03054 768.4697 25.25377 2.171143       37.72882 
1 1 1 2   20 16 o 562.9269 25.83536 61.88720       5.647998      60.51912       7.508104      63.67054       8.572201  554.2629 35.06149 567.5854 39.12859 -13.32251      52.53907 
1 1 1 2   20 17 o 597.6431 26.00163 69.79890       6.034906      88.50218       8.034762      45.58994       9.141178  672.1120 30.78246 476.4750 50.15391 195.6370       58.84705 
1 1 1 2   20 18 o 578.6036 24.09112 65.41270       5.413349      59.93097       7.814046      70.47138       7.506477  550.3929 36.76896 598.2075 32.43263 -47.81458      49.02889 
1 1 1 2   20 19 o 166.0484 59.18673 4.923903       4.813130      -2.377710      6.648668      12.96394       6.976767  136.2249 61.00017 247.2077 69.67696 -110.9829      92.60616 
1 1 1 2   20 20 o 263.6509 51.66834 14.45966       5.101146      7.956916       6.985977      21.88706       7.466159  203.4386 71.42699 322.1447 61.92810 -118.7061      94.53520 
1 1 1 2   20 21 o 387.4708 52.89068 31.01592       7.750885      0.000000       0.000000      31.01592       7.750885  ?        ?        387.4708 52.89068 0.000000       52.89068 
1 1 1 2   20 22 o 154.7159 63.31806 2.458166       6.051509      -8.271168      10.64501      7.581244       7.355716  152.2284 71.37814 199.6431 72.90004 -47.41475      102.0257 
1 1 1 2   20 23 o 537.3134 27.66387 57.20296       5.752971      62.40473       7.959188      51.51205       8.324993  556.9669 37.00753 502.6978 43.05868 54.26901       56.77682 
1 1 1 2   20 24 o 420.7992 33.26535 35.63407       5.391870      33.99955       7.891807      37.06501       7.384010  401.2239 51.86177 422.8329 45.69373 -21.60898      69.11990 
1 1 1 2   20 25 o 237.0007 53.51738 12.30498       4.809237      11.04065       6.829305      13.54877       6.773613  219.6573 70.57478 241.9465 68.81673 -22.28926      98.57252 
1 1 1 2   20 26 o 183.6492 65.26814 7.196773       5.848930      9.521619       6.965207      1.636629       10.77159  205.0635 71.35863 177.9941 78.79455 27.06946       106.3044 
1 1 1 2   21 0  o 528.2878 24.53354 54.37719       5.033370      53.07954       5.742493      58.67950       10.45616  520.8707 28.49653 543.6705 50.08641 -22.79980      57.62552 
1 1 1 2   21 1  o 370.7385 31.87593 27.03646       4.544798      30.00705       5.233836      17.92999       9.163766  390.2471 34.90290 293.6897 78.73553 96.55734       86.12489 
1 1 1 2   21 2  o 561.0023 22.81732 61.29057       4.971156      67.72263       5.898601      45.52330       9.235328  589.4688 25.76678 478.2421 50.48836 111.2267       56.68335 
1 1 1 2   21 3  o 283.9958 34.74311 15.99737       3.751944      16.22529       4.876773      15.66681       5.873168  283.9412 45.78290 276.7408 56.55748 7.200378       72.76553 
1 1 1 2   21 4  f 330.7158 30.28796 21.52338       3.846823      26.68616       5.090179      14.64794       5.874103  367.6419 36.11796 267.1196 58.26503 100.5223       68.55160 
1 1 1 2   21 5  o 871.8934 16.61346 147.8447       5.625376      155.9736       7.774892      138.9140       8.149272  894.9725 22.36952 844.3314 24.85295 50.64105       33.43747 
1 1 1 2   21 6  o 727.9000 17.79677 103.0715       5.030846      99.08220       6.554015      108.7934       7.849265  713.1726 23.66382 746.9337 27.05945 -33.76105      35.94704 
1 1 1 2   21 7  o 712.6772 20.53102 98.87380       5.682395      96.78664       6.636134      104.6101       11.00151  704.7641 24.24618 729.6559 38.96549 -24.89178      45.89321 
1 1 1 2   21 8  o 945.0602 15.79009 173.7005       5.795249      173.1640       6.502385      175.7726       12.77859  943.4040 17.74790 947.8242 34.71579 -4.420166      38.98941 
1 1 1 2   21 9  o 668.7673 17.95128 87.03257       4.662280      85.09407       5.153472      95.77209       10.94236  661.0999 20.07265 697.3279 40.58147 -36.22797      45.27436 
1 1 1 2   21 10 o 785.0715 17.15670 119.9271       5.230833      118.7999       5.811714      124.7352       12.00320  781.1738 19.15705 797.2704 38.76710 -16.09662      43.24211 
1 1 1 2   21 11 o 683.1483 18.78003 90.85787       4.982408      88.83289       5.564039      99.05277       11.19315  675.2491 21.21770 708.7177 40.84077 -33.46863      46.02346 
1 1 1 2   21 12 o 248.7383 46.34763 12.58976       4.312389      13.63823       4.916170      9.090498       8.981285  258.1711 50.84257 225.4245 80.79681 32.74663       95.46251 
1 1 1 2   21 13 o 724.5180 20.09249 102.2589       5.653417      101.5988       6.506664      104.2925       11.41994  721.7855 23.21252 726.9849 40.61160 -5.199341      46.77737 
1 1 1 2   21 14 o 717.5431 24.03012 100.4595       6.696256      106.1816       8.225566      89.21596       11.53026  736.9317 28.74158 670.8830 44.50790 66.04871       52.98142 
1 1 1 2   21 15 o 875.8864 20.53880 149.5321       6.986359      151.5621       9.222423      146.7983       10.70234  880.6106 26.96703 865.5563 31.83870 15.05432       41.72438 
1 1 1 2   21 16 o 411.7776 34.55099 33.53805       5.474165      33.46073       7.492755      33.62656       8.017093  407.8190 48.24411 407.7858 51.79213 0.3320313E-01  70.78078 
1 1 1 2   21 17 o 434.7348 29.45491 37.22202       4.943560      33.00061       7.295584      40.80582       6.722075  404.6374 47.32024 453.0764 38.57065 -48.43903      61.04834 
1 1 1 2   21 18 o 280.1095 46.50042 16.04323       4.881005      21.61914       7.255567      11.43371       6.596913  321.5596 60.31645 232.9838 68.41425 88.57576       91.20628 
1 1 1 2   21 19 o 821.9874 19.93299 131.9811       6.363055      127.7492       9.131993      135.9746       8.871113  805.9761 29.17530 832.1211 27.45134 -26.14496      40.05964 
1 1 1 2   21 20 o 369.4680 43.19892 27.69393       6.081351      13.17583       10.26568      35.54350       7.548411  249.8215 86.64809 417.4332 47.40358 -167.6117      98.76736 
1 1 1 2   21 21 o 364.3808 43.43779 27.08378       6.025682      17.41258       10.07667      32.46700       7.517926  276.6084 85.31090 396.4997 49.93056 -119.8913      98.84842 
1 1 1 2   21 22 o 481.3196 34.89569 46.48350       6.478481      33.61000       11.12299      53.09278       7.969853  385.5115 76.98947 511.8115 40.42613 -126.3000      86.95776 
1 1 1 2   21 23 o 177.0574 61.61571 6.363575       5.193094      12.05369       7.546143      1.244411       7.157545  230.7366 74.19175 154.8008 66.41550 75.93585       99.57628 
1 1 1 2   21 24 o 154.1338 58.87985 4.102187       4.908551      11.86004       7.017348      -3.330095      6.868524  226.7839 71.39884 129.5762 59.56305 97.20773       92.98145 
1 1 1 2   21 25 o 425.5738 31.41965 36.58516       5.156111      39.26305       7.407195      34.06783       7.181716  432.6400 44.73176 401.2492 46.97696 31.39078       64.86729 
1 1 1 2   22 0  o 866.0186 19.65040 145.9739       6.608860      146.0714       10.41645      145.9082       8.550149  864.7922 31.01559 865.1349 25.44848 -0.3426514     40.11972 
1 1 1 2   22 1  o 981.5825 18.88619 187.4977       7.199447      188.3876       11.41429      186.9097       9.277706  982.3000 29.92103 979.3317 24.39399 2.968323       38.60486 
1 1 1 2   22 2  o 702.5671 40.69094 97.13299       11.05478      0.000000       0.000000      97.13299       11.05478  ?        ?        702.5671 40.69094 0.000000       40.69094 
1 1 1 2   22 3  f 1037.431 18.74665 209.4435       7.552856      214.6575       9.123774      198.0900       13.46340  1049.778 22.37944 1006.311 34.45043 43.46667       41.08128 
1 1 1 2   22 4  o 342.6776 34.98248 23.21286       4.590195      27.15740       5.343406      12.10485       8.966805  370.4450 37.66603 247.9149 80.96821 122.5301       89.30051 
1 1 1 2   22 5  o 419.4995 26.10529 34.45473       4.231845      34.15721       5.526191      34.87658       6.580355  416.3989 34.48374 419.5869 40.90322 -3.187988      53.49955 
1 1 1 2   22 6  f 633.3852 19.98537 78.11020       4.915958      67.64997       6.290510      94.52090       7.879144  588.7403 27.51276 695.6920 29.16313 -106.9517      40.09289 
1 1 1 2   22 7  o 210.4535 54.06967 9.105992       4.442739      9.893415       5.137640      6.771438       8.846303  219.3120 59.02141 209.7896 79.30507 9.522400       98.85757 
1 1 1 2   22 8  o 1035.383 15.88234 208.5444       6.386217      208.7022       7.168362      207.9372       14.05973  1035.528 17.82502 1030.197 35.14218 5.331543       39.40437 
1 1 1 2   22 9  o 940.5552 16.27731 172.1219       5.945591      170.0257       6.628784      180.7480       13.44664  934.5681 18.26396 960.0893 36.06403 -25.52118      40.42507 
1 1 1 2   22 10 o 594.0870 23.39164 68.82586       5.396831      78.55406       6.333932      43.05093       10.30993  634.4047 25.70863 461.2266 58.90427 173.1781       64.27010 
1 1 1 2   22 11 o 1294.357 16.37159 326.0166       8.229486      322.5510       9.240851      339.3001       18.09174  1287.078 18.48754 1315.274 35.41898 -28.19543      39.95364 
1 1 1 2   22 12 o 1087.356 16.87401 230.1277       7.125540      225.4583       7.967261      248.7899       15.92788  1075.915 19.06790 1125.724 36.43325 -49.80908      41.12136 
1 1 1 2   22 13 o 343.6120 35.79860 23.42626       4.706938      27.98342       5.489735      10.77706       9.146103  375.3599 38.19158 237.1058 81.81239 138.2541       90.28767 
1 1 1 2   22 14 o 127.2430 56.64808 -1.899343      5.645237      -1.899343      5.645237      0.000000       0.000000  127.2430 56.64808 ?        ?        0.000000       56.64808 
1 1 1 2   22 15 o 489.9892 40.90460 47.75136       7.712542      47.75136       7.712542      0.000000       0.000000  489.9892 40.90460 ?        ?        0.000000       40.90460 
1 1 1 2   22 16 o 228.7621 53.47983 10.90853       4.666062      10.79603       7.184228      10.99061       6.136546  228.8711 72.26474 228.9890 65.62593 -0.1179199     97.61636 
1 1 1 2   22 17 o 651.3770 22.00565 82.93514       5.566658      97.85847       8.520586      71.82220       7.352770  705.2382 31.11040 603.2973 31.49201 101.9409       44.26741 
1 1 1 2   22 18 o 889.7278 19.07766 154.5892       6.591893      163.0179       9.835916      147.7166       8.881641  910.7653 27.80868 867.4939 26.36324 43.27136       38.31897 
1 1 1 2   22 19 o 618.0985 27.10802 75.15663       6.507041      68.92208       11.38025      78.18503       7.931504  580.5436 50.99326 627.8075 32.64388 -47.26385      60.54697 
1 1 1 2   22 20 o 244.0073 60.25933 12.87104       5.676389      22.56348       10.06582      8.351401       6.873603  314.2897 81.70966 203.2755 70.87929 111.0142       108.1681 
1 1 1 2   22 21 o 169.5097 64.23524 4.946686       5.812690      -9.068602      10.01642      12.06317       7.137467  143.0346 67.73116 233.0092 71.78815 -89.97462      98.69674 
1 1 1 2   22 22 o 217.3607 65.76707 10.51392       6.025922      7.242140       10.99345      11.91915       7.204694  209.3083 85.46449 229.5033 72.35726 -20.19498      111.9810 
1 1 1 2   22 23 o 446.1622 32.36279 40.13123       5.569325      33.62143       7.887768      46.60303       7.864712  396.5149 52.51532 474.3946 43.16101 -77.87970      67.97596 
1 1 1 2   22 24 o 364.2279 37.30446 27.27022       5.202246      39.96609       7.416785      14.97504       7.298806  436.8915 44.32713 251.0656 71.44324 185.8259       84.07754 
1 1 1 2   23 0  o 106.2789 47.39718 -1.534605      3.970518      -0.4504655     5.190229      -3.064255      6.165096  130.0596 56.18392 128.5801 58.05794 1.479477       80.79206 
1 1 1 2   23 1  o 901.2856 25.87488 158.4930       9.056674      0.000000       0.000000      158.4930       9.056674  ?        ?        901.2856 25.87488 0.000000       25.87488 
1 1 1 2   23 2  o 363.3759 34.51042 26.08666       4.811616      22.66709       7.062823      29.04825       6.572869  333.5324 56.54715 381.4119 45.25749 -47.87949      72.42803 
1 1 1 2   23 3  o 1223.555 16.56158 291.2817       7.869611      301.4869       11.02942      280.6982       11.23197  1243.686 22.83568 1199.781 24.10603 43.90442       33.20495 
1 1 1 2   23 4  o 301.6791 41.20476 18.21182       4.701245      14.49206       5.446256      29.08658       9.312151  265.6447 54.61652 375.9525 66.19859 -110.3078      85.82085 
1 1 1 2   23 5  f 172.5281 57.20394 5.659381       4.469477      7.600339       5.216296      0.2991911      8.668505  195.7707 61.54574 171.6228 73.34660 24.14787       95.74760 
1 1 1 2   23 6  o 707.2778 19.65606 97.42400       5.399015      94.79348       6.985546      101.3265       8.508449  696.9171 25.81019 719.8162 30.43693 -22.89911      39.90705 
1 1 1 2   23 7  o 492.3763 26.82737 47.47912       5.110486      43.94291       5.886740      58.29783       10.29659  472.7145 32.25890 540.6014 49.59730 -67.88693      59.16526 
1 1 1 2   23 8  o 337.4901 31.04466 22.47088       4.023272      22.38420       4.481317      22.83110       9.134910  336.1489 34.83339 329.9130 73.21062 6.235901       81.07502 
1 1 1 2   23 9  f 498.4024 22.88283 48.44080       4.429124      46.10809       4.918589      58.44238       10.18462  485.2381 26.19811 541.2517 48.98339 -56.01361      55.54920 
1 1 1 2   23 10 o 641.8926 23.01301 80.36331       5.736722      74.21117       6.611192      99.11391       11.54183  616.2298 27.62543 707.9541 42.17105 -91.72430      50.41391 
1 1 1 2   23 11 o 779.4332 18.44088 118.3206       5.581984      119.1148       6.254958      115.2143       12.37069  781.7535 20.60281 763.2892 41.89294 18.46429       46.68505 
1 1 1 2   23 12 f 576.7780 22.84346 64.91512       5.116802      63.82398       5.735843      69.16742       11.32318  571.5188 25.84275 587.9481 50.06770 -16.42932      56.34378 
1 1 1 2   23 13 o 546.8332 28.31077 58.69627       5.991617      58.69627       5.991617      0.000000       0.000000  546.8332 28.31077 ?        ?        0.000000       28.31077 
1 1 1 2   23 14 o 237.6434 62.13924 11.86755       5.799670      11.86755       5.799670      0.000000       0.000000  237.6434 62.13924 ?        ?        0.000000       62.13924 
1 1 1 2   23 15 o 711.9797 22.32103 99.06764       6.171771      98.39964       7.168348      100.9816       12.13371  708.7532 26.04330 710.9354 44.16606 -2.182251      51.27275 
1 1 1 2   23 16 f 358.2018 43.95137 25.96424       5.985763      24.75908       7.360135      28.31839       10.28678  345.1057 56.90023 361.4504 75.70821 -16.34473      94.70676 
1 1 1 2   23 17 o 723.0322 21.04231 102.2543       5.908524      110.5251       8.860826      95.63243       7.928519  748.7247 30.47362 696.8561 29.29685 51.86859       42.27230 
1 1 1 2   23 18 o 235.3928 59.40796 11.89009       5.431087      1.595987       10.31309      15.84052       6.388760  185.1605 79.58961 271.2042 62.00849 -86.04367      100.8938 
1 1 1 2   23 19 o 352.6709 37.73266 25.13709       5.087728      13.30686       7.605254      34.72014       6.844925  244.9356 73.83396 412.6876 43.35714 -167.7520      85.62299 
1 1 1 2   23 20 o 242.7287 61.38705 12.94278       5.790435      16.51526       10.46010      11.36430       6.952969  265.8148 87.48174 226.5551 71.02901 39.25974       112.6862 
1 1 1 2   23 21 o 396.3228 40.89690 32.23031       6.204116      36.37097       11.31059      30.44832       7.419988  397.4061 76.05691 379.1892 51.73740 18.21689       91.98593 
1 1 1 2   23 22 o 326.4460 48.74010 22.64163       5.989829      32.05408       10.86695      18.53398       7.178820  366.8869 78.63284 284.8484 66.16089 82.03851       102.7637 
1 1 1 2   23 23 f 86.17737 42.30471 -8.898420      4.869424      -8.753685      6.812486      -9.049613      6.962786  109.8974 53.04798 110.6886 53.47823 -0.7912064     75.32602 
1 1 1 2   24 0  o 1387.986 20.44602 375.3470       11.02102      335.1190       17.54627      401.5593       14.16360  1307.421 34.55742 1434.315 25.42737 -126.8938      42.90416 
1 1 1 2   24 1  o 346.5211 33.63667 23.74354       4.469562      22.07372       5.915180      25.96558       6.823516  331.0220 47.36343 358.7549 50.36330 -27.73288      69.13579 
1 1 1 2   24 2  o 1099.326 17.05327 235.2164       7.280518      228.4208       9.773678      243.6881       10.91263  1082.243 23.25441 1117.415 25.14705 -35.17224      34.25116 
1 1 1 2   24 3  o 403.3277 29.03143 31.96362       4.516893      26.82487       5.800125      39.88275       7.200249  366.9105 41.43078 448.1740 41.85320 -81.26349      58.89142 
1 1 1 2   24 4  o 359.3589 37.68391 25.63237       5.180846      30.98201       7.537339      20.84127       7.133016  392.3381 50.65136 318.1957 59.92178 74.14240       78.46133 
1 1 1 2   24 5  o 121.1426 52.74830 -0.7026544     4.647897      1.740982       5.338192      -8.360730      9.450084  145.9913 59.57637 145.2880 67.84152 0.7032776      90.28741 
1 1 1 2   24 6  o 628.8152 23.99904 77.14703       5.860638      75.27590       6.837337      82.32906       11.37849  620.5550 28.37127 644.0128 45.79327 -23.45782      53.86977 
1 1 1 2   24 7  o 240.4764 53.18215 11.92888       4.834873      8.627979       5.539692      22.48137       9.904830  206.6242 63.17589 325.5544 79.11754 -118.9301      101.2461 
1 1 1 2   24 8  o 115.8677 51.77227 -1.853216      4.761680      -0.2151352E-01 5.521280      -7.170282      9.406940  136.4057 58.42244 148.4429 68.75780 -12.03711      90.22647 
1 1 1 2   24 9  o 899.2348 19.91349 157.5872       6.954221      151.2338       8.003699      177.1604       14.04807  880.3118 23.41134 948.8748 38.12237 -68.56299      44.73708 
1 1 1 2   24 10 o 807.3835 18.31093 126.9897       5.741407      123.4367       6.383489      142.0338       13.13537  795.6564 20.65877 848.7416 39.85096 -53.08521      44.88745 
1 1 1 2   24 11 o 367.7869 31.48700 26.72700       4.453979      27.44307       4.939865      23.61473       10.29850  372.0681 34.58305 331.3886 80.75991 40.67953       87.85300 
1 1 1 2   24 12 o 590.3799 25.48753 68.18791       5.843693      68.18791       5.843693      0.000000       0.000000  590.3799 25.48753 ?        ?        0.000000       25.48753 
1 1 1 2   24 13 f 930.6041 20.80924 169.0945       7.520544      169.0945       7.520544      0.000000       0.000000  930.6041 20.80924 ?        ?        0.000000       20.80924 
1 1 1 2   24 14 o 144.7865 57.88663 2.378775       4.924779      0.4284042      5.651532      8.532957       10.03905  139.3232 59.37466 222.3451 84.37884 -83.02193      103.1753 
1 1 1 2   24 15 f 616.7065 24.25200 74.54067       5.808368      76.18359       6.643383      69.20979       11.96688  622.6499 27.47371 581.7811 53.56723 40.86884       60.20177 
1 1 1 2   24 16 o 531.2616 27.40518 55.67238       5.634910      47.48459       6.379968      84.71471       12.01575  488.5005 33.83834 645.7863 48.25965 -157.2858      58.94088 
1 1 1 2   24 17 f 743.7792 30.32871 109.3816       8.760440      113.6899       12.20898      104.8093       12.57750  751.0720 42.02576 718.9496 45.27853 32.12231       61.77629 
1 1 1 2   24 18 o 343.1943 37.96497 23.86834       4.975258      15.87727       7.415892      30.40900       6.709217  266.5219 70.54450 384.4258 45.84406 -117.9039      84.13206 
1 1 1 2   24 19 o 376.4660 40.10482 28.93464       5.773138      24.59887       11.07283      30.55326       6.765459  320.1033 86.85874 383.9411 46.30860 -63.83780      98.43235 
1 1 1 2   24 20 o 161.3666 62.15788 4.407042       5.499786      -5.638015      10.61616      8.091942       6.429900  155.6286 72.41325 195.6088 68.53384 -39.98016      99.70239 
1 1 1 2   24 21 o 550.7776 30.63344 60.89594       6.526491      63.88175       12.31249      59.72918       7.696757  540.6274 59.63593 541.5634 36.81431 -0.9359131     70.08379 
1 1 1 2   24 22 o 318.1252 41.71936 21.16123       5.029979      23.05805       7.248758      19.39969       6.985475  320.6497 60.42747 291.4466 63.51206 29.20309       87.66562 
1 1 1 2   25 0  o 664.5489 23.67755 86.17637       6.110711      88.67143       7.420669      80.92024       10.77048  673.3802 28.37623 638.7949 43.67756 34.58527       52.08589 
1 1 1 2   25 1  o 512.7033 31.20399 51.66374       6.183482      57.62201       10.36104      48.36756       7.706340  536.6239 50.30413 493.9528 40.53022 42.67114       64.60034 
1 1 1 2   25 2  o 975.5232 21.79326 185.5605       8.256345      188.2695       13.90407      184.0851       10.26134  978.9225 36.57343 970.5048 27.22566 8.417786       45.59443 
1 1 1 2   25 3  o 296.2878 40.57382 17.60132       4.545958      19.93394       5.791886      13.85874       7.336416  313.5280 49.18657 257.3244 71.06736 56.20358       86.42852 
1 1 1 2   25 4  o 1247.481 17.29682 302.9953       8.379698      298.8252       11.25499      308.1821       12.55222  1237.481 23.41955 1256.066 25.73238 -18.58459      34.79412 
1 1 1 2   25 5  o 233.6175 57.37467 11.33833       5.167491      12.99500       7.270786      9.647350       7.345662  249.5494 71.40820 221.3817 73.33210 28.16769       102.3559 
1 1 1 2   25 6  o 853.9130 22.19057 142.2487       7.358852      151.3484       11.22537      135.3909       9.744925  878.3578 32.90797 831.4352 30.18020 46.92267       44.65176 
1 1 1 2   25 7  o 817.8552 21.53275 130.4780       6.839177      128.7671       7.968961      135.2615       13.32470  811.7755 25.27771 826.5671 41.64357 -14.79163      48.71499 
1 1 1 2   25 8  o 432.5166 32.42444 36.92239       5.406687      33.85297       6.179527      46.94287       11.16532  412.5193 39.03718 478.8986 61.45198 -66.37927      72.80280 
1 1 1 2   25 9  o 256.8703 52.11451 13.64346       5.021036      14.61803       5.917408      11.13761       9.488615  264.3782 59.11674 239.0251 83.28144 25.35316       102.1302 
1 1 1 2   25 10 o 1111.064 20.09360 240.8754       8.670111      237.2125       10.29473      249.8121       16.08011  1101.421 24.06766 1125.066 36.80299 -23.64502      43.97400 
1 1 1 2   25 11 o 191.5064 66.12313 7.011888       5.975031      7.011888       5.975031      0.000000       0.000000  191.5064 66.12313 ?        ?        0.000000       66.12313 
1 1 1 2   25 12 o 719.3140 23.13369 101.2429       6.462364      101.2429       6.462364      0.000000       0.000000  719.3140 23.13369 ?        ?        0.000000       23.13369 
1 1 1 2   25 13 o 390.2090 38.93837 30.55121       5.821896      28.26955       6.946827      35.93521       10.67122  371.6045 49.35802 410.4195 69.42712 -38.81506      85.18414 
1 1 1 2   25 14 o 561.7556 25.03082 61.94276       5.460726      61.80470       6.205365      62.41668       11.49694  559.4962 28.65511 550.6870 54.47309 8.809143       61.55025 
1 1 1 2   25 15 o 373.1771 36.18435 27.95877       5.178120      25.40122       5.911551      36.38998       10.73333  352.7288 44.12026 409.8907 69.93734 -57.16187      82.69117 
1 1 1 2   25 16 o 250.5331 60.33939 13.60783       5.800813      12.80999       7.131368      15.16809       9.972626  240.7961 71.25175 259.3234 85.42250 -18.52728      111.2376 
1 1 1 2   25 17 o 552.4125 31.03454 60.80748       6.630921      60.56059       8.220995      61.26718       11.21756  547.3231 38.93085 540.8071 54.13784 6.515991       66.68221 
1 1 1 2   25 18 o 537.6666 38.17742 58.62826       7.919817      67.81161       11.31848      49.81865       11.08577  568.5772 51.82845 480.1655 60.81232 88.41174       79.90199 
1 1 1 2   25 19 o 180.5223 62.69296 6.784633       5.374945      1.742445       10.31927      8.661878       6.296507  178.8412 78.21353 199.5050 67.91006 -20.66380      103.5815 
1 1 1 2   25 20 o 154.1305 60.46675 3.847439       5.278955      4.529046       10.51692      3.617864       6.103564  190.0060 80.98536 158.4050 64.04910 31.60100       103.2517 
1 1 1 2   26 0  o 546.4298 40.14907 59.24773       8.460303      0.000000       0.000000      59.24773       8.460303  ?        ?        546.4298 40.14907 0.000000       40.14907 
1 1 1 2   26 1  o 655.1705 22.11449 83.77330       5.626773      91.20302       7.413898      73.67992       8.641289  682.5739 27.96849 610.7103 36.60351 71.86365       46.06575 
1 1 1 2   26 2  o 754.9964 29.24809 111.6751       8.575714      101.3934       11.54933      124.3104       12.80313  714.9608 41.77730 791.8788 41.78008 -76.91797      59.08399 
1 1 1 2   26 3  o 263.6902 60.41803 14.54699       6.054452      22.84618       9.631172      9.124497       7.785035  326.7941 77.12965 218.2018 75.46906 108.5923       107.9100 
1 1 1 2   26 4  o 327.3446 38.00791 21.40367       4.741849      24.23696       5.946385      16.45531       7.858470  346.7254 45.23914 278.1849 72.13538 68.54050       85.14748 
1 1 1 2   26 5  o 90.52560 43.48531 -6.339191      4.448782      -9.186530      5.481273      -0.8427248     7.615591  95.93884 46.60987 154.2831 67.33947 -58.34427      81.89679 
1 1 1 2   26 6  o 280.5261 45.41087 16.02013       4.778138      14.54538       5.922644      18.76933       8.086446  263.4120 59.32302 296.6238 71.11910 -33.21182      92.61289 
1 1 1 2   26 7  o 707.9475 24.92132 98.07297       6.851728      93.99977       10.06968      101.5847       9.349917  688.6805 37.79491 718.2823 33.51850 -29.60181      50.51678 
1 1 1 2   26 8  o 105.1682 47.57401 -2.095217      4.161630      -3.052587      4.590691      2.320129       9.858720  106.4763 48.85227 188.4283 79.26910 -81.95205      93.11356 
1 1 1 2   26 9  o 618.1800 25.86567 74.90417       6.209644      81.40797       7.337905      58.49712       11.65477  643.5927 29.35844 534.1320 57.06922 109.4608       64.17799 
1 1 1 2   26 10 o 215.9140 66.04110 9.766447       6.052917      9.766447       6.052917      0.000000       0.000000  215.9140 66.04110 ?        ?        0.000000       66.04110 
1 1 1 2   26 11 f 531.9354 34.21480 56.21133       7.030573      56.21133       7.030573      0.000000       0.000000  531.9354 34.21480 ?        ?        0.000000       34.21480 
1 1 1 2   26 12 o 472.4036 31.89792 44.30124       5.817710      54.44221       7.029954      22.26337       10.36329  522.8489 34.82085 314.0304 83.52392 208.8185       90.49164 
1 1 1 2   26 13 o 114.7436 52.72880 -3.386264      5.377173      -3.093636      6.365437      -4.115365      10.04763  128.0919 58.29472 160.4068 73.09344 -32.31493      93.49290 
1 1 1 2   26 14 o 611.0834 27.45096 73.66864       6.514574      69.71964       7.725469      83.38809       12.11998  591.2009 33.78841 637.4576 49.34224 -46.25677      59.80229 
1 1 1 2   26 15 o 353.9713 54.23289 26.47220       7.217628      33.08519       9.944828      19.11198       10.49164  387.9034 68.52124 284.8774 86.91058 103.0260       110.6734 
1 1 1 2   26 16 o 360.0620 44.04779 26.78243       6.030835      21.67106       7.333786      37.45841       10.59896  314.2189 62.30003 410.7471 68.88358 -96.52823      92.87756 
1 1 1 2   26 17 o 290.8514 55.08744 18.33147       5.994505      19.16799       7.423172      16.76336       10.16339  290.8186 67.09261 263.1505 86.21407 27.66818       109.2441 
1 1 1 2   26 18 o 130.9153 57.61086 -0.3285491     5.676085      -4.089813      7.216916      5.771352       9.190648  130.0465 60.23242 190.3274 77.97777 -60.28093      98.53160 
1 1 1 2   26 19 o 168.9140 67.56513 4.651101       6.712779      0.1988555      10.19889      8.054054       8.916437  169.6661 75.79298 200.4611 78.60233 -30.79501      109.1920 
1 1 1 2   27 0  o 452.5325 29.39830 40.38171       5.138538      34.69489       6.593866      49.17602       8.199847  416.1198 41.35080 495.4885 43.04080 -79.36871      59.68584 
1 1 1 2   27 1  o 250.8799 51.39647 13.07101       4.839200      12.15003       6.162345      14.55262       7.816079  239.4567 64.72291 260.5642 73.85695 -21.10750      98.20338 
1 1 1 2   27 2  o 86.17284 42.04631 -8.238372      4.595799      -9.202526      5.709831      -6.464605      7.744586  98.68365 47.85760 131.9748 61.55458 -33.29115      77.96997 
1 1 1 2   27 3  o 464.1958 43.09716 43.23304       7.680575      36.73207       9.788902      53.64534       12.38850  420.4129 61.79993 508.2624 64.19448 -87.84952      89.10759 
1 1 1 2   27 4  o 294.5820 56.82048 18.13056       6.264820      6.313731       9.490968      27.25473       8.339824  206.4795 81.05361 360.8950 61.72240 -154.4155      101.8791 
1 1 1 2   27 5  o 1415.681 21.32874 391.7048       11.72623      347.1988       17.77975      425.9673       15.60002  1325.868 34.53006 1473.266 27.26566 -147.3978      43.99706 
1 1 1 2   27 6  o 310.0555 41.72032 19.46601       4.896093      16.38468       6.014693      25.51811       8.429420  279.1257 57.40288 347.0389 64.93166 -67.91321      86.66725 
1 1 1 2   27 7  o 647.5665 22.72124 82.08591       5.714054      81.06682       7.295528      83.70317       9.190484  641.8370 29.26874 648.7982 36.62516 -6.961243      46.88349 
1 1 1 2   27 8  o 100.6853 46.19807 -2.695572      4.106245      -0.2842596     4.463033      -15.99367      10.48089  119.9147 51.95002 132.8196 64.51015 -12.90486      82.82731 
1 1 1 2   27 9  o 279.5063 52.37228 16.34223       5.475984      16.34223       5.475984      0.000000       0.000000  279.5063 52.37228 ?        ?        0.000000       52.37228 
1 1 1 2   27 10 o 320.9962 40.29788 20.90462       4.912820      20.90462       4.912820      0.000000       0.000000  320.9962 40.29788 ?        ?        0.000000       40.29788 
1 1 1 2   27 11 o 405.7527 29.89574 32.70788       4.677662      34.56581       5.233492      25.32844       10.43008  416.2921 32.63305 333.8810 81.21714 82.41113       87.52794 
1 1 1 2   27 12 o 417.3007 35.55920 34.97314       5.707768      34.35501       6.747818      36.52765       10.70091  410.4983 42.96415 408.4866 69.97215 2.011719       82.10981 
1 1 1 2   27 13 f 154.5912 61.01297 3.406213       5.405057      4.544070       6.460039      0.7505559      9.869094  170.8353 66.92718 175.4466 76.61503 -4.611343      101.7306 
1 1 1 2   27 14 o 270.2305 64.61468 16.26327       6.689304      14.63075       9.186686      18.10571       9.759485  251.3495 81.94836 276.3430 83.71579 -24.99353      117.1489 
1 1 1 2   27 15 o 183.1804 64.48968 6.884391       5.697294      5.598673       7.004512      9.397834       9.793540  179.4871 69.86362 215.4471 82.95792 -35.96005      108.4571 
1 1 1 2   27 16 o 155.3249 61.52062 3.690594       5.513537      -1.260355      6.736852      13.73354       9.594963  137.2449 61.43394 240.6145 83.75183 -103.3696      103.8677 
1 1 1 2   27 17 o 444.8599 35.60963 40.30933       6.100466      43.11487       7.577028      35.13941       10.28567  455.1529 43.39151 390.2851 70.45390 64.86783       82.74403 
1 1 1 2   28 0  o 125.0368 53.78818 0.8309302E-02  4.716913      1.210831       6.033512      -1.881985      7.564642  147.5285 62.03512 147.0844 65.52123 0.4441833      90.22964 
1 1 1 2   28 1  o 571.3253 25.35019 64.06287       5.624613      66.06512       7.257001      61.05051       8.901290  577.3505 32.49822 551.2381 41.89361 26.11237       53.02083 
1 1 1 2   28 2  o 180.9458 59.18921 6.585867       4.791048      9.179914       6.027374      2.134003       7.896056  209.6560 66.19054 169.9567 71.19045 39.69930       97.20735 
1 1 1 2   28 3  o 341.4358 38.01883 23.45892       4.955616      22.55602       6.236324      25.00589       8.162976  330.5474 50.15596 342.6707 63.68419 -12.12332      81.06353 
1 1 1 2   28 4  o 445.9270 30.21461 39.39814       5.201615      34.73882       6.586551      47.12002       8.479267  414.9245 41.42916 481.9079 45.86016 -66.98334      61.80234 
1 1 1 2   28 5  o 177.2819 70.12851 4.417747       7.155972      15.72482       9.015394      -14.83811      11.76498  266.2973 80.41388 146.0843 70.31156 120.2130       106.8181 
1 1 1 2   28 6  o 353.7413 47.77310 25.72395       6.395043      31.91919       9.965936      21.38725       8.338127  384.0807 69.36676 312.4571 70.40273 71.62357       98.83466 
1 1 1 2   28 7  o 274.2270 48.48080 15.65828       4.974206      12.93964       6.158285      20.76129       8.437177  244.0997 64.13029 306.4879 72.09235 -62.38812      96.48835 
1 1 1 2   28 8  o 107.6592 48.59775 -1.887719      4.316107      -1.887719      4.316107      0.000000       0.000000  107.6592 48.59775 ?        ?        0.000000       48.59775 
1 1 1 2   28 9  o 137.3536 53.67181 2.631254       4.146354      -0.1173054E-01 4.495497      17.69097       10.73097  121.2363 52.33067 276.5178 88.42730 -155.2815      102.7516 
1 1 1 2   28 10 o 155.9278 55.81334 4.524523       4.284389      4.868288       4.709087      2.872446       10.32337  161.9196 58.44996 188.1709 80.22077 -26.25122      99.25608 
1 1 1 2   28 11 o 355.5416 37.19804 25.63916       5.060121      27.07854       5.833044      21.26184       10.17211  363.3632 42.11673 299.8026 84.00418 63.56064       93.97086 
1 1 1 2   28 12 o 297.0034 40.58574 18.17428       4.558741      15.02238       5.097543      30.76419       10.18793  265.0861 51.37104 367.2476 73.99044 -102.1615      90.07536 
1 1 1 2   28 13 o 298.3826 46.18900 18.71210       5.179359      19.32700       6.122714      17.16500       9.711879  298.9961 54.74664 266.6556 84.00245 32.34045       100.2677 
1 1 1 2   28 14 o 188.4190 57.29766 7.762867       4.565438      7.670803       5.150577      8.100392       9.861996  188.0252 61.36332 206.2890 82.09753 -18.26381      102.4961 
1 1 1 2   28 15 o 99.77752 46.52959 -3.415823      4.422284      -4.688709      5.034403      0.8845663      9.253524  102.6049 48.41346 166.6259 73.43278 -64.02106      87.95587 
1 1 1 2   28 16 o 125.2596 52.26257 1.353583       4.231805      3.383509       4.875941      -4.842868      8.519025  147.0264 57.97437 138.6296 64.62511 8.396835       86.81838 
1 1 1 2   29 0  o 216.0300 55.63243 9.997071       4.695570      13.11842       6.253880      5.963660       7.109103  244.9683 64.75491 186.1961 70.92323 58.77220       96.03802 
1 1 1 2   29 1  o 475.5497 28.21866 44.79036       5.188157      56.29683       7.015890      30.90517       7.707037  530.9856 34.20494 384.9041 52.96219 146.0815       63.04738 
1 1 1 2   29 2  f 353.4440 35.82724 25.14324       4.849745      22.99018       6.426753      27.99089       7.391056  331.6997 51.56540 365.6278 53.64782 -33.92810      74.41155 
1 1 1 2   29 3  o 100.3045 47.05356 -4.305331      4.635135      -8.910847      5.948428      2.813516       7.395506  101.5701 49.15863 167.7960 69.47166 -66.22591      85.10513 
1 1 1 2   29 4  o 184.1553 57.82878 7.092059       4.606716      11.61215       6.054585      0.8777928      7.099144  230.4363 64.89455 154.3105 66.17290 76.12582       92.68310 
1 1 1 2   29 5  o 327.3358 38.38608 21.75589       4.787081      18.97895       6.181443      25.91676       7.566565  298.6119 55.34129 348.8063 57.88767 -50.19440      80.08521 
1 1 1 2   29 6  o 213.7128 72.56172 9.717709       7.188458      10.83741       9.236403      7.997604       11.44798  226.9364 81.86848 218.5622 87.94712 8.374176       120.1547 
1 1 1 2   29 7  o 210.3531 71.75510 9.415821       7.029850      3.244328       8.780423      20.43535       11.73280  178.9850 75.02680 291.0342 92.39898 -112.0492      119.0235 
1 1 1 2   29 8  o 325.8242 41.61185 21.82575       5.145114      29.23611       6.078468      3.099485       9.662736  377.4807 42.18542 183.4667 77.89774 194.0140       88.58707 
1 1 1 2   29 9  f 217.9523 49.62438 10.18740       4.106199      8.185193       4.540609      19.17480       9.620034  194.3110 56.67355 283.7045 82.41902 -89.39352      100.0239 
1 1 1 2   29 10 o 206.2009 52.07462 9.227043       4.171081      9.761271       4.608254      6.805419       9.811311  211.1257 55.47950 200.9172 81.21696 10.20845       98.35735 
1 1 1 2   29 11 o 317.8006 40.52237 20.87774       4.887423      18.59105       5.573407      28.48955       10.16859  294.8477 50.48964 347.5683 77.32912 -52.72061      92.35256 
1 1 1 2   29 12 o 202.8201 57.78419 9.134614       4.771747      10.68534       5.616689      5.111972       9.046263  217.4085 62.92402 185.9367 76.89656 31.47179       99.36052 
1 1 1 2   29 13 o 484.5832 26.41370 46.81734       4.952033      48.80183       5.676912      40.50109       10.12787  493.0473 29.78788 425.7348 63.17251 67.31244       69.84328 
1 1 1 2   30 0  o 434.6114 29.08162 37.65103       4.880162      36.68874       6.470521      38.92060       7.432156  424.3111 39.72945 434.4861 44.68331 -10.17499      59.79153 
1 1 1 2   30 1  o 118.8889 51.92766 -0.3360288     4.535701      0.1412598      5.938591      -1.004251      7.026734  137.6802 59.78598 142.7454 63.39334 -5.065125      87.13827 
1 1 1 2   30 2  o 432.0748 29.89415 37.27590       4.985347      35.10267       6.501797      40.37657       7.766202  414.2905 40.94701 441.7894 45.93704 -27.49887      61.53754 
1 1 1 2   30 3  o 210.5863 55.82975 9.665112       4.639944      8.464130       5.981247      11.48005       7.352827  198.7268 66.18856 226.2534 73.28616 -27.52661      98.75114 
1 1 1 2   30 4  o 793.4492 20.15023 123.6190       6.209077      129.0351       8.357757      116.9479       9.275735  807.2887 26.65833 765.8322 31.18794 41.45654       41.02870 
1 1 1 2   30 5  o 149.3787 59.19241 3.211622       5.106274      1.360118       5.840768      9.215722       10.51796  143.2975 60.68702 217.2001 85.30575 -73.90266      104.6899 
1 1 1 2   30 6  o 311.1904 46.03514 20.31269       5.395548      21.49966       6.062068      15.78783       11.83594  317.8612 50.82032 256.2675 92.64109 61.59372       105.6649 
1 1 1 2   30 7  o 136.3633 55.07608 2.295349       4.507819      1.443336       5.700958      3.716741       7.363458  141.9424 60.02598 169.1071 69.59985 -27.16472      91.90896 
1 1 1 2   30 8  o 150.7009 63.86882 1.802920       6.476811      0.3289632      8.799845      3.545221       9.567409  161.9914 71.48881 181.6332 77.32563 -19.64180      105.3086 
1 1 1 2   30 9  o 278.3580 54.52787 16.94090       5.683684      16.94090       5.683684      0.000000       0.000000  278.3580 54.52787 ?        ?        0.000000       54.52787 
1 1 1 2   30 10 o 182.2150 64.76072 6.972163       5.758391      11.39078       7.226785      -0.7120304     9.530179  221.4639 72.70642 162.0007 72.75254 59.46315       102.8550 
1 1 1 2   30 11 o 97.37934 45.94777 -4.281793      4.534628      -10.69768      5.175029      16.93522       9.410804  85.46951 42.27143 260.4669 82.75838 -174.9974      92.92913 
1 1 1 2   31 0  o 144.2171 55.74189 3.380874       4.434795      4.085217       5.854055      2.432230       6.793851  160.3086 63.42442 156.5769 65.83332 3.731659       91.41489 
1 1 1 2   31 1  o 476.7449 27.41767 45.35641       5.054886      32.98525       6.560437      63.43259       7.930139  398.3378 43.09555 558.2786 36.78253 -159.9408      56.65846 
1 1 1 2   31 2  o 215.8559 54.92958 10.29735       4.616086      11.78054       5.951580      8.057997       7.312999  227.3190 64.45374 196.3620 72.53130 30.95700       97.03131 
1 1 1 2   31 3  o 132.1548 56.36641 0.9356698      5.101009      4.417796       5.857634      -9.991788      10.37671  162.6274 63.72514 140.3873 67.16458 22.24010       92.58496 
1 1 1 2   31 4  o 263.4787 54.07166 15.21274       5.347330      15.11930       6.096808      15.52426       11.13188  258.6297 61.58480 250.3677 89.92893 8.261932       108.9950 
1 1 1 2   31 5  o 135.7497 57.07282 1.511906       5.105504      -2.864695      5.823442      16.05138       10.61416  119.8091 54.98880 253.4593 88.09538 -133.6503      103.8488 
1 1 1 2   31 6  o 259.6489 48.88014 14.53074       4.748007      17.54854       6.247607      10.40483       7.305125  279.9872 59.30281 213.2123 73.14215 66.77495       94.16261 
1 1 1 2   31 7  o 311.2536 40.83198 20.19282       4.816564      13.84916       6.137681      30.36212       7.771051  245.4371 63.80215 373.0267 55.31922 -127.5897      84.44484 
1 1 1 3   0  0  o 796.6321 14.74712 123.5042       4.558871      123.5042       4.558871      123.5042       4.558871  796.6321 14.74712 796.6321 14.74712 0.000000       0.000000 
1 1 1 3   0  1  o 518.5728 14.08530 52.38669       2.831905      52.38669       2.831905      52.38669       2.831905  518.5728 14.08530 518.5728 14.08530 0.000000       0.000000 
1 1 1 3   0  2  f 58.95131 35.70529 0.6368129      1.509590      0.6368129      1.509590      0.6368129      1.509590  58.95131 35.70529 58.95131 35.70529 0.000000       0.000000 
1 1 1 3   0  3  o 343.0637 16.74461 23.04237       2.218769      23.04237       2.218769      23.04237       2.218769  343.0637 16.74461 343.0637 16.74461 0.000000       0.000000 
1 1 1 3   0  4  o 626.1099 15.08229 76.31424       3.662489      76.31424       3.662489      76.31424       3.662489  626.1099 15.08229 626.1099 15.08229 0.000000       0.000000 
1 1 1 3   0  5  o 1275.938 18.00872 316.6128       8.919600      316.6128       8.919600      316.6128       8.919600  1275.938 18.00872 1275.938 18.00872 0.000000       0.000000 
1 1 1 3   0  6  o 251.3639 22.16827 12.56748       2.125312      12.56748       2.125312      12.56748       2.125312  251.3639 22.16827 251.3639 22.16827 0.000000       0.000000 
1 1 1 3   0  7  o 73.67240 42.50426 1.312037       1.961470      1.312037       1.961470      1.312037       1.961470  73.67240 42.50426 73.67240 42.50426 0.000000       0.000000 
1 1 1 3   0  8  f 93.34498 47.45623 2.492485       2.155461      2.492485       2.155461      2.492485       2.155461  93.34498 47.45623 93.34498 47.45623 0.000000       0.000000 
1 1 1 3   0  9  o 937.3971 17.47258 170.9299       6.355772      170.9299       6.355772      170.9299       6.355772  937.3971 17.47258 937.3971 17.47258 0.000000       0.000000 
1 1 1 3   0  10 o 719.7107 17.98916 100.8574       5.020920      100.8574       5.020920      100.8574       5.020920  719.7107 17.98916 719.7107 17.98916 0.000000       0.000000 
1 1 1 3   0  11 o 704.8311 18.69233 96.77415       5.108407      96.77415       5.108407      96.77415       5.108407  704.8311 18.69233 704.8311 18.69233 0.000000       0.000000 
1 1 1 3   0  12 o 954.5042 18.70474 177.3481       6.927573      177.3481       6.927573      177.3481       6.927573  954.5042 18.70474 954.5042 18.70474 0.000000       0.000000 
1 1 1 3   0  13 o 601.0928 20.99853 70.56083       4.888267      70.56083       4.888267      70.56083       4.888267  601.0928 20.99853 601.0928 20.99853 0.000000       0.000000 
1 1 1 3   0  14 o 401.1578 27.82154 31.83394       4.286479      31.83394       4.286479      31.83394       4.286479  401.1578 27.82154 401.1578 27.82154 0.000000       0.000000 
1 1 1 3   0  15 o 160.3931 77.20137 7.601286       5.568693      7.601286       5.568693      7.601286       5.568693  160.3931 77.20137 160.3931 77.20137 0.000000       0.000000 
1 1 1 3   0  16 o 98.71559 59.32395 2.015521       4.102779      2.015521       4.102779      2.015521       4.102779  98.71559 59.32395 98.71559 59.32395 0.000000       0.000000 
1 1 1 3   0  17 o 100.8090 60.76461 2.053683       4.330527      2.053683       4.330527      2.053683       4.330527  100.8090 60.76461 100.8090 60.76461 0.000000       0.000000 
1 1 1 3   0  18 o 203.3765 66.92293 10.42153       4.691579      10.42153       4.691579      10.42153       4.691579  203.3765 66.92293 203.3765 66.92293 0.000000       0.000000 
1 1 1 3   0  19 o 533.3375 40.46188 56.60082       8.269711      56.60082       8.269711      56.60082       8.269711  533.3375 40.46188 533.3375 40.46188 0.000000       0.000000 
1 1 1 3   0  20 o 90.81738 59.22425 -0.4373456     5.088502      -0.4373456     5.088502      -0.4373456     5.088502  90.81738 59.22425 90.81738 59.22425 0.000000       0.000000 
1 1 1 3   0  21 o 913.4651 23.89781 162.7073       8.464585      162.7073       8.464585      162.7073       8.464585  913.4651 23.89781 913.4651 23.89781 0.000000       0.000000 
1 1 1 3   0  22 o 556.2413 31.65334 60.88456       6.787062      60.88456       6.787062      60.88456       6.787062  556.2413 31.65334 556.2413 31.65334 0.000000       0.000000 
1 1 1 3   0  23 o 95.57381 63.09289 -1.192806      6.047946      -1.192806      6.047946      -1.192806      6.047946  95.57381 63.09289 95.57381 63.09289 0.000000       0.000000 
1 1 1 3   0  24 o 792.2338 27.31493 122.7622       8.381263      122.7622       8.381263      122.7622       8.381263  792.2338 27.31493 792.2338 27.31493 0.000000       0.000000 
1 1 1 3   0  25 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 3   0  26 o 530.3854 57.04863 57.56914       11.40699      57.56914       11.40699      57.56914       11.40699  530.3854 57.04863 530.3854 57.04863 0.000000       0.000000 
1 1 1 3   0  27 o 998.9547 27.69572 195.3350       10.72583      195.3350       10.72583      195.3350       10.72583  998.9547 27.69572 998.9547 27.69572 0.000000       0.000000 
1 1 1 3   0  28 o 197.0022 90.14802 11.66102       7.520267      11.66102       7.520267      11.66102       7.520267  197.0022 90.14802 197.0022 90.14802 0.000000       0.000000 
1 1 1 3   0  29 o 678.5778 34.90124 91.45667       9.141935      91.45667       9.141935      91.45667       9.141935  678.5778 34.90124 678.5778 34.90124 0.000000       0.000000 
1 1 1 3   0  30 o 114.5493 74.39999 0.6594104      7.918534      0.6594104      7.918534      0.6594104      7.918534  114.5493 74.39999 114.5493 74.39999 0.000000       0.000000 
1 1 1 3   0  31 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 3   0  32 o 190.5863 108.9495 14.40463       12.70796      14.40463       12.70796      14.40463       12.70796  190.5863 108.9495 190.5863 108.9495 0.000000       0.000000 
1 1 1 3   0  33 o 493.7003 51.64559 52.73918       9.654003      52.73918       9.654003      52.73918       9.654003  493.7003 51.64559 493.7003 51.64559 0.000000       0.000000 
1 1 1 3   1  0  o 1104.163 11.59233 237.0804       4.970863      242.2748       7.167039      232.2656       6.900272  1115.353 16.54624 1092.124 16.26920 23.22900       23.20484 
1 1 1 3   1  1  o 698.2026 10.35976 94.76165       2.809048      92.94691       3.241131      100.2393       5.631032  691.3506 12.07175 717.0060 20.22261 -25.65540      23.55167 
1 1 1 3   1  2  o 1412.849 11.79185 388.1017       6.470023      386.2288       10.20646      389.3599       8.365652  1408.080 18.66465 1414.533 15.22856 -6.452637      24.08896 
1 1 1 3   1  3  o 1170.414 12.18693 266.3131       5.539390      262.8156       7.763803      269.9398       7.905889  1162.019 17.20415 1177.650 17.28648 -15.63074      24.38863 
1 1 1 3   1  4  o 601.4742 10.71611 70.30182       2.503123      64.65874       3.450918      76.56729       3.636250  576.5923 15.41125 627.4778 14.92201 -50.88556      21.45164 
1 1 1 3   1  5  o 1196.793 12.37875 278.3554       5.753387      271.5863       7.960782      285.7572       8.324432  1181.675 17.34722 1212.072 17.68472 -30.39758      24.77246 
1 1 1 3   1  6  o 400.1957 12.14902 31.12065       1.888172      33.17596       2.738753      29.25876       2.606696  413.0578 17.07316 387.8991 17.30388 25.15863       24.30879 
1 1 1 3   1  7  o 1175.380 12.60325 268.4444       5.752923      275.4855       8.309186      261.9616       7.972948  1190.269 17.97568 1160.712 17.68750 29.55737       25.21850 
1 1 1 3   1  8  o 94.22110 33.46466 1.488566       1.537381      1.314012       2.141194      1.674307       2.208750  100.9191 38.80817 106.5647 39.76197 -5.645653      55.56157 
1 1 1 3   1  9  o 1916.844 16.33345 714.3063       12.15885      704.8904       16.87181      724.4803       17.53796  1903.098 22.82825 1929.247 23.40795 -26.14941      32.69650 
1 1 1 3   1  10 o 398.7747 15.58845 30.91522       2.414118      31.46322       3.384600      30.34770       3.444341  401.4772 21.78954 394.1961 22.59336 7.281097       31.38859 
1 1 1 3   1  11 o 260.6357 22.15805 13.32183       2.221542      13.86941       3.145648      12.77696       3.137836  264.7354 31.19526 253.7136 32.60044 11.02176       45.12131 
1 1 1 3   1  12 o 346.7408 19.55627 23.47875       2.622665      19.19484       3.748266      27.58778       3.670959  311.8512 31.37552 375.2888 25.33591 -63.43756      40.32780 
1 1 1 3   1  13 o 465.3242 16.73983 42.14055       3.025066      43.67271       4.351668      40.70780       4.208120  472.5699 23.78779 456.1975 23.83513 16.37241       33.67450 
1 1 1 3   1  14 o 796.5303 16.30050 123.5167       5.042329      119.2890       6.141317      132.2621       8.832927  782.2368 20.21600 822.2537 27.66119 -40.01685      34.26118 
1 1 1 3   1  15 f 273.3647 32.08408 14.86574       3.341352      16.12063       4.121652      12.45986       5.706975  283.4187 38.43857 243.8701 60.53988 39.54863       71.71192 
1 1 1 3   1  16 o 350.2465 27.79390 24.16653       3.749456      18.52367       6.397006      27.11963       4.627705  299.0697 57.16156 370.2267 32.51564 -71.15701      65.76254 
1 1 1 3   1  17 o 185.7767 43.79404 7.096557       3.108042      3.879175       4.312323      10.57450       4.483545  152.9263 55.82118 225.9960 52.14559 -73.06975      76.38827 
1 1 1 3   1  18 o 671.6925 19.57341 87.89420       5.105813      85.89683       8.757258      88.92284       6.284503  660.9382 34.23503 675.0605 23.97178 -14.12231      41.79335 
1 1 1 3   1  19 o 448.8429 25.73889 39.43205       4.467807      38.34414       7.719396      39.98005       5.478705  438.7729 45.98517 451.0821 31.47201 -12.30917      55.72363 
1 1 1 3   1  20 o 276.4448 42.36473 15.33915       4.403234      17.31999       5.420811      11.49736       7.549310  292.5942 49.46920 239.0489 73.86028 53.54533       88.89625 
1 1 1 3   1  21 f 799.9933 17.48861 124.4793       5.433375      122.5159       7.671490      126.4556       7.696477  792.9771 24.91100 805.6601 24.59870 -12.68304      35.00934 
1 1 1 3   1  22 o 737.6840 18.76373 105.8655       5.375483      103.1279       7.552709      108.6758       7.652433  727.3806 26.73702 746.7263 26.38822 -19.34570      37.56603 
1 1 1 3   1  23 o 429.5818 28.17948 36.15203       4.675125      34.59784       6.605532      37.71197       6.617736  418.0755 41.22057 436.9915 39.41932 -18.91595      57.03524 
1 1 1 3   1  24 o 1130.776 20.20911 248.9774       8.874664      248.4939       15.38592      249.2184       10.86407  1126.508 35.16909 1130.540 24.74449 -4.031982      43.00180 
1 1 1 3   1  25 o 943.3292 19.01713 173.2683       6.966846      171.8719       10.03915      174.5654       9.676099  938.1049 27.55608 945.6604 26.34736 -7.555542      38.12507 
1 1 1 3   1  26 o 1059.702 18.55676 218.6731       7.636847      229.1082       10.93371      208.7328       10.67134  1083.220 25.99097 1033.801 26.57994 49.41943       37.17558 
1 1 1 3   1  27 o 754.4532 26.09917 111.2375       7.646927      106.2790       9.132800      122.8668       13.98645  736.2748 31.94008 786.3654 45.99933 -50.09058      56.00095 
1 1 1 3   1  28 o 107.3299 50.32509 -5.124863      5.291280      -4.883494      7.332185      -5.387164      7.643520  133.5933 61.45806 135.1543 62.38261 -1.560959      87.57101 
1 1 1 3   1  29 o 419.8358 36.49959 35.14482       5.891857      36.65195       8.296012      33.61100       8.369158  423.5167 51.49946 404.0397 54.74706 19.47696       75.16273 
1 1 1 3   1  30 o 142.7296 61.67883 0.5987097E-01  6.259521      8.006745       7.877475      -13.55317      10.31019  205.9323 75.40404 136.1730 65.61166 69.75926       99.95328 
1 1 1 3   1  31 o 164.9758 67.80684 2.991413       6.977116      1.592706       8.326723      6.288048       12.78339  168.1005 71.86485 217.3154 90.76680 -49.21486      115.7720 
1 1 1 3   1  32 o 302.5679 75.45010 21.33316       8.835362      0.000000       0.000000      21.33316       8.835362  ?        ?        302.5679 75.45010 0.000000       75.45010 
1 1 1 3   1  33 o 237.8838 66.30410 13.06975       6.354579      5.629871       9.392399      19.35006       8.629462  189.5926 78.37676 283.1811 76.61166 -93.58849      109.6005 
1 1 1 3   2  0  o 352.2057 10.66746 24.11487       1.459101      24.48676       2.054971      23.73676       2.072096  354.7185 14.91743 349.2250 15.27836 5.493530       21.35317 
1 1 1 3   2  1  o 682.3240 10.48559 90.49597       2.778508      89.87502       3.904760      91.13285       3.954520  679.6306 14.79427 684.3618 14.87922 -4.731201      20.98241 
1 1 1 3   2  2  o 1137.493 11.89844 251.5468       5.256138      258.5851       7.604002      245.1069       7.273605  1152.576 16.98809 1122.184 16.69005 30.39197       23.81497 
1 1 1 3   2  3  o 930.7230 11.27085 168.3680       4.073850      176.5185       5.977447      161.2983       5.567013  952.4979 16.15934 910.5541 15.74304 41.94373       22.56031 
1 1 1 3   2  4  o 580.1215 10.77157 65.39611       2.426755      67.80346       3.502623      63.17371       3.365390  590.4857 15.27411 569.9733 15.20383 20.51233       21.55121 
1 1 1 3   2  5  o 1017.965 11.72025 201.3613       4.633377      206.2662       6.689257      196.8378       6.423959  1029.905 16.72449 1006.116 16.44095 23.78888       23.45236 
1 1 1 3   2  6  o 513.2557 16.25814 51.21472       3.240654      0.000000       0.000000      51.21472       3.240654  ?        ?        513.2557 16.25814 0.000000       16.25814 
1 1 1 3   2  7  o 551.0222 11.77226 58.99228       2.519168      55.32653       3.508309      62.89425       3.619579  533.4575 16.93441 568.7948 16.38605 -35.33728      23.56431 
1 1 1 3   2  8  o 1304.711 13.29222 330.7900       6.735033      323.7504       9.301343      338.5491       9.765122  1290.293 18.56220 1319.401 19.05781 -29.10791      26.60367 
1 1 1 3   2  9  o 229.0494 20.96669 10.29250       1.844342      9.863999       2.602402      10.72490       2.614225  222.8092 30.90801 232.7077 29.59672 -9.898499      42.79335 
1 1 1 3   2  10 o 556.0497 13.35414 60.09161       2.883750      53.83936       3.961807      67.13693       4.205577  526.0676 19.39206 587.5053 18.43257 -61.43774      26.75465 
1 1 1 3   2  11 o 542.3793 14.17666 57.18820       2.986105      56.12209       4.212770      58.26473       4.233284  536.9802 20.20140 547.1523 19.92238 -10.17206      28.37248 
1 1 1 3   2  12 o 627.6617 13.95592 76.59943       3.401826      73.84100       4.771267      79.45149       4.851553  615.8306 19.95007 638.8318 19.55538 -23.00122      27.93597 
1 1 1 3   2  13 o 999.7563 15.76621 194.4885       6.121382      187.8210       7.379279      209.2001       10.96133  981.9510 19.35068 1034.728 27.27779 -52.77722      33.44437 
1 1 1 3   2  14 o 626.2324 17.48378 76.38081       4.252054      76.64487       5.259767      75.88271       7.223790  626.8145 21.60725 622.3812 29.88689 4.433289       36.87952 
1 1 1 3   2  15 o 499.8455 17.50268 48.67586       3.397569      46.40390       4.819408      50.92065       4.790498  486.4626 25.60043 510.4742 24.16456 -24.01160      35.20381 
1 1 1 3   2  16 o 381.7132 25.21136 28.60783       3.716283      23.40966       6.415205      31.23329       4.559189  339.2882 50.20268 398.0978 29.70355 -58.80960      58.33189 
1 1 1 3   2  17 o 144.1282 55.65601 2.810175       4.417956      0.000000       0.000000      2.810175       4.417956  ?        ?        144.1282 55.65601 0.000000       55.65601 
1 1 1 3   2  18 o 1188.638 17.66512 275.0646       8.154440      269.6792       13.81281      277.9456       10.10282  1173.968 30.29688 1194.033 21.78704 -20.06519      37.31724 
1 1 1 3   2  19 o 677.9761 17.55048 89.44831       4.620952      90.55901       6.528113      88.33291       6.541935  681.4500 24.66753 672.9794 25.03090 8.470581       35.14304 
1 1 1 3   2  20 o 471.1018 26.68492 43.42025       4.862065      39.41015       5.857861      52.30068       8.717236  447.6713 33.94660 514.1057 44.08802 -66.43433      55.64284 
1 1 1 3   2  21 o 124.1878 52.66682 0.1784465      4.408724      0.5000362      5.302480      -0.5417246     7.934980  137.8325 58.06718 161.2414 69.56189 -23.40895      90.61266 
1 1 1 3   2  22 o 737.7264 18.70162 105.8770       5.357997      107.9121       7.594328      103.8600       7.560491  744.1050 26.28011 729.9606 26.66998 14.14441       37.44238 
1 1 1 3   2  23 o 979.1372 20.31251 186.6129       7.723875      194.5795       13.80466      182.9824       9.319098  997.3028 35.64270 968.9936 24.76424 28.30920       43.40126 
1 1 1 3   2  24 o 1167.401 17.27250 265.1729       7.830749      262.2397       10.88079      268.3245       11.27862  1159.791 24.15754 1173.051 24.75775 -13.26025      34.59094 
1 1 1 3   2  25 o 361.5529 36.06830 25.88210       4.996778      26.94719       6.968579      24.75497       7.168692  365.7622 50.39719 349.1924 54.65498 16.56985       74.34409 
1 1 1 3   2  26 o 695.4855 22.72675 94.32545       6.138375      94.69881       8.506021      93.91971       8.867184  695.4984 31.49216 692.3588 32.97816 3.139526       45.59951 
1 1 1 3   2  27 o 788.5836 21.67817 121.2942       6.638934      128.6900       9.250992      113.4404       9.533104  810.7535 29.38133 760.5596 32.27551 50.19397       43.64597 
1 1 1 3   2  28 o 171.7526 65.19033 4.539081       5.992922      4.889480       7.250045      3.783157       10.64873  183.7949 71.20634 202.0805 83.48978 -18.28561      109.7310 
1 1 1 3   2  29 o 216.5415 67.46290 9.779828       6.283445      15.19220       7.342490      -5.028379      12.14509  265.3136 70.18010 176.7952 80.48378 88.51840       106.7843 
1 1 1 3   2  30 o 365.0693 48.42772 27.40325       6.696444      29.28877       8.020442      23.06397       12.16721  373.7880 57.06014 315.0152 93.02863 58.77280       109.1338 
1 1 1 3   2  31 o 175.3650 65.47464 5.513408       5.990903      11.87691       8.255318      -1.566458      8.707598  232.6783 77.76611 156.8836 70.06142 75.79474       104.6717 
1 1 1 3   2  32 o 238.5010 71.47755 13.02469       7.142819      24.76902       12.88161      7.810487       8.583207  310.9559 96.54779 201.5573 77.64780 109.3986       123.8978 
1 1 1 3   2  33 o 168.9740 69.06477 4.148735       7.188285      -5.469419      13.19310      8.209507       8.572459  171.2202 80.02042 200.7096 77.52105 -29.48940      111.4127 
1 1 1 3   3  0  o 586.9004 11.80569 66.96612       2.690814      66.15209       3.296671      68.59088       4.657490  583.1379 14.55715 593.2813 20.21451 -10.14337      24.91059 
1 1 1 3   3  1  o 805.5176 12.83658 126.1635       4.015618      130.1647       7.375240      124.4776       4.787460  816.9368 23.24661 799.8794 15.41177 17.05743       27.89136 
1 1 1 3   3  2  o 56.33426 24.75120 -0.2820959     1.044040      0.1766842      2.549635      -0.3745215     1.144384  95.25990 40.20565 58.18483 25.72372 37.07507       47.73054 
1 1 1 3   3  3  o 1274.639 14.73140 315.9305       7.292212      317.6826       8.912600      312.3823       12.68330  1277.726 17.96134 1265.597 25.80529 12.12842       31.44078 
1 1 1 3   3  4  o 677.8860 10.77057 89.28823       2.835458      89.59927       4.016492      88.97922       4.003426  678.8445 15.23521 676.4913 15.23848 2.353210       21.54815 
1 1 1 3   3  5  o 508.1874 11.04378 50.17704       2.179564      49.42447       3.070116      50.94175       3.094770  504.2091 15.67892 511.8944 15.56754 -7.685272      22.09472 
1 1 1 3   3  6  f 111.2878 28.44771 2.505826       1.234182      2.776427       1.755237      2.241210       1.735721  118.6061 35.40700 109.2185 35.62114 9.387619       50.22470 
1 1 1 3   3  7  o 94.27597 31.72636 1.616378       1.374115      1.283428       1.889059      1.990510       2.002481  96.52383 36.60910 108.2093 38.21834 -11.68551      52.92323 
1 1 1 3   3  8  o 493.6709 12.66935 47.35578       2.428956      45.96080       3.387547      48.83186       3.484636  486.1767 17.94168 501.1332 17.90508 -14.95651      25.34750 
1 1 1 3   3  9  o 934.3216 12.39059 169.6292       4.495898      168.7301       6.319254      170.5507       6.397794  931.5145 17.46820 936.5171 17.59084 -5.002563      24.79064 
1 1 1 3   3  10 o 464.2439 14.40391 41.89457       2.596896      44.80257       3.686365      39.02971       3.658921  479.8572 19.78146 447.8169 21.03897 32.04028       28.87810 
1 1 1 3   3  11 o 848.0524 13.01164 139.7921       4.285313      142.3776       6.089831      137.2561       6.031288  855.4330 18.33122 839.8917 18.49093 15.54132       26.03744 
1 1 1 3   3  12 o 620.1623 14.30622 74.78975       3.445547      73.23070       4.784750      76.46899       4.965768  613.2301 20.09129 626.6136 20.40603 -13.38354      28.63680 
1 1 1 3   3  13 o 165.4567 42.72521 5.601848       2.764402      2.830633       3.445677      10.60742       4.630908  134.4285 49.76055 226.5183 53.49646 -92.08980      73.06150 
1 1 1 3   3  14 o 835.1358 14.14007 135.7047       4.586028      133.8876       6.416723      137.6019       6.556790  828.6948 19.93842 840.0839 20.09744 -11.38904      28.30985 
1 1 1 3   3  15 o 422.8706 19.55017 34.86788       3.210599      31.30349       4.436101      38.78864       4.652575  398.6868 28.84593 444.3568 27.09023 -45.66998      39.57232 
1 1 1 3   3  16 o 365.1116 22.71521 26.12623       3.204888      25.26449       4.522186      26.99580       4.542675  357.1785 32.97355 369.5191 31.97029 -12.34058      45.92771 
1 1 1 3   3  17 o 290.7383 41.48587 17.00270       4.551305      0.000000       0.000000      17.00270       4.551305  ?        ?        290.7383 41.48587 0.000000       41.48587 
1 1 1 3   3  18 o 390.9140 23.85761 29.92025       3.604559      26.41445       5.168435      33.24028       5.029633  364.9894 36.97301 410.8585 31.76904 -45.86908      48.74706 
1 1 1 3   3  19 o 623.5460 18.12142 75.66994       4.388223      77.09623       6.229916      74.26546       6.182130  628.6934 25.51616 617.0124 25.79979 11.68097       36.28641 
1 1 1 3   3  20 f 952.2235 16.17105 176.3431       5.980055      171.3380       8.288414      181.7774       8.636470  937.8909 22.75575 966.0057 23.02123 -28.11481      32.36976 
1 1 1 3   3  21 o 877.5439 24.80524 150.0293       8.453574      142.2818       11.68604      158.5340       12.24377  853.1436 35.27095 900.5964 35.00718 -47.45282      49.69449 
1 1 1 3   3  22 o 681.3676 23.14867 90.40923       6.125416      87.32589       10.77379      91.88197       7.445954  666.1998 41.85516 686.4446 27.93102 -20.24481      50.31895 
1 1 1 3   3  23 o 455.7670 27.13156 40.65599       4.780537      38.11755       6.695986      43.29499       6.827326  439.2392 39.68267 468.6882 37.83167 -29.44897      54.82653 
1 1 1 3   3  24 o 415.3012 30.48197 33.88555       4.881910      31.54564       6.688396      36.55363       7.142035  398.0529 44.00247 428.9439 43.47451 -30.89096      61.85670 
1 1 1 3   3  25 o 297.1797 43.99850 17.76323       4.924456      17.94841       6.632295      17.53570       7.351582  294.9618 59.94256 290.0869 66.65620 4.874878       89.64462 
1 1 1 3   3  26 o 1001.023 19.21616 195.1768       7.470310      190.1161       10.15673      201.1407       11.02595  986.5864 26.50884 1014.448 27.98711 -27.86200      38.54863 
1 1 1 3   3  27 o 692.3467 26.45850 93.71377       7.114048      95.11163       8.663114      90.81911       12.46641  696.3911 32.03264 674.8008 47.88139 21.59033       57.60831 
1 1 1 3   3  28 o 233.4371 60.25856 11.45622       5.500087      15.77806       7.541405      6.545219       8.039015  271.8571 70.74839 200.1135 75.61132 71.74352       103.5490 
1 1 1 3   3  29 o 343.3933 49.30761 24.16863       6.386920      25.02592       7.463566      21.82347       12.34437  346.4529 57.48727 310.7621 94.15374 35.69073       110.3164 
1 1 1 3   3  30 o 410.8174 42.65184 34.21698       6.705605      40.98734       8.003520      18.27090       12.28294  448.2112 46.66434 283.4287 94.85751 164.7825       105.7143 
1 1 1 3   3  31 o 580.7161 29.49692 66.97841       6.630404      80.73146       9.348777      53.05916       9.405091  633.0210 38.20752 507.1107 48.34179 125.9103       61.61772 
1 1 1 3   3  32 o 168.2802 64.59212 4.940835       5.924769      11.03313       8.453283      -0.9416159     8.306426  222.5627 78.53254 153.6253 68.53027 68.93739       104.2294 
1 1 1 3   3  33 o 193.7745 75.78397 7.309660       8.272095      0.000000       0.000000      7.309660       8.272095  ?        ?        193.7745 75.78397 0.000000       75.78397 
1 1 1 3   4  0  o 302.1363 13.20791 17.74852       1.549762      17.09152       2.183581      18.41538       2.199898  295.6714 19.11893 307.0129 18.53787 -11.34149      26.63054 
1 1 1 3   4  1  o 615.1551 12.90019 73.56538       3.081831      71.05011       5.671464      74.61927       3.671125  603.6631 24.19205 619.4017 15.26156 -15.73859      28.60367 
1 1 1 3   4  2  o 382.3724 19.25663 28.52938       2.850362      27.02328       4.085160      29.95820       3.978978  371.0012 28.57334 391.0449 26.35463 -20.04367      38.87161 
1 1 1 3   4  3  o 1316.864 18.89120 337.4068       9.661142      331.7261       13.42333      343.5121       13.91582  1304.463 26.49722 1327.335 26.99605 -22.87146      37.82710 
1 1 1 3   4  4  o 153.5938 23.97242 4.703192       1.383221      5.350954       1.554000      2.232445       3.034991  163.8511 25.23125 123.8956 46.53435 39.95548       52.93450 
1 1 1 3   4  5  o 139.7578 46.76162 3.605386       2.984948      0.000000       0.000000      3.605386       2.984948  ?        ?        139.7578 46.76162 0.000000       46.76162 
1 1 1 3   4  6  o 625.0922 11.24857 75.91438       2.730670      73.53594       3.799359      78.45573       3.927321  615.0538 15.90630 635.2947 15.91817 -20.24091      22.50330 
1 1 1 3   4  7  o 308.4185 14.83215 18.48783       1.776530      16.47259       2.466300      20.66108       2.561170  290.1266 22.05434 325.2719 20.37800 -35.14529      30.02760 
1 1 1 3   4  8  o 323.1934 21.72956 20.41638       2.711503      20.41638       2.711503      0.000000       0.000000  323.1934 21.72956 ?        ?        0.000000       21.72956 
1 1 1 3   4  9  f 998.4955 12.52854 193.7411       4.858191      193.0162       6.837218      194.4803       6.904312  996.2498 17.67190 1000.012 17.77818 -3.762146      25.06710 
1 1 1 3   4  10 o 986.2221 12.73796 189.0304       4.878682      191.9181       6.939477      186.2083       6.860202  993.2897 17.98966 978.3961 18.05486 14.89362       25.48737 
1 1 1 3   4  11 o 945.5162 13.04883 173.7808       4.791468      177.4275       6.815252      170.2166       6.737732  954.8818 18.37826 935.2580 18.55044 19.62378       26.11282 
1 1 1 3   4  12 f 772.6516 15.24590 116.1267       4.574723      115.2563       5.661833      117.7635       7.764405  769.3811 18.94905 776.8118 25.73738 -7.430725      31.96059 
1 1 1 3   4  13 o 524.9183 15.49146 53.62112       3.157999      53.24595       4.465636      53.99643       4.466533  522.4951 22.00762 526.1802 21.85789 -3.685059      31.01778 
1 1 1 3   4  14 o 155.8991 41.77266 4.970927       2.580213      7.106032       3.620586      2.767526       3.678037  185.6701 49.36168 135.9055 51.19180 49.76460       71.11382 
1 1 1 3   4  15 o 386.4038 20.73288 29.21151       3.099848      28.37963       4.322150      30.09265       4.448264  379.3672 29.57031 390.7215 29.53345 -11.35437      41.79268 
1 1 1 3   4  16 o 484.5652 21.36536 45.81118       4.020596      58.68539       7.043996      39.59004       4.896593  545.5872 33.40594 448.8037 28.23771 96.78342       43.74158 
1 1 1 3   4  17 o 865.7883 17.96519 145.9878       6.040483      153.0019       11.21087      143.1185       7.170308  883.3113 32.68116 856.6779 21.55223 26.63348       39.14789 
1 1 1 3   4  18 o 852.3937 18.23219 141.4524       6.035415      135.9906       10.35831      144.2598       7.426256  833.5211 31.99957 860.2663 22.22844 -26.74524      38.96250 
1 1 1 3   4  19 o 522.1757 20.41434 53.09388       4.139805      49.85713       5.803120      56.44800       5.907410  504.3549 29.75949 536.9745 28.42922 -32.61960      41.15639 
1 1 1 3   4  20 f 987.1622 18.73330 189.6121       7.181758      176.3680       12.09634      196.8221       8.925023  950.0558 32.78514 1005.251 22.86160 -55.19556      39.96896 
1 1 1 3   4  21 o 471.1975 27.96962 43.44328       5.095278      48.98372       6.280139      32.77131       8.716050  499.8054 32.53216 403.5136 57.22345 96.29178       65.82450 
1 1 1 3   4  22 f 1163.387 19.31943 263.3472       8.728640      277.3764       10.93623      238.7255       14.48803  1193.378 23.59727 1105.368 33.75004 88.00964       41.18126 
1 1 1 3   4  23 o 1400.033 17.20878 381.3040       9.356564      381.2613       13.05348      381.3491       13.41843  1398.738 24.03045 1398.757 24.70195 -0.1965332E-01 34.46228 
1 1 1 3   4  24 o 203.2010 57.17857 8.432633       4.702365      15.79251       6.485171      0.2731073      6.828394  276.2251 61.97866 153.3329 65.30287 122.8922       90.03232 
1 1 1 3   4  25 o 835.9872 22.99648 136.2653       7.466017      138.7712       8.982854      130.6669       13.42659  842.9053 27.44148 813.4996 42.64770 29.40570       50.71352 
1 1 1 3   4  26 o 208.5085 60.75945 8.892351       5.221028      7.708292       7.050716      10.32983       7.768687  204.8608 71.76665 228.7814 75.39638 -23.92065      104.0916 
1 1 1 3   4  27 o 474.3195 30.95132 44.28821       5.670104      42.62011       7.670170      46.29820       8.419600  462.2741 43.22630 481.2771 45.59085 -19.00305      62.82547 
1 1 1 3   4  28 o 189.0506 62.81189 7.020663       5.387739      18.27618       7.283566      -6.579953      8.006461  293.6942 65.52353 134.6254 62.72243 159.0688       90.70522 
1 1 1 3   4  29 o 432.7071 40.25322 37.57804       6.686726      35.73432       7.923206      42.14143       12.46513  418.3271 49.74577 441.9453 75.32857 -23.61823      90.27200 
1 1 1 3   4  30 o 198.8279 62.77452 8.279971       5.421253      11.98718       7.426458      4.050740       7.932117  235.0034 73.36370 179.9571 72.92725 55.04630       103.4438 
1 1 1 3   4  31 f 457.0666 35.28012 42.00525       6.213891      56.09071       8.812539      28.07705       8.763206  523.9733 43.70645 358.1756 65.41009 165.7976       78.66850 
1 1 1 3   4  32 o 190.2648 84.00651 1.742697       12.16568      0.000000       0.000000      1.742697       12.16568  ?        ?        190.2648 84.00651 0.000000       84.00651 
1 1 1 3   4  33 o 236.9516 70.02515 13.20205       6.891745      11.40530       11.89520      14.10992       8.455472  226.6388 90.17421 241.3442 78.61616 -14.70544      119.6323 
1 1 1 3   5  0  o 967.4511 11.66521 181.8902       4.382778      184.8327       6.258948      179.0592       6.139156  974.8459 16.53246 959.5050 16.47530 15.34088       23.34005 
1 1 1 3   5  1  o 1176.347 14.46637 269.0203       6.608809      262.5246       11.51837      272.2081       8.069149  1160.599 25.55529 1182.964 17.56420 -22.36487      31.00926 
1 1 1 3   5  2  o 292.8811 23.25163 16.80868       2.622924      17.49655       3.664169      16.08578       3.756295  297.6432 32.21340 284.8478 34.67134 12.79538       47.32658 
1 1 1 3   5  3  o 667.2589 12.68146 86.52299       3.286181      84.60805       3.804318      92.15182       6.522400  659.7365 14.84835 687.8830 24.41546 -28.14648      28.57601 
1 1 1 3   5  4  o 504.3436 10.73424 49.41738       2.102452      53.72991       3.063682      45.57862       2.890501  525.7578 15.00479 484.2250 15.37085 41.53278       21.48038 
1 1 1 3   5  5  o 735.8631 13.15407 105.2254       3.759111      105.4363       4.430007      104.6829       7.104664  736.4926 15.48845 733.2437 24.94981 3.248901       29.36640 
1 1 1 3   5  6  o 725.8634 13.48691 102.3871       3.801852      99.96941       4.443006      108.9979       7.346818  717.1308 15.95330 748.1993 25.28448 -31.06848      29.89670 
1 1 1 3   5  7  o 553.6113 11.85356 59.54891       2.548482      61.82760       3.621369      57.31318       3.587072  563.9409 16.53527 542.9432 17.01209 20.99762       23.72396 
1 1 1 3   5  8  o 115.4866 33.03657 2.663601       1.556471      0.9689444      2.176174      4.438458       2.227073  97.25294 38.60890 147.9463 38.41978 -50.69334      54.46767 
1 1 1 3   5  9  o 1095.980 12.73364 233.4355       5.419800      226.7491       7.490795      240.7811       7.851426  1079.732 17.86421 1112.608 18.17098 -32.87549      25.48165 
1 1 1 3   5  10 o 884.7474 12.63815 152.1397       4.342411      152.3935       6.111887      151.8810       6.170729  885.0801 17.78135 883.5721 17.98318 1.508057       25.28974 
1 1 1 3   5  11 o 1002.705 14.77172 195.5212       5.752177      197.4251       7.205960      192.1772       9.549994  1007.157 18.42326 992.7506 24.77051 14.40674       30.87061 
1 1 1 3   5  12 o 832.9259 13.43465 134.9155       4.345711      141.0572       6.211622      129.0275       6.081958  851.0637 18.79381 813.9072 19.24157 37.15649       26.89694 
1 1 1 3   5  13 o 941.0526 13.62429 172.2705       4.979157      177.1812       7.138829      167.6186       6.948222  953.5079 19.27856 927.4181 19.29168 26.08984       27.27328 
1 1 1 3   5  14 o 681.8802 14.79236 90.49776       3.917181      87.84270       5.503312      93.22427       5.576883  670.9833 21.11954 691.2851 20.77334 -20.30176      29.62375 
1 1 1 3   5  15 o 389.3754 23.58768 29.72495       3.549999      27.82438       5.853327      30.83082       4.464905  372.9951 41.09009 395.5711 29.27213 -22.57599      50.45050 
1 1 1 3   5  16 o 350.7329 26.86514 24.19919       3.631441      23.32340       5.894476      24.73494       4.610258  340.1197 45.78926 353.2628 34.02545 -13.14313      57.04724 
1 1 1 3   5  17 o 1061.736 14.90770 219.3230       6.146886      218.2964       8.586089      220.4025       8.804029  1058.247 20.89202 1063.255 21.32142 -5.007813      29.85095 
1 1 1 3   5  18 o 389.8018 28.63924 29.84250       4.305087      37.76515       7.710194      26.25354       5.189373  435.1848 46.33344 363.9765 37.23676 71.20828       59.44211 
1 1 1 3   5  19 o 328.3635 34.57594 21.32589       4.342908      18.89655       7.528486      22.53749       5.316714  302.1745 66.00133 336.3466 41.58941 -34.17209      78.01189 
1 1 1 3   5  20 o 801.2440 24.04457 125.0695       7.481862      125.0695       7.481862      0.000000       0.000000  801.2440 24.04457 ?        ?        0.000000       24.04457 
1 1 1 3   5  21 o 896.4434 17.09165 156.2853       5.950245      147.8334       8.101389      166.1851       8.767911  871.2165 23.94448 923.6511 24.44332 -52.43463      34.21716 
1 1 1 3   5  22 o 919.8634 20.10615 164.6715       7.182574      166.0086       8.756517      161.9220       12.55698  923.0984 24.42617 909.9903 35.53206 13.10809       43.11804 
1 1 1 3   5  23 o 790.6843 19.14753 121.6812       5.879549      123.8653       8.063035      119.2012       8.592028  796.9539 26.05178 781.4995 28.30994 15.45447       38.47269 
1 1 1 3   5  24 o 354.6797 41.07996 25.04476       5.553662      28.04980       6.728793      18.62324       9.836279  374.2010 47.36285 297.6521 82.32395 76.54895       94.97617 
1 1 1 3   5  25 o 327.7232 40.28053 21.42645       5.018686      17.35793       6.816272      26.24327       7.416667  289.3185 62.49253 359.5741 54.84841 -70.25558      83.14845 
1 1 1 3   5  26 o 141.6447 58.26339 1.433553       5.156387      -6.667822      7.009512      10.98789       7.612175  123.9843 58.06654 233.4528 74.45800 -109.4685      94.42307 
1 1 1 3   5  27 o 660.8320 24.62827 85.33459       6.320521      90.19055       8.634170      79.72791       9.277608  677.7232 32.80502 634.9769 37.79357 42.74634       50.04521 
1 1 1 3   5  28 o 691.7224 27.31652 93.81993       7.338127      92.98779       8.654249      95.94884       13.84236  687.2863 32.42379 689.0114 52.11700 -1.725037      61.37983 
1 1 1 3   5  29 o 201.8335 68.56502 8.142447       6.418418      4.774581       7.633378      16.26920       11.85763  183.7437 72.51076 273.5290 93.19257 -89.78525      118.0791 
1 1 1 3   5  30 o 133.7206 57.93340 -0.8710521E-01 5.550751      5.247522       7.624298      -6.103572      8.096896  184.9016 72.62653 135.0789 62.98118 49.82266       96.13138 
1 1 1 3   5  31 o 309.8499 50.31285 20.22283       5.846547      19.22435       8.286816      21.21242       8.249840  290.4269 73.42984 306.8802 70.68066 -16.45331      101.9201 
1 1 1 3   5  32 o 201.0188 69.40264 8.779956       6.582360      8.278641       10.77387      9.078527       8.314581  211.2561 85.20888 207.6378 77.21100 3.618347       114.9874 
1 1 1 3   5  33 o 135.5603 60.73914 -1.103114      6.602450      -1.941095      8.443035      0.2160006      10.59309  148.3255 67.36173 171.8491 76.97160 -23.52354      102.2850 
1 1 1 3   6  0  o 1862.576 15.80085 674.4819       11.42938      654.1927       15.43758      699.0938       17.00269  1833.334 21.68251 1894.903 23.10482 -61.56958      31.68539 
1 1 1 3   6  1  o 358.9366 12.77718 25.03700       1.781069      24.69276       2.469252      25.41033       2.571483  355.8731 17.92410 360.9794 18.40423 -5.106262      25.69025 
1 1 1 3   6  2  o 699.3564 17.69876 95.11151       4.806949      93.82516       6.810340      96.38863       6.785830  694.0825 25.26560 703.5358 24.83641 -9.453308      35.42877 
1 1 1 3   6  3  o 693.7995 13.00358 93.54008       3.503684      95.15466       4.137837      89.44994       6.585840  699.6624 15.22849 677.7623 25.02106 21.90009       29.29096 
1 1 1 3   6  4  o 2003.879 24.03451 781.6913       18.70401      742.9862       24.57242      835.0082       28.84009  1951.627 32.42075 2067.887 35.91219 -116.2595      48.38172 
1 1 1 3   6  5  o 1134.957 12.20050 250.2849       5.377556      247.6243       7.505918      253.0908       7.708140  1128.558 17.12585 1140.924 17.39662 -12.36609      24.41182 
1 1 1 3   6  6  f 1148.301 14.63799 256.2804       6.527772      254.0836       7.729336      261.7448       12.19041  1143.147 17.41053 1159.167 27.07972 -16.01978      32.19375 
1 1 1 3   6  7  o 796.3749 16.44854 123.3036       5.087132      123.3036       5.087132      0.000000       0.000000  796.3749 16.44854 ?        ?        0.000000       16.44854 
1 1 1 3   6  8  o 891.0471 12.07213 154.2828       4.177461      157.2490       5.959054      151.4165       5.857888  899.2432 17.06366 882.4064 17.09403 16.83685       24.15314 
1 1 1 3   6  9  o 1083.833 12.78888 228.3073       5.382982      239.0690       7.842398      218.7201       7.402045  1108.562 18.21633 1060.360 17.97506 48.20227       25.59175 
1 1 1 3   6  10 o 612.1967 14.64951 72.87424       3.482908      71.54674       4.359437      75.21689       5.791169  606.3478 18.51317 621.2439 24.00359 -14.89612      30.31352 
1 1 1 3   6  11 o 255.7304 23.07183 12.85256       2.266680      13.67533       3.153012      11.97256       3.260845  262.5486 31.55553 244.7051 35.33684 17.84341       47.37556 
1 1 1 3   6  12 o 857.4134 13.29581 142.9789       4.427240      148.7582       6.347645      137.5045       6.177930  873.8881 18.70376 840.1500 18.93469 33.73804       26.61490 
1 1 1 3   6  13 o 579.7907 15.07648 65.42747       3.394682      65.72683       4.800848      65.12814       4.800763  580.4384 21.29776 577.7763 21.39550 2.662048       30.18877 
1 1 1 3   6  14 f 588.8318 17.72336 67.55772       4.052894      66.86051       6.687172      67.96249       5.095344  583.2629 29.61952 590.0116 22.23745 -6.748718      37.03809 
1 1 1 3   6  15 o 835.5493 16.54539 135.9600       5.368798      140.2781       9.122970      133.6723       6.640419  846.4777 27.75190 827.8155 20.65542 18.66217       34.59500 
1 1 1 3   6  16 o 549.8785 17.59992 58.88951       3.758421      55.94906       5.231372      62.02631       5.403213  535.1349 25.17238 563.5149 24.68987 -28.37994      35.25958 
1 1 1 3   6  17 o 396.2401 27.13608 30.81584       4.150594      25.23101       7.341993      33.43904       5.031816  352.0075 55.54979 412.0668 31.68622 -60.05930      63.95151 
1 1 1 3   6  18 o 893.0718 15.75661 155.1440       5.464837      157.8127       7.766739      152.5272       7.690714  899.9382 22.22276 884.7168 22.38383 15.22137       31.54183 
1 1 1 3   6  19 o 619.8296 21.91111 74.82269       5.274297      68.63388       9.133194      77.91929       6.460431  590.2717 40.07963 632.1107 26.31724 -41.83899      47.94762 
1 1 1 3   6  20 o 827.7531 16.99229 133.2565       5.462367      129.9774       7.491299      136.9792       7.981930  816.9028 23.61341 838.5179 24.51137 -21.61511      34.03528 
1 1 1 3   6  21 o 271.2518 39.30986 14.69627       4.020295      12.10078       5.531768      17.60188       5.852928  242.6405 59.22392 294.5518 53.12054 -51.91129      79.55667 
1 1 1 3   6  22 o 923.7999 20.28053 166.1028       7.275875      160.1978       8.631997      180.5932       13.52201  906.7388 24.51326 960.7763 36.24022 -54.03748      43.75219 
1 1 1 3   6  23 o 233.2642 55.72134 11.20513       4.978505      16.24389       5.960998      -0.4145506     9.052202  281.4891 56.49311 172.2391 74.30212 109.2500       93.33957 
1 1 1 3   6  24 o 888.0036 19.02285 153.5323       6.560216      170.0947       9.244751      136.7328       9.310694  933.6723 25.49604 836.5836 28.65792 97.08875       38.35785 
1 1 1 3   6  25 o 568.0836 25.21453 62.98515       5.562769      63.40814       7.573469      62.48958       8.197412  567.7114 34.51477 562.8556 37.71997 4.855835       51.12794 
1 1 1 3   6  26 o 529.4229 27.95835 54.96045       5.727955      54.26200       7.818453      55.76966       8.415567  523.7089 38.71616 530.3363 41.18353 -6.627441      56.52455 
1 1 1 3   6  27 o 970.2814 22.71067 183.8461       8.557672      183.7175       10.16717      184.1586       15.84897  968.8044 27.02316 964.3932 42.31740 4.411194       50.20969 
1 1 1 3   6  28 o 278.4501 58.89104 16.30585       6.169376      17.06185       7.146264      14.09379       12.22410  282.7704 66.23724 263.9503 94.29773 18.82004       115.2364 
1 1 1 3   6  29 o 97.21986 46.90985 -7.826355      5.314757      -0.7847901     7.118423      -16.69582      7.989103  147.6033 64.74564 106.8095 52.76867 40.79378       83.52563 
1 1 1 3   6  30 o 427.1953 35.51875 36.60084       5.839243      37.25384       8.056392      35.87814       8.475407  424.6956 49.79156 414.6042 53.91362 10.09143       73.38853 
1 1 1 3   6  31 o 497.0644 36.90662 49.92266       7.073494      82.79968       11.83045      31.62993       8.824588  632.3186 48.54731 381.6955 61.63164 250.6231       78.45573 
1 1 1 3   6  32 o 177.3083 66.75938 6.014172       6.253923      -0.5097938     10.38097      9.730866       7.835392  169.8109 76.11807 210.4071 75.46114 -40.59621      107.1837 
1 1 1 3   7  0  o 1177.523 12.68244 269.4370       5.799633      272.1553       8.225343      266.7494       8.178693  1183.016 17.90340 1171.200 17.98146 11.81580       25.37449 
1 1 1 3   7  1  o 307.4424 14.19264 18.37043       1.694552      20.97630       2.387375      15.72453       2.405646  327.8735 18.82833 283.4102 22.02999 44.46329       28.97976 
1 1 1 3   7  2  o 1086.177 14.41202 229.2963       6.079295      228.7774       10.98451      229.5255       7.299061  1083.816 26.09740 1086.500 17.29854 -2.684204      31.30996 
1 1 1 3   7  3  o 663.7269 18.50863 85.66932       4.770806      85.55499       6.659544      85.78986       6.837867  662.8126 25.87175 663.6719 26.53012 -0.8593140     37.05664 
1 1 1 3   7  4  o 1130.409 18.75059 248.5037       8.231489      252.7810       11.74081      244.3686       11.54385  1139.224 26.53757 1120.107 26.53770 19.11670       37.52989 
1 1 1 3   7  5  o 592.7336 19.42877 68.33514       4.472320      65.55251       6.257030      71.24170       6.394853  580.0339 27.77709 604.7206 27.23001 -24.68665      38.89782 
1 1 1 3   7  6  o 907.0081 13.93378 159.8873       4.908041      165.0335       5.899029      148.3121       8.847090  921.3222 16.48697 872.5679 26.10798 48.75433       30.87793 
1 1 1 3   7  7  o 1187.430 15.01523 274.0981       6.924178      273.4794       8.226061      275.6021       12.82521  1185.811 17.86275 1189.056 27.77373 -3.244995      33.02208 
1 1 1 3   7  8  o 846.3171 12.04300 139.1910       3.958184      138.6711       5.551951      139.7283       5.644633  844.4062 16.93036 847.6016 17.14810 -3.195435      24.09760 
1 1 1 3   7  9  o 756.9987 13.82082 111.4043       4.063095      107.8019       5.075871      117.8295       6.778945  744.3890 17.55831 777.7708 22.44308 -33.38184      28.49537 
1 1 1 3   7  10 o 699.7346 12.98527 95.18996       3.528681      91.65474       4.893906      99.01813       5.092641  686.2025 18.36434 713.2321 18.38587 -27.02960      25.98633 
1 1 1 3   7  11 f 545.1434 14.21669 57.80568       3.009797      57.01547       4.235256      58.61194       4.278059  540.9323 20.16084 548.4604 20.08508 -7.528076      28.45822 
1 1 1 3   7  12 o 345.3008 19.03043 23.30492       2.542109      26.05092       3.589125      20.54060       3.601073  364.2316 25.53512 322.6260 29.05281 41.60559       38.67955 
1 1 1 3   7  13 o 434.7264 19.41162 36.84634       3.277221      45.49416       5.519042      32.13636       4.073051  480.8595 29.69946 404.5137 26.06615 76.34586       39.51585 
1 1 1 3   7  14 o 569.4788 17.76176 63.19031       3.928181      61.14541       6.377425      64.44042       4.986365  557.7358 29.54883 574.5080 22.34910 -16.77222      37.04882 
1 1 1 3   7  15 o 763.3066 17.62223 113.4963       5.223817      123.8107       10.00343      109.6290       6.125336  794.2227 32.43235 749.6816 21.03900 44.54102       38.65873 
1 1 1 3   7  16 o 858.0332 15.15341 143.2560       5.049431      153.7212       7.509604      134.6201       6.821793  887.8353 21.77994 830.9492 21.13957 56.88611       30.35205 
1 1 1 3   7  17 o 650.5089 16.87558 82.35059       4.263242      79.72438       5.953936      85.11380       6.107256  639.3317 23.98004 660.6093 23.80529 -21.27765      33.78956 
1 1 1 3   7  18 o 760.0304 16.55053 112.3718       4.885071      111.7323       6.848789      113.0340       6.969870  757.1845 23.29078 761.5493 23.56669 -4.364807      33.13381 
1 1 1 3   7  19 o 663.5500 21.03905 85.71859       5.421604      82.39137       9.523135      87.31410       6.594631  647.5505 38.03550 669.3022 25.37116 -21.75165      45.72084 
1 1 1 3   7  20 o 264.0036 46.53281 14.08215       4.596540      7.807083       7.814912      17.40126       5.683630  211.5795 75.41740 293.0853 51.83102 -81.50574      91.51086 
1 1 1 3   7  21 o 1505.898 19.41344 441.2363       11.35340      444.8470       13.82078      433.7432       19.90963  1511.325 23.54760 1489.823 34.41125 21.50159       41.69680 
1 1 1 3   7  22 o 804.9834 18.43509 126.0841       5.763154      123.3421       7.923952      129.1636       8.397291  795.4213 25.65173 813.8591 26.56819 -18.43787      36.93074 
1 1 1 3   7  23 o 355.2494 39.45395 25.06420       5.351227      23.52466       6.430776      28.53027       9.649086  341.7242 49.93075 371.6798 69.40044 -29.95557      85.49562 
1 1 1 3   7  24 o 599.6725 23.72544 70.12842       5.525308      74.24815       7.518547      65.29099       8.147186  615.2288 31.57436 575.7872 36.62526 39.44153       48.35649 
1 1 1 3   7  25 o 947.6214 19.20969 174.8998       7.069411      180.5942       9.805365      168.7356       10.20172  961.6570 26.25521 929.1281 28.27288 32.52893       38.58357 
1 1 1 3   7  26 o 347.2903 39.98009 24.07207       5.293765      21.58202       7.103860      27.18162       7.938511  323.5972 58.68901 364.3018 58.06015 -40.70462      82.55532 
1 1 1 3   7  27 o 447.7411 38.13627 39.85894       6.568027      45.88794       7.771695      24.79054       12.28646  479.4398 42.16902 335.3150 91.70746 144.1248       100.9380 
1 1 1 3   7  28 o 426.4742 34.87427 36.16730       5.725450      34.47200       7.674443      38.29522       8.598063  411.6378 48.96768 432.8543 52.20176 -21.21655      71.57414 
1 1 1 3   7  29 o 387.9926 37.66024 30.23080       5.603113      41.63089       7.660745      17.11697       8.216401  453.3012 44.07401 278.3441 74.52635 174.9571       86.58346 
1 1 1 3   7  30 o 165.4114 63.06412 4.517905       5.624088      7.802118       7.870139      1.090480       8.039902  202.3454 75.14357 163.5296 70.28173 38.81584       102.8887 
1 1 1 3   7  31 o 148.9573 63.00772 1.575226       6.283834      2.545895       10.02490      0.9470160      8.064861  182.2247 78.40204 160.8237 69.75354 21.40103       104.9402 
1 1 1 3   7  32 o 558.7044 30.32860 62.62199       6.555900      57.95097       9.532728      66.81382       9.030527  525.6241 47.20290 569.6590 41.09566 -44.03491      62.58568 
1 1 1 3   8  0  o 296.5808 16.65170 17.15485       1.910157      17.66762       2.676625      16.62267       2.726815  300.3985 23.12126 291.1904 24.33605 9.208099       33.56838 
1 1 1 3   8  1  o 680.9290 11.94820 90.09010       3.159602      93.65941       4.529757      86.70798       4.409379  694.0718 16.80515 667.8083 17.00190 26.26343       23.90560 
1 1 1 3   8  2  o 1247.887 13.02162 302.6047       6.310566      303.8344       8.928209      301.3771       8.920771  1249.952 18.39260 1244.881 18.45213 5.071045       26.05319 
1 1 1 3   8  3  o 1341.723 15.66733 349.9464       8.163674      348.7384       14.65213      350.4903       9.831004  1337.757 28.20301 1342.434 18.85719 -4.676392      33.92644 
1 1 1 3   8  4  o 1569.895 21.32781 479.5676       13.00304      465.2533       17.69724      496.3616       19.16895  1544.811 29.49865 1595.302 30.94050 -50.49060      42.74909 
1 1 1 3   8  5  o 1215.130 12.66947 286.9337       5.978735      283.2765       6.646238      302.4466       13.68810  1207.243 14.17599 1245.613 28.29645 -38.37073      31.64882 
1 1 1 3   8  6  f 677.7083 27.36532 89.52760       7.202301      0.000000       0.000000      89.52760       7.202301  ?        ?        677.7083 27.36532 0.000000       27.36532 
1 1 1 3   8  7  o 1676.321 17.61157 546.5921       11.46524      546.2354       13.78533      547.3924       20.64967  1675.126 21.19051 1674.295 31.75800 0.8315430      38.17863 
1 1 1 3   8  8  o 758.5264 13.32222 111.8450       3.924417      117.0575       5.092650      104.2241       6.157743  775.7410 16.90438 731.5673 21.67401 44.17365       27.48674 
1 1 1 3   8  9  o 263.0451 19.69476 13.54737       1.997310      14.14753       2.753435      12.88087       2.901633  267.9256 26.82294 255.0484 29.86006 12.87726       40.13843 
1 1 1 3   8  10 o 891.8979 12.72992 154.6720       4.409292      160.7450       6.359714      149.0506       6.118633  908.6267 18.02287 874.9530 18.00701 33.67371       25.47698 
1 1 1 3   8  11 o 486.6447 15.04378 46.08484       2.843132      47.36838       3.989725      44.76053       4.052605  492.8873 20.84334 479.0362 21.78402 13.85114       30.14943 
1 1 1 3   8  12 o 1001.234 13.54125 195.0345       5.265290      203.5834       7.699381      187.5242       7.216540  1021.900 19.40078 980.8580 18.94501 41.04236       27.11649 
1 1 1 3   8  13 o 961.1896 15.41599 179.8672       5.754512      169.5529       9.198352      186.4998       7.376236  931.1313 25.43730 978.0018 19.42080 -46.87042      32.00350 
1 1 1 3   8  14 o 937.8236 16.59468 171.2828       6.043911      163.3052       10.76940      174.9506       7.302297  912.5850 30.38717 947.2142 19.85104 -34.62921      36.29661 
1 1 1 3   8  15 o 300.8049 26.92219 17.83199       3.111760      21.89282       4.442737      13.92131       4.359821  332.0355 34.98017 261.8236 44.46837 70.21191       56.57781 
1 1 1 3   8  16 o 534.0685 18.03633 55.53704       3.740874      63.48079       5.376363      48.08183       5.208422  570.3547 24.27256 495.3383 27.17934 75.01639       36.44000 
1 1 1 3   8  17 o 984.0717 15.19520 188.3538       5.807123      190.2843       8.177263      186.3895       8.248221  988.3086 21.30529 978.0798 21.71491 10.22882       30.42125 
1 1 1 3   8  18 f 344.9450 27.87379 23.36743       3.702092      25.56785       5.138993      20.99351       5.337759  359.3953 37.36575 324.0829 43.50955 35.31238       57.35225 
1 1 1 3   8  19 o 596.3581 22.64959 69.25609       5.245604      71.08488       6.376122      65.42602       9.227371  603.7991 27.19168 576.2410 41.51114 27.55804       49.62421 
1 1 1 3   8  20 o 761.3966 21.17368 112.8373       6.260880      124.9446       10.89387      106.8660       7.650586  799.5484 35.08402 740.4673 26.60485 59.08105       44.03074 
1 1 1 3   8  21 o 472.0035 24.68627 43.52423       4.509382      43.85324       6.101166      43.12811       6.694513  472.5969 33.45880 468.0550 37.13429 4.541870       49.98447 
1 1 1 3   8  22 o 391.0417 29.93555 30.03388       4.511563      34.65430       6.155974      24.67269       6.631115  418.8048 38.27224 350.2788 50.18033 68.52597       63.10967 
1 1 1 3   8  23 o 544.8348 28.39872 58.13094       5.988050      61.48938       7.182463      50.47582       10.84377  559.5465 33.20138 501.0901 56.72222 58.45639       65.72475 
1 1 1 3   8  24 o 453.6451 34.16505 40.54731       5.974840      39.99712       7.183099      41.78273       10.76377  448.9632 41.67294 453.0144 62.87754 -4.051270      75.43354 
1 1 1 3   8  25 o 675.2611 23.02173 88.94298       6.037230      86.53337       8.209647      91.78062       8.909036  664.6862 31.80386 684.2147 33.52821 -19.52850      46.21284 
1 1 1 3   8  26 o 464.3998 36.99918 42.71165       6.617496      44.01783       7.714713      39.07427       12.87392  469.9890 42.73422 429.1376 80.19662 40.85132       90.87195 
1 1 1 3   8  27 o 261.9567 55.44268 14.31509       5.464440      14.02066       7.274596      14.69634       8.278053  256.5466 70.73233 262.2777 76.52943 -5.731140      104.2104 
1 1 1 3   8  28 o 502.0529 30.88233 49.84623       5.992059      58.32548       8.101103      39.60349       8.903755  540.4713 38.85541 439.2694 53.28374 101.2018       65.94619 
1 1 1 3   8  29 o 145.5444 59.95450 1.884300       5.469901      7.818327       7.112084      -6.708554      8.558366  200.7678 71.90547 138.0217 64.48649 62.74603       96.58625 
1 1 1 3   8  30 o 343.2847 51.99055 24.76202       6.714201      19.55364       10.02907      28.99244       9.038610  289.0831 84.20232 363.9362 66.39773 -74.85312      107.2319 
1 1 1 3   8  31 f 136.1641 59.09227 0.2523435      5.794668      9.456516       8.030317      -9.747049      8.370032  210.5657 76.27888 124.4539 59.74689 86.11179       96.89251 
1 1 1 3   8  32 o 396.1298 58.32959 34.47211       8.704729      34.47211       8.704729      0.000000       0.000000  396.1298 58.32959 ?        ?        0.000000       58.32959 
1 1 1 3   9  0  o 1227.772 13.19873 292.9492       6.293293      284.9075       8.662001      301.9400       9.158893  1210.329 18.42837 1245.926 18.92878 -35.59778      26.41786 
1 1 1 3   9  1  o 1349.382 13.54245 353.8725       7.096761      348.4638       9.823758      359.7760       10.26334  1338.477 18.89899 1359.963 19.43272 -21.48584      27.10724 
1 1 1 3   9  2  o 1143.271 12.78531 254.0028       5.676604      255.0190       7.987445      252.9657       8.069038  1145.117 17.96098 1140.472 18.21836 4.644775       25.58330 
1 1 1 3   9  3  f 439.8486 12.81099 37.59742       2.188335      37.21171       3.064242      37.99889       3.126236  437.4117 18.03868 442.0071 18.21229 -4.595428      25.63360 
1 1 1 3   9  4  o 1301.771 20.15579 329.7421       10.18973      315.5801       13.84844      346.4613       15.04695  1272.272 28.02806 1332.865 29.06927 -60.59363      40.38063 
1 1 1 3   9  5  o 688.0430 14.15292 92.02389       3.781723      95.96613       4.413414      81.13302       7.335574  702.5093 16.17687 644.8995 29.28964 57.60980       33.46004 
1 1 1 3   9  6  o 1227.589 18.22713 293.1881       8.689591      293.1881       8.689591      0.000000       0.000000  1227.589 18.22713 ?        ?        0.000000       18.22713 
1 1 1 3   9  7  o 862.1020 16.90758 144.5792       5.660674      144.5792       5.660674      0.000000       0.000000  862.1020 16.90758 ?        ?        0.000000       16.90758 
1 1 1 3   9  8  o 505.9909 12.98599 49.77483       2.551796      53.25222       3.637189      46.40399       3.581034  523.0822 17.90474 488.2277 18.88679 34.85446       26.02480 
1 1 1 3   9  9  o 914.1911 17.69151 162.7042       6.281014      162.7042       6.281014      0.000000       0.000000  914.1911 17.69151 ?        ?        0.000000       17.69151 
1 1 1 3   9  10 o 1100.755 13.16245 235.6616       5.626723      234.2898       7.940644      237.0450       7.974239  1096.646 18.64495 1103.082 18.61460 -6.435181      26.34649 
1 1 1 3   9  11 o 1281.411 13.91539 319.4887       6.924872      333.3617       10.17996      307.5402       9.447505  1307.513 20.04804 1256.030 19.36820 51.48340       27.87564 
1 1 1 3   9  12 o 896.8445 19.23697 156.8188       6.700110      0.000000       0.000000      156.8188       6.700110  ?        ?        896.8445 19.23697 0.000000       19.23697 
1 1 1 3   9  13 o 758.6955 14.24168 112.0180       4.196204      108.8190       5.841999      115.4276       6.031178  746.9641 20.13881 769.3033 20.18722 -22.33929      28.51483 
1 1 1 3   9  14 o 346.9408 22.31366 23.58591       2.990505      24.30497       4.211117      22.85435       4.247542  350.7183 31.24521 339.7433 32.59282 10.97498       45.15037 
1 1 1 3   9  15 o 714.5906 15.37433 99.36324       4.266596      96.60930       5.918123      102.3437       6.156703  703.8920 21.64960 724.4485 21.88329 -20.55652      30.78285 
1 1 1 3   9  16 o 580.4014 17.46412 65.56544       3.936437      65.77367       5.408984      65.33098       5.739643  580.7191 23.98400 578.5899 25.54383 2.129150       35.03883 
1 1 1 3   9  17 o 475.0637 20.65735 43.94800       3.811136      47.13267       5.333687      40.62580       5.447639  490.5892 28.11222 454.9077 31.02102 35.68152       41.86407 
1 1 1 3   9  18 o 840.5681 18.77817 137.4823       6.129910      135.9021       7.347133      141.1018       11.11961  835.3290 22.64813 849.6035 33.70119 -14.27448      40.60429 
1 1 1 3   9  19 f 221.8666 44.30497 9.993915       3.683797      7.273433       5.049640      13.08885       5.385961  192.5647 60.55732 252.6566 56.32820 -60.09184      82.70462 
1 1 1 3   9  20 o 611.5645 23.57717 72.84066       5.599663      76.84771       9.873033      70.94040       6.798988  624.9988 40.90208 603.0728 29.02997 21.92609       50.15695 
1 1 1 3   9  21 o 950.9256 17.35072 175.8965       6.407552      156.9405       8.696988      198.4023       9.476391  897.3809 24.95538 1009.092 24.18154 -111.7116      34.74936 
1 1 1 3   9  22 o 1471.379 17.09163 421.2154       9.766431      414.9272       13.43519      428.2617       14.22201  1459.026 23.71116 1482.043 24.70997 -23.01746      34.24619 
1 1 1 3   9  23 o 228.4185 53.37662 10.75003       4.649680      13.86984       6.371265      7.195138       6.801035  258.3613 63.86359 199.9129 70.45153 58.44835       95.08931 
1 1 1 3   9  24 o 137.2726 58.00865 0.4796946      5.317947      3.915332       6.426728      -6.981506      9.470885  172.1033 66.93948 149.9831 69.30185 22.12021       96.35165 
1 1 1 3   9  25 o 304.5168 53.91260 18.98407       6.142391      21.01081       7.116673      13.06468       12.16230  319.1411 59.61259 263.0662 94.05085 56.07495       111.3518 
1 1 1 3   9  26 o 701.7006 27.11089 96.37418       7.387945      95.29086       8.703358      99.16768       13.97603  696.6190 32.17093 702.8207 51.56476 -6.201782      60.77740 
1 1 1 3   9  27 o 712.1403 23.70065 99.22476       6.554716      110.2450       8.871429      85.97623       9.727081  748.7913 30.50737 657.8837 38.23692 90.90753       48.91586 
1 1 1 3   9  28 o 159.3191 62.16139 3.585037       5.555381      2.471565       7.364251      5.055484       8.462791  167.4705 69.32980 190.9769 76.03606 -23.50639      102.8985 
1 1 1 3   9  29 o 380.3239 46.07174 29.65860       6.665984      39.45446       10.46913      22.97915       8.644898  429.3156 64.81014 322.7982 70.89974 106.5174       96.05794 
1 1 1 3   9  30 o 533.3187 32.10831 56.84477       6.619161      60.77353       9.317590      52.84210       9.404835  544.5775 44.44464 505.0405 48.54916 39.53705       65.82057 
1 1 1 3   9  31 o 363.8259 44.87749 27.61729       6.206493      34.88241       8.816816      20.48095       8.738323  400.5287 58.40071 294.3673 75.93723 106.1614       95.79721 
1 1 1 3   9  32 o 289.7699 54.52890 18.43847       5.911128      24.73727       8.773998      13.20343       7.998861  324.2346 71.59369 234.7075 76.46446 89.52716       104.7496 
1 1 1 3   10 0  o 780.2302 12.64264 118.3085       3.830793      118.7887       5.408412      117.8250       5.426753  781.4816 17.82063 778.2954 17.95427 3.186218       25.29685 
1 1 1 3   10 1  o 227.2847 21.89324 10.14923       1.908547      6.720677       2.648265      13.85424       2.752965  181.9129 38.67686 265.2203 27.10902 -83.30748      47.23133 
1 1 1 3   10 2  o 822.9641 12.25294 131.6183       3.916059      125.4947       5.407966      138.3692       5.678200  803.2615 17.33600 843.4592 17.33479 -40.19769      24.51595 
1 1 1 3   10 3  o 1052.709 12.69909 215.3820       5.191693      216.4090       7.301098      214.3315       7.383928  1054.752 17.82419 1049.647 18.11408 5.105469       25.41302 
1 1 1 3   10 4  o 1110.785 12.73001 239.8136       5.491447      249.6667       7.953128      230.8358       7.591635  1132.823 18.07789 1089.280 17.94600 43.54321       25.47292 
1 1 1 3   10 5  o 483.4663 17.29843 45.47216       3.247886      45.47216       3.247886      0.000000       0.000000  483.4663 17.29843 ?        ?        0.000000       17.29843 
1 1 1 3   10 6  o 1217.268 18.42240 288.3850       8.708840      288.3850       8.708840      0.000000       0.000000  1217.268 18.42240 ?        ?        0.000000       18.42240 
1 1 1 3   10 7  o 1120.239 28.70190 245.2043       12.48674      0.000000       0.000000      245.2043       12.48674  ?        ?        1120.239 28.70190 0.000000       28.70190 
1 1 1 3   10 8  o 1400.428 13.85096 381.4497       7.533013      381.9721       10.69008      380.9344       10.61687  1400.214 19.65887 1398.336 19.55046 1.877808       27.72529 
1 1 1 3   10 9  o 904.3576 12.63278 159.0532       4.436770      168.9912       6.500454      150.3860       6.070655  931.4546 17.97025 878.7123 17.78938 52.74225       25.28620 
1 1 1 3   10 10 o 729.7919 18.49937 103.7902       5.243051      0.000000       0.000000      103.7902       5.243051  ?        ?        729.7919 18.49937 0.000000       18.49937 
1 1 1 3   10 11 o 1277.928 19.73126 318.4714       9.792399      0.000000       0.000000      318.4714       9.792399  ?        ?        1277.928 19.73126 0.000000       19.73126 
1 1 1 3   10 12 o 295.3749 22.77501 17.13687       2.592359      15.11786       3.491293      19.61792       3.870217  275.4284 33.31738 314.4997 32.13900 -39.07132      46.29215 
1 1 1 3   10 13 o 582.1609 15.76534 65.97723       3.564301      63.93648       4.840765      68.39375       5.267609  572.4237 21.77551 591.8860 22.91646 -19.46228      31.61229 
1 1 1 3   10 14 o 598.3608 16.15061 69.68977       3.753013      69.16293       5.204763      70.26039       5.416702  595.4211 22.50862 600.0334 23.24511 -4.612366      32.35696 
1 1 1 3   10 15 o 1368.077 15.07732 364.0954       8.010556      367.1097       11.33672      361.0897       11.32057  1372.485 21.26922 1361.151 21.41579 11.33398       30.18304 
1 1 1 3   10 16 o 371.3269 27.60287 27.06299       3.952051      30.63352       4.719664      18.68519       7.229531  394.6628 31.04393 300.5577 63.90483 94.10510       71.04613 
1 1 1 3   10 17 o 734.9695 16.48159 105.0673       4.704316      108.9312       6.558930      100.9738       6.751044  747.8101 22.58467 719.8159 24.15024 27.99420       33.06511 
1 1 1 3   10 18 o 811.0978 16.47974 127.9378       5.191005      132.2941       7.316170      123.5215       7.366467  824.2180 22.85671 796.3226 23.82003 27.89539       33.01247 
1 1 1 3   10 19 o 269.4504 37.01948 14.46033       3.771450      15.05254       5.118914      13.75717       5.577863  272.4477 50.23077 259.0519 56.99167 13.39578       75.96828 
1 1 1 3   10 20 o 419.4924 31.53216 34.54932       5.099375      21.03451       8.498187      42.15356       6.374545  318.8260 70.50635 462.9399 35.73308 -144.1140      79.04428 
1 1 1 3   10 21 o 538.0950 27.13636 56.62651       5.652457      50.27599       9.476936      60.13315       7.042200  502.7241 49.17070 553.6412 32.90103 -50.91711      59.16278 
1 1 1 3   10 22 o 476.1300 26.43157 44.37375       4.868171      48.75205       6.667676      39.37532       7.124247  497.7535 34.71037 445.6907 41.64272 52.06287       54.21186 
1 1 1 3   10 23 o 132.4556 54.70227 1.096866       4.568678      5.733673       6.127480      -4.707857      6.855878  183.7889 66.62334 129.7874 59.60394 54.00154       89.39407 
1 1 1 3   10 24 o 1278.342 20.60258 318.4460       10.22814      326.1855       12.41792      302.1189       18.03635  1292.771 24.73427 1240.080 37.45166 52.69128       44.88219 
1 1 1 3   10 25 o 366.2064 52.92822 27.24670       7.308931      27.24670       7.308931      0.000000       0.000000  366.2064 52.92822 ?        ?        0.000000       52.92822 
1 1 1 3   10 26 o 1088.382 19.20779 231.0257       8.118706      232.3815       11.09727      229.4645       11.90880  1089.517 26.22733 1081.922 28.34289 7.595459       38.61596 
1 1 1 3   10 27 o 508.3273 29.65901 50.98690       5.829592      53.90264       7.673201      47.00645       8.965376  520.0097 38.26475 481.5682 48.60323 38.44153       61.85843 
1 1 1 3   10 28 o 209.2563 68.34653 9.093426       6.389093      15.34257       9.759100      4.405892       8.452237  263.6083 84.33107 186.4303 75.37476 77.17801       113.1065 
1 1 1 3   10 29 o 110.1994 52.69975 -7.759352      6.373806      -0.4903594E-01 9.769230      -13.47401      8.410456  172.3479 75.71816 117.2062 57.12035 55.14169       94.84711 
1 1 1 3   10 30 o 499.0886 33.09333 49.99778       6.377866      44.17815       8.710320      56.72440       9.364497  459.8254 49.55994 523.6617 46.53228 -63.83630      67.98118 
1 1 1 3   10 31 o 474.7931 35.03993 45.73345       6.415285      46.01707       9.365603      45.48273       8.805449  463.9902 52.92240 463.7512 49.66439 0.2390442      72.57639 
1 1 1 3   11 0  o 981.3863 13.03002 187.2144       4.966072      191.6118       7.100590      183.0039       6.948066  992.3187 18.42533 969.7707 18.44875 22.54797       26.07392 
1 1 1 3   11 1  o 253.8065 21.78436 12.63748       2.126405      9.662706       2.944705      15.87887       3.073831  219.4230 35.79063 283.8666 28.25848 -64.44356      45.60165 
1 1 1 3   11 2  o 312.9520 17.71787 19.11650       2.144524      23.03469       3.025860      15.16208       3.039817  343.0965 22.83986 277.2507 28.64528 65.84579       36.63619 
1 1 1 3   11 3  o 256.2130 20.17673 12.85991       1.991368      11.74530       2.693965      14.20261       2.956788  243.5623 29.05433 268.1872 28.84265 -24.62485      40.93962 
1 1 1 3   11 4  o 173.3544 29.21737 6.028913       1.897056      7.922319       2.333963      2.342791       3.256545  198.9581 31.23563 127.4413 48.13108 71.51680       57.37827 
1 1 1 3   11 5  o 410.1350 19.80689 32.75948       3.154795      32.75948       3.154795      0.000000       0.000000  410.1350 19.80689 ?        ?        0.000000       19.80689 
1 1 1 3   11 6  o 831.4286 12.24229 134.3961       3.952899      132.9680       4.353387      141.1043       9.435058  826.8833 13.55673 849.5815 28.59641 -22.69818      31.64711 
1 1 1 3   11 7  o 768.5444 14.92167 114.9255       4.453631      113.2658       5.150181      119.8464       8.868272  762.6987 17.38767 782.5913 29.17937 -19.89264      33.96715 
1 1 1 3   11 8  o 226.6002 28.30951 10.20267       2.436914      0.000000       0.000000      10.20267       2.436914  ?        ?        226.6002 28.30951 0.000000       28.30951 
1 1 1 3   11 9  o 154.0357 41.25776 4.852600       2.517562      0.000000       0.000000      4.852600       2.517562  ?        ?        154.0357 41.25776 0.000000       41.25776 
1 1 1 3   11 10 o 974.3055 14.63632 184.7645       5.538026      175.8374       8.715669      190.8094       7.171988  948.6660 23.65698 989.3814 18.66585 -40.71539      30.13415 
1 1 1 3   11 11 o 273.2147 23.44556 14.68734       2.463569      11.93874       3.347275      17.93592       3.639006  243.6148 36.50441 300.6704 31.63956 -57.05562      48.30770 
1 1 1 3   11 12 o 454.8732 17.07509 40.29884       3.016347      37.05185       4.067995      44.26413       4.495486  434.8419 24.18473 475.3601 24.43413 -40.51819      34.37917 
1 1 1 3   11 13 o 954.4975 14.00512 177.2351       5.191462      180.5815       7.269080      173.7512       7.416821  962.6430 19.44403 944.1242 20.22836 18.51880       28.05809 
1 1 1 3   11 14 o 223.9417 34.87079 10.06243       2.933958      15.98805       3.965713      2.897113       4.360864  283.0319 36.96196 144.6407 55.43975 138.3912       66.63146 
1 1 1 3   11 15 o 1055.776 17.18726 216.9046       7.047036      235.2588       8.761904      183.2831       11.85873  1099.039 20.52851 968.0665 31.54316 130.9727       37.63496 
1 1 1 3   11 16 o 1327.444 15.31322 342.6744       7.894248      336.8257       10.92355      349.0684       11.42139  1315.131 21.38782 1338.711 21.96869 -23.57996      30.66043 
1 1 1 3   11 17 o 671.3268 17.38100 87.66306       4.531446      86.35252       6.258457      89.10719       6.569733  665.7499 24.20629 676.2084 25.01723 -10.45844      34.81100 
1 1 1 3   11 18 o 302.3461 31.98661 18.04333       3.698753      17.03201       5.039619      19.22414       5.445590  291.0732 46.12032 309.5043 46.76357 -18.43109      65.68040 
1 1 1 3   11 19 o 1115.578 16.09658 241.9939       6.973672      244.7468       9.679578      239.0229       10.05569  1121.196 22.23039 1107.852 23.37235 13.34375       32.25611 
1 1 1 3   11 20 o 732.5203 18.31934 104.4008       5.211437      102.6975       7.143802      106.3384       7.619330  725.8595 25.34247 738.4750 26.56764 -12.61548      36.71621 
1 1 1 3   11 21 o 366.5642 38.64202 26.63882       5.418070      21.51531       8.943188      29.60974       6.810107  321.0176 73.34112 385.0154 46.48662 -63.99786      86.83274 
1 1 1 3   11 22 o 998.0917 24.67181 194.3190       9.563116      194.3190       9.563116      0.000000       0.000000  998.0917 24.67181 ?        ?        0.000000       24.67181 
1 1 1 3   11 23 o 812.7867 19.76365 128.6789       6.238379      130.9378       8.424711      125.9367       9.282310  818.8736 26.49172 802.4912 29.78433 16.38239       39.86123 
1 1 1 3   11 24 o 742.8914 24.95490 107.7585       7.199613      105.8229       8.416991      113.0359       13.89825  735.3885 29.47217 753.9476 47.71296 -18.55908      56.08150 
1 1 1 3   11 25 o 775.7416 24.04705 117.5655       7.244473      119.9722       8.761370      112.3630       12.88136  782.6028 28.82721 751.7026 44.32138 30.90015       52.87148 
1 1 1 3   11 26 o 557.8467 27.71258 61.03335       6.003711      65.33646       7.919497      55.21854       9.206068  574.2528 35.68789 524.3411 45.66570 49.91174       57.95672 
1 1 1 3   11 27 o 569.6345 27.66253 63.77877       6.119503      69.59589       8.106476      56.07211       9.330636  591.7638 35.43715 526.6920 46.08069 65.07184       58.13107 
1 1 1 3   11 28 o 216.4398 68.54868 9.967846       6.460551      20.29280       9.702679      1.744113       8.659287  299.1759 81.36051 172.9982 73.60489 126.1777       109.7142 
1 1 1 3   11 29 o 567.8193 29.13163 64.02612       6.402336      70.30550       8.644581      56.39721       9.528337  590.6343 37.88734 523.3323 47.39687 67.30200       60.67878 
1 1 1 3   11 30 o 569.7658 29.69208 64.82039       6.547255      74.56116       9.150171      54.60104       9.372255  605.1732 39.14299 511.7581 47.70746 93.41507       61.71042 
1 1 1 3   11 31 o 204.1944 65.56607 9.399693       5.895041      7.418603       8.659691      11.11063       8.047612  196.2250 77.29665 219.4880 76.68475 -23.26300      108.8822 
1 1 1 3   12 0  o 689.0674 13.67193 92.32950       3.658639      94.57437       5.148401      90.03924       5.200181  696.9297 19.02197 679.9473 19.69316 16.98248       27.37984 
1 1 1 3   12 1  o 798.4556 13.14554 123.9583       4.076217      133.3904       5.909371      115.3969       5.630050  827.7520 18.38286 769.8519 18.83116 57.90009       26.31619 
1 1 1 3   12 2  o 531.3228 15.60941 54.92216       3.220867      57.51383       4.135993      50.92868       5.134119  543.4143 19.59840 510.1222 26.00202 33.29211       32.56075 
1 1 1 3   12 3  o 491.6172 15.80494 47.02653       3.017504      47.75991       3.826889      45.82112       4.906239  495.1389 19.90173 483.7104 26.21561 11.42850       32.91409 
1 1 1 3   12 4  o 636.1634 14.53151 78.72947       3.590107      77.20442       4.486428      81.44471       5.986373  629.6267 18.34803 646.0305 23.86068 -16.40375      30.09954 
1 1 1 3   12 5  f 487.5025 14.68131 46.23997       2.779518      44.48327       3.706025      48.49858       4.202236  477.7477 19.97477 498.6788 21.69859 -20.93112      29.49272 
1 1 1 3   12 6  o 933.6282 12.65188 169.5245       4.587297      171.1896       5.132707      162.9152       10.22607  938.0240 14.08979 912.2224 28.86557 25.80157       32.12076 
1 1 1 3   12 7  o 1190.358 13.35690 275.6566       6.174637      276.4502       6.928357      272.5929       13.61292  1191.785 14.96940 1179.364 29.72183 12.42053       33.27868 
1 1 1 3   12 8  o 340.5293 49.64469 23.56690       6.372212      0.000000       0.000000      23.56690       6.372212  ?        ?        340.5293 49.64469 0.000000       49.64469 
1 1 1 3   12 9  o 368.8454 17.98203 26.51260       2.575794      18.14643       4.073460      32.08651       3.324915  301.6085 35.45347 404.9377 21.21670 -103.3292      41.31702 
1 1 1 3   12 10 o 414.1156 16.31900 33.39674       2.624480      35.17557       3.799000      31.77272       3.629920  423.7551 23.17262 402.6516 23.31320 21.10352       32.87059 
1 1 1 3   12 11 f 501.3754 15.67968 48.93567       3.053010      54.83427       4.359509      43.25851       4.276893  530.1806 21.17316 470.6654 23.39851 59.51523       31.55619 
1 1 1 3   12 12 o 349.6898 20.94132 23.92710       2.830818      25.01990       3.899954      22.71017       4.115499  356.4989 28.40484 338.9615 31.62938 17.53741       42.51180 
1 1 1 3   12 13 o 917.8765 16.74695 163.9784       5.969637      162.7476       7.035800      167.1417       11.27943  913.9955 19.82173 923.9567 31.43458 -9.961243      37.16226 
1 1 1 3   12 14 o 423.5919 20.52788 34.94902       3.376911      34.96692       4.489256      34.92569       5.124985  422.2997 27.52365 421.4132 31.54411 0.8864746      41.86385 
1 1 1 3   12 15 o 820.7225 15.23542 130.9930       4.856000      130.6256       6.680601      131.4044       7.070846  819.0135 21.00373 821.3170 22.16831 -2.303528      30.53835 
1 1 1 3   12 16 o 430.0816 22.34284 36.11834       3.718937      36.48971       5.010077      35.66261       5.550013  431.3206 30.09867 425.8137 33.84099 5.506836       45.28954 
1 1 1 3   12 17 o 985.6492 15.60922 188.8916       5.974913      190.1409       8.228958      187.4987       8.689440  988.3286 21.43954 981.2788 22.80192 7.049805       31.29827 
1 1 1 3   12 18 o 387.6631 26.99856 29.43521       4.039277      24.16576       5.420668      36.01432       6.056946  348.9267 40.77163 427.5715 36.83636 -78.64481      54.94764 
1 1 1 3   12 19 o 775.0476 17.56992 116.8471       5.288424      112.9855       7.158494      121.4869       7.846717  761.5330 24.20499 789.5086 25.59194 -27.97559      35.22540 
1 1 1 3   12 20 o 958.3406 16.95217 178.6682       6.309185      177.2510       8.649865      180.2794       9.222732  953.7351 23.35359 961.6476 24.69537 -7.912537      33.98899 
1 1 1 3   12 21 o 365.2230 40.60394 26.52038       5.661609      29.94515       9.811955      24.81101       6.931992  380.9156 68.86295 350.3308 52.57354 30.58481       86.63765 
1 1 1 3   12 22 o 336.9084 45.17669 22.76853       5.762022      5.125580       9.504546      33.02068       7.245249  203.8905 80.76836 406.3964 46.75896 -202.5059      93.32700 
1 1 1 3   12 23 o 619.9542 26.41277 75.06908       6.359186      74.03072       7.438715      77.88815       12.25676  614.1516 31.29221 624.6027 50.97383 -10.45105      59.81249 
1 1 1 3   12 24 o 339.8640 40.39528 23.08652       5.227257      22.67488       6.814946      23.67480       8.147053  332.9911 54.59126 337.3893 64.53016 -4.398193      84.52424 
1 1 1 3   12 25 o 108.8342 51.17895 -5.595233      5.540255      -7.310665      6.687722      -1.842583      9.891465  117.2547 55.47065 171.1532 75.64934 -53.89849      93.80733 
1 1 1 3   12 26 o 787.8142 24.71572 121.5779       7.561798      136.9825       9.274672      91.03404       13.05977  835.0009 28.60116 670.7874 50.50344 164.2134       58.03985 
1 1 1 3   12 27 o 527.8423 34.08218 55.41320       6.949176      63.39308       10.74279      49.67159       9.112461  557.2945 50.17483 493.8261 48.12696 63.46835       69.52495 
1 1 1 3   12 28 o 186.3609 64.34595 6.941985       5.658163      6.097873       7.513556      8.047775       8.599669  189.2625 72.71687 207.6951 78.26827 -18.43268      106.8348 
1 1 1 3   12 29 o 218.9582 62.12695 10.56555       5.527613      17.45432       7.555832      2.633593       8.107769  277.5098 70.09045 170.2393 71.76577 107.2705       100.3145 
1 1 1 3   12 30 o 236.1184 60.48197 12.49563       5.570668      17.01980       7.972513      8.179556       7.786993  268.7134 74.03151 199.5055 74.61559 69.20792       105.1102 
1 1 1 3   12 31 o 289.5918 50.89190 18.16540       5.514630      14.77153       8.109170      21.08530       7.521656  246.8416 76.59667 302.6589 65.86411 -55.81731      101.0204 
1 1 1 3   13 0  o 975.1091 15.20921 185.0373       5.759541      184.4247       7.167584      186.1536       9.676128  972.9003 18.97040 976.1010 25.52577 -3.200684      31.80316 
1 1 1 3   13 1  o 280.6910 24.02965 15.49417       2.594161      11.86547       3.283859      21.51776       4.230935  243.1983 35.84408 329.4705 33.53423 -86.27219      49.08506 
1 1 1 3   13 2  o 684.4921 15.09118 91.17943       4.011619      92.14684       5.098430      89.60699       6.500082  687.6571 19.09135 677.3055 24.71190 10.35162       31.22752 
1 1 1 3   13 3  o 791.3918 13.23112 121.8264       4.066457      127.0040       5.781274      116.7564       5.720879  807.3688 18.43842 774.0259 19.03177 33.34283       26.49874 
1 1 1 3   13 4  o 428.6225 16.02988 35.76905       2.668291      35.70747       3.587088      35.84533       3.992444  427.2382 21.69057 427.6888 24.13575 -0.4506531     32.45020 
1 1 1 3   13 5  o 607.0925 14.03358 71.71803       3.308655      73.60950       4.533633      69.56260       4.839630  614.5047 18.99736 597.1347 20.86949 17.37000       28.22118 
1 1 1 3   13 6  o 781.8688 21.55553 119.3154       6.545166      126.2550       9.498383      113.0409       9.031761  802.2313 30.48752 759.0514 30.63891 43.17993       43.22304 
1 1 1 3   13 7  o 441.6190 16.51969 37.98615       2.833202      38.02454       3.125463      37.80917       6.710146  441.6957 18.22062 435.5942 40.11716 6.101471       44.06106 
1 1 1 3   13 8  o 806.6003 14.74614 126.6392       4.619179      130.1602       5.293813      115.4054       9.455765  817.4606 16.67530 766.6229 31.76047 50.83777       35.87190 
1 1 1 3   13 9  o 557.1539 17.74533 60.48161       3.839611      60.75862       4.438877      59.65842       7.652000  558.1144 20.47962 549.3093 36.07034 8.805176       41.47871 
1 1 1 3   13 10 o 420.1018 16.80219 34.36785       2.741248      35.45681       4.089129      33.47903       3.694289  425.2679 24.86770 413.4728 23.09914 11.79514       33.94073 
1 1 1 3   13 11 f 1297.721 14.19139 327.6194       7.152115      325.6909       10.07438      329.5790       10.15534  1292.694 20.06756 1300.378 20.10930 -7.683228      28.40935 
1 1 1 3   13 12 o 610.6512 18.27602 72.60748       4.334140      70.51078       5.015767      78.78750       8.611192  601.4547 21.47367 632.8083 35.17879 -31.35358      41.21488 
1 1 1 3   13 13 o 64.27046 31.45900 -5.102412      2.633199      -4.550438      3.493344      -5.828682      4.007111  82.51891 39.33770 85.87522 41.25645 -3.356316      57.00481 
1 1 1 3   13 14 o 701.6100 22.99056 95.91654       6.264312      0.000000       0.000000      95.91654       6.264312  ?        ?        701.6100 22.99056 0.000000       22.99056 
1 1 1 3   13 15 o 545.3016 27.24376 57.99312       5.769414      0.000000       0.000000      57.99312       5.769414  ?        ?        545.3016 27.24376 0.000000       27.24376 
1 1 1 3   13 16 o 996.8132 15.30760 193.1870       5.925827      198.8324       8.277390      187.2516       8.487322  1010.696 21.08845 980.6835 22.28506 30.01294       30.68137 
1 1 1 3   13 17 f 642.7919 18.32511 80.37344       4.574515      80.92110       6.142898      79.69164       6.854051  644.5230 24.54183 639.3378 27.60507 5.185181       36.93699 
1 1 1 3   13 18 o 1456.380 16.20154 412.4595       9.163446      407.2791       12.59915      418.2773       13.35171  1446.238 22.43229 1465.443 23.46065 -19.20508      32.45935 
1 1 1 3   13 19 o 469.3073 24.50567 43.04395       4.450846      45.51903       5.955481      39.91249       6.698771  481.5822 32.02591 449.6465 38.73967 31.93570       50.26352 
1 1 1 3   13 20 o 411.5821 28.88918 33.24586       4.588380      28.11869       6.033524      40.27794       7.066000  375.9614 42.04363 451.0416 40.78041 -75.08026      58.57225 
1 1 1 3   13 21 o 930.3024 18.16561 168.4756       6.562994      171.5689       9.025523      165.0046       9.560516  937.7920 24.78209 919.3179 26.77859 18.47406       36.48623 
1 1 1 3   13 22 o 463.9363 43.42469 42.78626       7.732881      50.72406       10.51893      33.45184       11.40684  502.2552 54.81881 399.8769 76.23603 102.3783       93.89906 
1 1 1 3   13 23 o 130.3693 56.98943 -0.9393535     5.473172      -4.861868      6.311717      10.95091       10.98907  122.2169 56.50815 245.6978 89.19695 -123.4810      105.5901 
1 1 1 3   13 24 o 567.4583 25.81395 62.97676       5.688745      63.26069       7.590949      62.61301       8.591915  566.0877 34.69642 561.7764 39.63636 4.311340       52.67715 
1 1 1 3   13 25 o 671.2033 23.33668 88.10910       6.083046      91.63727       8.175515      83.73331       9.104770  682.6926 30.83628 650.1092 36.20606 32.58344       47.55791 
1 1 1 3   13 26 o 194.5305 71.05809 6.887812       6.989579      -6.697972      9.339403      24.18567       10.53836  146.6472 68.12928 329.3839 82.54789 -182.7366      107.0315 
1 1 1 3   13 27 o 361.6121 46.94820 26.84757       6.437537      33.87370       9.992122      21.86174       8.417221  396.6051 67.27854 315.5446 70.46827 81.06049       97.42782 
1 1 1 3   13 28 o 282.3642 54.33313 17.00414       5.741742      14.98156       7.754435      19.45889       8.542788  257.4982 73.76422 292.5455 74.87807 -35.04724      105.1089 
1 1 1 3   13 29 o 172.8108 63.04558 5.773003       5.499697      12.45080       7.659658      -1.333076      7.901469  233.2546 74.72108 148.6703 66.54147 84.58430       100.0550 
1 1 1 3   13 30 o 323.7404 44.43592 22.01276       5.439382      17.92539       7.899775      25.69753       7.500632  275.1737 72.79775 341.3105 58.70414 -66.13678      93.51839 
1 1 1 3   14 0  o 609.9029 16.54036 72.45206       3.917722      75.78659       4.990932      67.09897       6.323637  623.2518 20.62007 585.3033 27.82005 37.94843       34.62864 
1 1 1 3   14 1  o 347.6367 20.31145 23.65429       2.730241      25.43614       3.760306      21.66761       3.970554  359.4557 27.13706 330.8146 31.27672 28.64108       41.40837 
1 1 1 3   14 2  o 666.8414 14.16727 86.54102       3.668907      88.93457       5.200526      84.16927       5.176792  675.2714 19.83083 656.8629 20.29355 18.40851       28.37411 
1 1 1 3   14 3  o 160.3178 37.49157 5.269341       2.292556      4.203816       3.104347      6.547588       3.400132  147.1462 47.61444 178.2793 48.03009 -31.13316      67.63153 
1 1 1 3   14 4  o 787.7895 16.74904 120.8942       5.124225      130.0198       9.712814      117.3746       6.031981  813.9166 30.72820 775.7067 20.02325 38.20996       36.67633 
1 1 1 3   14 5  f 576.9734 18.67907 64.89850       4.185420      65.81589       7.820168      64.53022       4.954802  577.1423 35.05635 574.8651 22.19384 2.277222       41.49113 
1 1 1 3   14 6  o 303.3485 29.41907 18.20657       3.422195      17.50380       4.043001      19.98252       6.427024  296.0258 35.90240 311.3100 55.18068 -15.28421      65.83229 
1 1 1 3   14 7  o 298.1096 22.04418 17.44167       2.534003      16.14241       2.763586      24.30116       6.349968  286.2629 25.11253 346.2165 48.56348 -59.95358      54.67222 
1 1 1 3   14 8  f 353.8137 18.71714 24.46441       2.562681      23.84746       2.767329      28.17897       6.790277  349.0855 20.50272 373.6687 47.89442 -24.58319      52.09834 
1 1 1 3   14 9  o 531.8345 15.95297 55.05959       3.294929      53.55607       3.628073      62.13697       7.871514  524.3615 17.81629 560.9407 36.32895 -36.57928      40.46249 
1 1 1 3   14 10 o 696.3733 17.36199 94.41689       4.695367      91.05337       5.409837      104.6877       9.453424  683.5104 20.38033 730.6463 33.31608 -47.13593      39.05533 
1 1 1 3   14 11 o 904.7007 13.84181 159.1750       4.863240      165.0131       7.092332      153.9938       6.681371  920.3979 19.84200 889.2045 19.34799 31.19348       27.71371 
1 1 1 3   14 12 o 381.5924 20.26558 28.43759       2.992451      26.30660       4.338552      30.37131       4.132865  365.5473 30.84962 393.5152 27.21052 -27.96796      41.13528 
1 1 1 3   14 13 o 1080.324 14.39641 226.9295       6.039993      223.6120       8.434363      230.4216       8.653533  1071.691 20.26537 1087.856 20.48303 -16.16431      28.81388 
1 1 1 3   14 14 o 431.3161 20.97092 36.21734       3.512702      35.65226       4.792536      36.87331       5.163613  426.4490 29.11208 433.4717 30.87540 -7.022644      42.43587 
1 1 1 3   14 15 o 335.4968 26.71881 22.07870       3.452380      18.37896       4.500544      27.36867       5.381527  303.9656 39.02662 372.1182 37.76196 -68.15265      54.30509 
1 1 1 3   14 16 o 682.2995 17.21986 90.53816       4.562812      88.35367       6.188251      93.14067       6.754440  673.5480 23.65764 691.4199 25.15472 -17.87189      34.53178 
1 1 1 3   14 17 o 583.4355 19.81283 66.24033       4.489184      67.93171       6.043213      64.15781       6.705669  590.3466 26.35924 572.5794 30.26380 17.76721       40.13362 
1 1 1 3   14 18 o 241.8685 44.12131 11.84238       3.991637      8.958580       5.218379      15.90918       6.196976  210.0484 60.61085 278.2141 59.17501 -68.16573      84.70747 
1 1 1 3   14 19 o 344.6012 32.91467 23.43674       4.351312      22.64073       5.692119      24.55595       6.749477  336.3453 44.68323 348.9571 51.33912 -12.61182      68.06097 
1 1 1 3   14 20 o 382.6142 31.31051 28.82167       4.611672      30.18138       6.022118      26.89361       7.171093  389.8713 40.35846 365.0350 52.06005 24.83630       65.87150 
1 1 1 3   14 21 o 881.4377 21.17654 151.3995       7.248943      148.4091       8.563826      158.9572       13.61429  872.0307 25.28762 899.3690 38.97887 -27.33826      46.46306 
1 1 1 3   14 22 o 245.2026 71.91028 12.45690       7.292487      8.352057       9.530759      18.25420       11.32640  222.7757 82.69977 294.5162 90.38235 -71.74048      122.5080 
1 1 1 3   14 23 o 211.0405 59.20987 9.213320       5.050147      15.50790       6.611852      0.3987045      7.824224  271.9371 63.72111 163.0112 69.67519 108.9259       94.41933 
1 1 1 3   14 24 o 522.2365 28.81294 53.65413       5.821022      58.71698       7.710687      46.94516       8.876128  544.2538 36.69494 482.7608 47.97946 61.49298       60.40320 
1 1 1 3   14 25 o 448.5642 37.22768 40.12727       6.426525      45.52343       10.12418      36.48566       8.316959  470.3003 56.56605 422.4028 51.78482 47.89746       76.69019 
1 1 1 3   14 26 o 723.4606 30.94129 103.3640       8.693233      119.7516       11.96277      85.02634       12.65455  773.4435 39.96330 645.2711 50.91184 128.1724       64.72311 
1 1 1 3   14 27 f 355.9817 42.28821 25.86134       5.731856      27.25333       7.678376      24.10934       8.614241  358.8553 57.00227 330.8788 69.26014 27.97653       89.70075 
1 1 1 3   14 28 o 441.3003 35.43149 39.28060       6.021081      45.24498       8.408362      33.00346       8.625997  467.4837 46.94889 392.0069 58.44800 75.47675       74.96911 
1 1 1 3   14 29 o 119.1273 53.96487 -2.006136      5.376722      -5.329947      7.636127      1.262039       7.571947  130.0413 60.80872 156.9623 67.83335 -26.92099      91.09920 
1 1 1 3   14 30 o 361.5580 39.37859 27.03510       5.439836      33.01046       7.831217      21.46348       7.562022  390.8883 52.95093 305.7605 65.64533 85.12784       84.33926 
1 1 1 3   15 0  o 338.8266 22.17024 22.51597       2.901180      21.59226       4.025578      23.51422       4.184831  330.0245 31.80266 344.5583 31.62730 -14.53381      44.85192 
1 1 1 3   15 1  o 548.4440 16.10276 58.58423       3.429736      60.98931       4.801077      56.07776       4.901231  558.8378 22.12203 535.6584 23.56076 23.17932       32.31863 
1 1 1 3   15 2  o 100.0159 40.68446 0.8113041      2.479442      -1.425840      3.335654      3.573559       3.706516  96.22230 43.13873 144.2702 51.88416 -48.04795      67.47529 
1 1 1 3   15 3  o 374.6117 48.95424 28.42686       6.951626      28.42686       6.951626      0.000000       0.000000  374.6117 48.95424 ?        ?        0.000000       48.95424 
1 1 1 3   15 4  o 687.6074 16.20704 92.07852       4.327851      93.54638       6.658248      91.00464       5.695024  691.7059 24.78623 682.8273 21.47616 8.878540       32.79608 
1 1 1 3   15 5  o 757.4269 15.92603 111.7068       4.684639      116.4997       7.317057      108.3776       6.098372  772.0704 24.40347 745.2833 21.07000 26.78711       32.24088 
1 1 1 3   15 6  o 998.5579 19.32204 194.3739       7.492975      194.2987       9.641662      194.4887       11.90645  997.0837 24.89960 995.8755 30.78571 1.208191       39.59482 
1 1 1 3   15 7  o 516.2452 15.34699 51.87092       3.076855      52.84254       3.371704      47.03310       7.523604  520.9490 16.66580 486.6984 40.16383 34.25061       43.48427 
1 1 1 3   15 8  o 693.6421 14.09348 93.59644       3.796484      94.10237       4.180921      91.21866       9.063790  695.3836 15.48173 680.8737 34.38929 14.50989       37.71349 
1 1 1 3   15 9  o 322.7553 22.75871 20.41546       2.834378      22.14617       3.105083      11.76783       6.940805  336.0652 23.94814 238.8292 70.18734 97.23608       74.16048 
1 1 1 3   15 10 f 365.9028 26.12709 26.26389       3.688246      27.99843       4.321001      21.60807       7.079301  377.3034 29.73025 324.8271 58.25949 52.47635       65.40685 
1 1 1 3   15 11 o 687.7012 14.84915 91.97382       3.965786      103.8884       5.989233      82.67121       5.292166  730.3163 21.11700 651.5042 20.91646 78.81213       29.72248 
1 1 1 3   15 12 o 721.7422 14.99868 101.2945       4.204004      97.81859       6.024000      104.5946       5.869720  708.6769 21.88813 732.9370 20.62162 -24.26007      30.07227 
1 1 1 3   15 13 o 956.7797 14.39469 177.9700       5.348627      175.3537       7.544832      180.6132       7.583519  949.1353 20.46885 963.2866 20.27157 -14.15125      28.80816 
1 1 1 3   15 14 o 763.2123 15.44537 113.2533       4.577956      110.5542       6.407892      116.0671       6.542626  753.5712 21.89591 772.1384 21.81871 -18.56726      30.91095 
1 1 1 3   15 15 o 475.6697 20.90656 44.03700       3.862034      40.08406       5.244394      48.72063       5.708563  452.2806 30.02861 498.8804 29.59704 -46.59982      42.16280 
1 1 1 3   15 16 o 325.7145 30.03619 20.87590       3.756552      22.86440       4.958232      18.19637       5.755639  339.6849 38.25139 299.9328 51.25402 39.75211       63.95423 
1 1 1 3   15 17 o 1186.921 15.94911 273.9764       7.351676      268.7531       9.949473      280.2576       10.91054  1174.764 21.80829 1199.378 23.42406 -24.61462      32.00450 
1 1 1 3   15 18 o 975.3364 16.71724 185.0674       6.332088      188.5345       8.679561      181.1226       9.258280  983.6413 22.72129 963.8007 24.73518 19.84058       33.58699 
1 1 1 3   15 19 o 439.5432 36.93779 38.15192       6.246762      38.15192       6.246762      0.000000       0.000000  439.5432 36.93779 ?        ?        0.000000       36.93779 
1 1 1 3   15 20 o 442.3450 32.52145 38.51060       5.547573      36.10629       6.364057      46.11875       11.32081  427.0065 38.80055 476.3574 62.72005 -49.35086      73.75153 
1 1 1 3   15 21 o 379.6140 38.24407 28.60369       5.561327      30.34148       6.421457      23.38895       11.12374  389.9718 43.12223 330.7902 85.84610 59.18158       96.06810 
1 1 1 3   15 22 o 322.0602 47.92574 21.00135       5.811572      15.54791       9.130966      24.71477       7.534749  271.7807 80.67140 346.9781 57.96094 -75.19742      99.33451 
1 1 1 3   15 23 f 285.4584 58.77007 16.99679       6.298107      42.38847       10.63115      3.266477       7.817625  453.6950 61.95727 178.1333 72.32527 275.5618       95.23470 
1 1 1 3   15 24 o 202.5956 61.07984 8.503944       5.204439      15.89629       6.988115      -0.7030860     7.798816  272.7178 66.56469 155.8340 68.07705 116.8839       95.21210 
1 1 1 3   15 25 f 225.3637 65.07269 10.83948       6.013189      18.73569       9.119259      4.765013       7.998421  290.7314 78.79836 186.0499 73.96897 104.6815       108.0768 
1 1 1 3   15 26 o 351.5969 45.42554 25.34552       6.057548      21.90212       7.254273      33.27692       11.00968  320.0658 60.58004 387.4769 75.87976 -67.41113      97.09624 
1 1 1 3   15 27 o 318.3116 51.16876 21.33104       6.111069      25.48730       7.554982      13.46506       10.39342  344.7000 58.53031 245.8606 87.04445 98.83934       104.8930 
1 1 1 3   15 28 o 148.9239 60.30864 2.820006       5.420503      3.169835       7.642148      2.465822       7.689569  168.4630 70.25550 164.9604 69.73417 3.502594       98.98833 
1 1 1 3   15 29 o 379.7007 37.67717 29.57648       5.482457      41.18716       7.747103      17.92817       7.759642  443.3991 45.64209 275.7591 71.76520 167.6400       85.04966 
1 1 1 3   16 0  o 283.6642 26.87463 15.88774       2.925255      16.18211       4.023822      15.55779       4.260158  284.1542 37.36972 277.7337 40.70559 6.420563       55.25795 
1 1 1 3   16 1  o 697.5031 18.46538 94.82249       5.001870      100.2916       9.296470      92.59418       5.933984  714.2903 33.51316 688.6897 22.18680 25.60059       40.19186 
1 1 1 3   16 2  o 829.1083 14.54454 133.7852       4.683164      127.9346       6.402940      140.5153       6.867416  809.8954 20.35741 848.6936 20.83600 -38.79822      29.13011 
1 1 1 3   16 3  o 708.1964 16.57401 97.66779       4.558366      93.91734       6.980470      100.4561       6.018891  693.0294 25.93612 717.5171 21.60013 -24.48767      33.75274 
1 1 1 3   16 4  o 651.8730 17.06459 82.75643       4.320030      89.01207       6.687106      78.27560       5.659548  674.8383 25.51588 633.2185 23.01443 41.61975       34.36166 
1 1 1 3   16 5  o 950.4212 14.45892 175.7512       5.336787      170.4835       7.136238      182.4357       8.038838  935.2795 19.64717 967.1774 21.40224 -31.89783      29.05283 
1 1 1 3   16 6  o 1486.241 15.35202 429.8359       8.861000      436.2096       12.47310      423.3417       12.59042  1495.697 21.47350 1473.318 22.00471 22.37952       30.74603 
1 1 1 3   16 7  o 194.5235 33.39050 7.620438       2.431604      6.854324       2.616943      12.46155       6.578402  183.4738 37.97870 244.7562 67.17262 -61.28239      77.16568 
1 1 1 3   16 8  o 449.2644 17.26922 39.28379       3.013025      38.63400       3.289654      42.66721       7.506576  445.4232 19.01732 463.7191 42.14310 -18.29599      46.23526 
1 1 1 3   16 9  o 372.0394 20.54927 27.03973       2.957510      26.17341       3.231790      31.50341       7.335870  365.7462 22.86763 396.6228 48.64599 -30.87653      53.75278 
1 1 1 3   16 10 o 917.5894 14.59587 163.7223       5.201234      163.2937       5.813368      165.4416       11.64466  916.2244 16.33797 919.8115 32.59867 -3.587158      36.46371 
1 1 1 3   16 11 o 1077.333 17.37553 225.7890       7.269694      227.4913       8.647541      221.6869       13.42377  1080.981 20.59901 1065.052 32.45456 15.92957       38.43980 
1 1 1 3   16 12 o 194.9337 39.42904 7.707547       2.882365      7.504520       4.492782      7.849565       3.757594  193.0061 56.39760 195.9384 49.39504 -2.932343      74.97039 
1 1 1 3   16 13 o 993.6391 14.62257 191.9352       5.642615      188.7532       7.992344      195.0974       7.967440  984.7785 20.89814 1001.237 20.49057 -16.45831      29.26765 
1 1 1 3   16 14 o 705.7138 16.21166 96.84219       4.443081      100.6175       6.374614      93.27530       6.196118  718.8425 22.83453 692.0997 23.05277 26.74286       32.44759 
1 1 1 3   16 15 o 943.7842 15.42175 173.1879       5.652418      166.7456       7.807183      180.2850       8.194312  925.4628 21.72238 962.2786 21.92723 -36.81586      30.86527 
1 1 1 3   16 16 o 308.3166 32.19953 18.77359       3.798561      19.90526       5.191339      17.46947       5.572885  315.4815 43.53143 293.6494 50.70055 21.83212       66.82463 
1 1 1 3   16 17 o 544.0516 21.58245 57.65665       4.560043      57.21571       6.084881      58.22152       6.887125  540.5016 29.09573 544.6389 32.71291 -4.137207      43.78009 
1 1 1 3   16 18 o 776.4315 18.67272 117.3594       5.630392      107.7567       7.404931      130.5196       8.668740  743.1442 25.65783 817.6179 27.30094 -74.47369      37.46553 
1 1 1 3   16 19 o 837.4425 18.74735 136.5511       6.097095      134.7456       7.947182      139.1342       9.505836  831.0656 24.62350 843.7218 29.01102 -12.65619      38.05202 
1 1 1 3   16 20 o 1001.367 20.63542 195.3996       8.024804      202.1623       9.538687      179.0207       14.84470  1017.886 24.13022 953.8143 40.07557 64.07214       46.77946 
1 1 1 3   16 21 o 312.9809 43.22255 19.69663       5.113396      17.58545       6.669566      22.70709       7.964366  290.8798 60.99005 330.5052 64.36517 -39.62540      88.67165 
1 1 1 3   16 22 o 301.4762 55.95553 18.78472       6.310050      32.22037       10.44568      11.06469       7.918025  391.3043 71.36722 233.4849 76.07764 157.8194       104.3125 
1 1 1 3   16 23 o 581.9324 30.80381 66.76476       6.936747      63.56996       11.79337      68.45473       8.577414  558.6513 55.07526 587.0457 37.82459 -28.39435      66.81306 
1 1 1 3   16 24 o 351.8256 46.17259 25.22274       6.156374      22.72374       9.339298      27.14309       8.186926  321.9681 75.92601 359.3785 60.83023 -37.41037      97.28862 
1 1 1 3   16 25 f 414.9869 34.12790 34.38528       5.451374      33.56047       7.414409      35.35580       8.042673  404.5574 48.13697 414.0235 51.10502 -9.466125      70.20605 
1 1 1 3   16 26 o 140.2852 58.23904 1.619505       5.217578      8.403557       7.207700      -5.849132      7.562628  203.8373 72.45266 129.7448 60.61927 74.09242       94.46737 
1 1 1 3   16 27 o 276.3862 60.05892 16.78827       6.262272      20.71003       7.835613      9.854517       10.41877  303.1354 68.20836 221.3422 85.47018 81.79327       109.3505 
1 1 1 3   16 28 o 297.1466 49.03271 18.82962       5.460903      24.86983       7.557316      12.22949       7.899831  335.4213 60.22972 229.3476 76.05167 106.0736       97.01276 
1 1 1 3   17 0  o 580.9984 20.73345 65.81658       4.678153      53.27832       8.188257      71.89246       5.700030  518.1021 41.03128 606.7740 24.18924 -88.67194      47.63072 
1 1 1 3   17 1  o 600.4570 18.59826 70.23923       4.336928      70.77081       6.681910      69.85229       5.700923  601.3870 28.61005 598.0782 24.54478 3.308716       37.69590 
1 1 1 3   17 2  o 298.8417 28.84962 17.63283       3.306563      14.72919       4.946649      19.97816       4.445729  268.4610 49.26162 316.7301 36.83083 -48.26910      61.50786 
1 1 1 3   17 3  o 213.0199 39.73256 9.212837       3.166050      7.619750       4.569114      10.68423       4.391129  193.5282 56.96753 227.6404 50.94253 -34.11224      76.42278 
1 1 1 3   17 4  o 488.0146 18.31362 46.37691       3.470843      48.87080       4.645736      43.22644       5.221601  500.4632 23.90311 469.3016 28.78902 31.16156       37.41879 
1 1 1 3   17 5  o 630.5729 18.54313 77.42343       4.540947      80.20832       5.297041      69.70341       8.819391  641.5342 21.26109 594.4147 38.41053 47.11951       43.90219 
1 1 1 3   17 6  f 196.9441 39.72512 7.888412       2.933508      6.636203       3.709151      9.979865       4.793581  180.5934 50.77010 219.9367 55.97985 -39.34329      75.57345 
1 1 1 3   17 7  o 114.4565 42.38324 2.010546       2.500182      2.688925       2.687815      -2.345637      6.811085  125.1158 44.26842 139.7068 62.20810 -14.59108      76.35143 
1 1 1 3   17 8  o 150.7386 42.43386 4.586222       2.589291      5.236634       2.809838      0.9241542      6.667303  160.6142 43.82682 155.4856 65.28765 5.128616       78.63376 
1 1 1 3   17 9  o 914.0458 14.31669 162.4394       5.082045      156.8199       5.573162      190.1743       12.38132  897.9544 15.98157 986.4156 32.32056 -88.46118      36.05592 
1 1 1 3   17 10 o 285.8851 29.48425 16.11775       3.226493      14.52696       3.540450      23.91265       7.837146  270.4378 34.49603 342.3493 61.19273 -71.91150      70.24619 
1 1 1 3   17 11 o 1001.375 15.25246 194.9606       5.931499      197.4076       6.710819      186.2226       12.68144  1007.469 17.15204 976.3029 33.44691 31.16608       37.58841 
1 1 1 3   17 12 o 326.5227 34.39112 21.06005       4.295438      20.42635       5.084405      22.64001       8.028240  320.1894 41.89363 332.4100 64.51648 -12.22061      76.92498 
1 1 1 3   17 13 o 308.0463 27.47291 18.64624       3.252120      22.84034       5.051126      15.67669       4.250250  339.3927 39.03362 280.1353 40.22159 59.25732       56.04819 
1 1 1 3   17 14 o 612.8117 17.76895 73.05183       4.228797      65.64603       6.057676      80.09152       5.906051  580.2495 26.88210 641.2109 23.71747 -60.96136      35.84921 
1 1 1 3   17 15 o 379.9496 25.56443 28.27194       3.750219      26.63351       5.434459      29.76155       5.181780  366.6491 38.75340 388.5258 34.70781 -21.87677      52.02363 
1 1 1 3   17 16 o 260.0035 38.62239 13.54062       3.781334      16.45868       5.331029      10.58598       5.364353  284.7229 50.03888 226.6705 59.99945 58.05237       78.12697 
1 1 1 3   17 17 o 824.6106 17.39822 132.3327       5.571624      126.6767       7.671360      138.6469       8.105483  805.9100 24.51082 843.0901 24.75580 -37.18018      34.83719 
1 1 1 3   17 18 o 1111.895 17.04276 240.6064       7.359218      245.5730       10.13207      235.0605       10.70670  1122.223 23.24829 1097.555 25.11894 24.66772       34.22637 
1 1 1 3   17 19 o 512.3646 29.09797 51.49490       5.766003      51.14682       6.695580      52.49392       11.34315  509.6821 34.02228 509.7598 58.34911 -0.7769775E-01 67.54357 
1 1 1 3   17 20 o 1167.021 17.61302 265.2125       7.982526      263.7625       10.79439      266.9623       11.85849  1162.431 23.91128 1168.869 26.12375 -6.437378      35.41468 
1 1 1 3   17 21 o 733.7341 20.81663 105.0263       5.931674      104.7191       7.853435      105.4342       9.050698  731.3630 27.65023 732.8910 31.79909 -1.528015      42.13926 
1 1 1 3   17 22 o 846.2499 20.24454 139.7901       6.653259      139.7595       8.848500      139.8300       10.09189  844.4415 26.98188 843.4676 30.80890 0.9738770      40.95375 
1 1 1 3   17 23 o 176.8169 72.40470 3.196854       7.918722      0.000000       0.000000      3.196854       7.918722  ?        ?        176.8169 72.40470 0.000000       72.40470 
1 1 1 3   17 24 o 428.6340 33.66062 36.61356       5.558143      29.09208       7.351381      46.65079       8.492284  375.0717 51.85637 479.0477 46.22137 -103.9760      69.46581 
1 1 1 3   17 25 o 210.9305 60.05367 9.578737       5.155752      12.50961       7.096313      6.301978       7.503371  238.2068 71.21171 190.5201 72.79348 47.68666       101.8332 
1 1 1 3   17 26 f 129.0773 55.36695 0.4316432      4.972272      -5.768037      7.043096      6.591905       7.020669  123.7404 58.03296 187.9529 70.74010 -64.21246      91.49856 
1 1 1 3   17 27 o 130.4463 57.90407 -0.8620461     5.855853      -13.17982      7.062187      26.24289       10.47604  102.2950 50.36082 329.6359 82.13367 -227.3410      96.34393 
1 1 1 3   17 28 o 536.4900 29.08021 57.67241       6.036177      77.62218       8.888851      40.60001       8.222880  616.6592 37.29237 437.2362 49.28590 179.4230       61.80470 
1 1 1 3   18 0  o 502.6897 22.05393 49.25874       4.305404      55.59140       6.887074      45.19630       5.516139  531.6524 33.52812 479.8526 29.74715 51.79980       44.82218 
1 1 1 3   18 1  o 320.0639 29.56833 20.19507       3.633745      25.65486       5.731103      16.52469       4.699006  358.6806 41.93523 286.4789 43.61283 72.20178       60.50324 
1 1 1 3   18 2  o 439.9307 20.45512 37.70127       3.494736      35.55507       4.730660      40.27967       5.185154  425.6044 28.79052 452.9821 29.63833 -27.37769      41.31979 
1 1 1 3   18 3  o 725.3336 15.89757 102.3499       4.478129      99.85857       6.057590      105.3523       6.649823  715.8627 21.78924 735.1063 23.29335 -19.24353      31.89594 
1 1 1 3   18 4  o 215.3805 43.07214 9.441322       3.476847      10.05251       3.939017      7.285668       7.397611  221.6962 47.19869 204.2705 73.31614 17.42578       87.19503 
1 1 1 3   18 5  o 160.1415 45.59485 5.176655       2.971929      2.951037       3.757032      8.897593       4.857870  139.2258 51.87598 208.5454 57.91739 -69.31969      77.75308 
1 1 1 3   18 6  o 576.8811 17.66749 64.75262       3.958122      64.57830       5.202222      64.99226       6.099504  575.6729 23.26940 577.1403 27.21354 -1.467346      35.80561 
1 1 1 3   18 7  o 289.9778 25.30266 16.51578       2.820889      17.28446       3.046823      11.90190       7.464630  296.5058 26.74775 242.2622 73.17516 54.24358       77.91050 
1 1 1 3   18 8  o 1207.141 14.64785 283.3083       6.866883      292.8307       7.854560      252.4268       14.14486  1227.055 16.48276 1136.754 32.04087 90.30090       36.03191 
1 1 1 3   18 9  o 774.8961 14.95079 116.7413       4.499204      117.6574       4.994210      112.7950       10.36540  777.8230 16.53324 759.5554 35.13976 18.26764       38.83491 
1 1 1 3   18 10 o 908.6309 14.98224 160.5091       5.286791      162.6041       5.922287      152.2887       11.73114  914.4091 16.67711 882.8046 34.21746 31.60449       38.06522 
1 1 1 3   18 11 o 274.4646 34.04669 14.94012       3.551094      17.11076       3.977968      6.423451       7.879581  293.7437 35.59797 202.0695 75.15942 91.67419       83.16342 
1 1 1 3   18 12 o 320.5839 31.36834 20.25379       3.855322      23.55076       4.346156      8.080437       8.351272  345.7113 32.76265 216.5120 77.87872 129.1993       84.48956 
1 1 1 3   18 13 f 392.5508 23.64725 30.12874       3.588167      37.28796       5.650013      25.28960       4.645161  435.4799 33.66980 358.1207 33.79948 77.35922       47.70807 
1 1 1 3   18 14 o 199.2880 46.15702 8.125525       3.502067      11.40011       5.571220      5.986340       4.502940  235.1325 60.62286 176.4135 57.36619 58.71901       83.46263 
1 1 1 3   18 15 o 545.0010 20.45931 57.84511       4.330283      57.22572       6.418555      58.36254       5.866502  540.2271 30.72068 546.0681 27.75465 -5.841003      41.40146 
1 1 1 3   18 16 o 865.8271 16.77917 145.8730       5.641957      147.6414       8.039031      144.1565       7.920160  870.1354 23.78969 859.8154 23.71924 10.32007       33.59393 
1 1 1 3   18 17 o 620.8531 20.44570 75.09242       4.929680      82.78982       7.078338      67.84235       6.869589  650.9677 27.99908 588.2354 30.17280 62.73230       41.16244 
1 1 1 3   18 18 o 546.0845 26.56659 58.24621       5.634089      54.03451       6.940856      66.38201       9.646832  523.8619 34.30627 578.6554 43.24007 -54.79346      55.19622 
1 1 1 3   18 19 o 534.7745 25.51683 55.86470       5.299384      67.55903       7.376554      43.39162       7.618207  586.1213 32.53481 467.0261 42.46741 119.0953       53.49762 
1 1 1 3   18 20 o 256.9019 50.24036 13.58303       4.832839      17.62966       6.344336      7.988571       7.459658  291.3942 58.10136 208.0179 73.73275 83.37631       93.87378 
1 1 1 3   18 21 o 805.7616 20.47076 126.7386       6.405727      127.0656       8.484355      126.3050       9.769004  805.1945 27.13251 801.5317 31.38352 3.662842       41.48612 
1 1 1 3   18 22 o 291.8943 54.54545 17.76538       5.955826      8.510464       9.020720      24.91741       7.929936  216.7697 80.45921 344.2325 61.57911 -127.4628      101.3196 
1 1 1 3   18 23 o 522.2258 33.26032 54.18694       6.710365      32.43362       11.15959      66.50693       8.398282  383.6861 77.56058 576.9646 37.68824 -193.2785      86.23251 
1 1 1 3   18 24 o 227.3661 59.04840 11.14789       5.260416      2.036504       7.123713      22.07428       7.801044  161.3266 67.59956 318.7589 65.21568 -157.4323      93.92970 
1 1 1 3   18 25 o 156.7892 59.15881 4.181974       4.916810      7.637143       6.882281      0.5801635      7.026810  195.6660 70.65682 151.1358 65.33060 44.53027       96.23135 
1 1 1 3   18 26 o 376.0618 37.65822 28.84481       5.425886      40.82484       8.018266      18.72512       7.369450  442.1870 47.43321 287.3386 67.23408 154.8484       82.28202 
1 1 1 3   18 27 o 328.3662 49.93303 23.05408       6.166950      25.55120       7.296393      16.80865       11.53905  341.4921 57.02851 258.1206 91.68086 83.37146       107.9705 
1 1 1 3   19 0  o 721.7111 18.74990 101.3830       5.255214      107.0947       8.529831      97.88865       6.671853  740.4316 29.66385 708.5946 24.24491 31.83704       38.31135 
1 1 1 3   19 1  o 162.6193 47.82062 5.302557       3.221086      10.55688       4.202191      -2.182769      5.015597  227.1005 49.07840 117.9550 52.88881 109.1455       72.15203 
1 1 1 3   19 2  o 370.1337 28.75319 26.90489       4.100631      27.56665       4.632750      24.51043       8.812394  374.1593 32.19621 344.4565 68.28940 29.70276       75.49860 
1 1 1 3   19 3  o 394.2616 23.01204 30.38761       3.508138      28.48756       4.661582      32.86911       5.327312  380.4904 31.83994 408.5608 33.88131 -28.07034      46.49435 
1 1 1 3   19 4  o 525.3697 19.00551 53.71474       3.877685      52.46204       5.110044      55.41536       5.953927  518.7576 25.36484 532.0701 28.92286 -13.31244      38.46956 
1 1 1 3   19 5  o 730.6314 16.21779 103.8183       4.601696      95.90179       5.959750      115.5059       7.241454  701.7741 21.86768 769.9218 24.21872 -68.14771      32.63038 
1 1 1 3   19 6  o 1413.249 15.65843 388.3685       8.593990      378.1532       11.54188      401.0789       12.87451  1393.704 21.32446 1435.006 23.10197 -41.30212      31.43936 
1 1 1 3   19 7  o 581.5695 20.67648 65.83086       4.669886      65.73144       5.397056      66.12707       9.315290  580.8975 23.92376 579.3271 41.68281 1.570435       48.06041 
1 1 1 3   19 8  f 417.6846 20.55964 33.95424       3.334971      35.88387       3.655391      24.37256       8.145476  428.7556 22.02749 345.4940 63.03080 83.26163       66.76894 
1 1 1 3   19 9  o 1058.706 14.89323 217.9073       6.123394      220.5791       6.879441      207.7170       13.43544  1065.018 16.63291 1031.129 33.55141 33.88879       37.44797 
1 1 1 3   19 10 o 324.4839 27.66515 20.67901       3.452916      19.70472       3.807338      25.19327       8.195414  316.1570 31.42564 351.5199 62.31488 -35.36292      69.79050 
1 1 1 3   19 11 o 994.9105 15.51735 192.4748       5.995557      189.8003       6.658563      203.9340       13.78273  987.8005 17.35734 1021.235 34.75215 -33.43439      38.84571 
1 1 1 3   19 12 o 856.6191 16.72827 142.7368       5.565020      140.2357       6.232381      152.5750       12.36081  848.8746 18.90525 882.8315 36.05298 -33.95697      40.70904 
1 1 1 3   19 13 o 1381.124 18.81442 371.2823       10.09140      370.3942       12.04434      373.3744       18.48598  1378.762 22.49395 1381.120 34.46539 -2.357544      41.15630 
1 1 1 3   19 14 o 199.0827 47.96487 8.131698       3.664510      8.865754       5.771893      7.636006       4.743067  210.1045 64.52747 194.6673 58.22429 15.43721       86.91296 
1 1 1 3   19 15 o 1148.340 16.00643 256.5588       7.138273      261.0695       10.43272      252.5883       9.788170  1157.147 23.21565 1138.407 22.13992 18.74011       32.08025 
1 1 1 3   19 16 o 583.6561 21.23609 66.38422       4.813483      64.96203       7.007648      67.65464       6.623196  575.3024 31.48463 588.3086 28.98908 -13.00623      42.79777 
1 1 1 3   19 17 o 374.5126 33.70264 27.71307       4.849329      31.67778       6.459540      22.59303       7.340611  398.7403 42.36300 331.6495 59.16337 67.09082       72.76626 
1 1 1 3   19 18 o 496.6828 25.16698 48.30765       4.838578      53.81101       6.907183      43.00485       6.780150  522.4851 34.22995 466.0347 37.78754 56.45044       50.98615 
1 1 1 3   19 19 o 424.9404 30.33014 35.58646       4.972426      33.00320       6.952409      38.29160       7.114538  405.5574 44.89542 437.9178 42.36303 -32.36044      61.72702 
1 1 1 3   19 20 o 894.8770 19.04187 156.2131       6.617607      167.2006       9.376571      145.3089       9.340951  923.9472 26.13177 860.8100 27.94189 63.13721       38.25727 
1 1 1 3   19 21 o 294.9843 53.61591 18.09312       5.915902      15.37700       9.033711      20.13256       7.827940  266.1435 80.52428 306.5073 67.58043 -40.36380      105.1250 
1 1 1 3   19 22 o 459.5240 35.98871 42.15787       6.371153      42.47925       9.666558      41.91104       8.471578  452.6591 56.19765 453.0085 48.93090 -0.3493042     74.51448 
1 1 1 3   19 23 o 233.0993 64.61718 11.81430       6.052640      6.373214       10.75635      14.33541       7.321815  209.5273 84.91895 254.6485 71.24060 -45.12115      110.8443 
1 1 1 3   19 24 o 687.3072 49.26748 97.46528       13.06317      97.46528       13.06317      0.000000       0.000000  687.3072 49.26748 ?        ?        0.000000       49.26748 
1 1 1 3   19 25 o 288.9008 44.73730 17.45154       4.857088      24.65867       7.442213      12.10403       6.410576  336.4890 59.10807 231.5333 67.28530 104.9557       89.56046 
1 1 1 3   19 26 o 133.8181 55.91311 1.549659       4.853434      -1.373495      6.928610      4.365930       6.800760  138.3119 62.07907 168.5539 67.79909 -30.24199      91.92675 
1 1 1 3   20 0  o 555.3182 23.43276 60.07484       5.053512      62.27032       5.824764      53.39201       10.16233  565.1152 26.54076 517.9600 51.19059 47.15515       57.66184 
1 1 1 3   20 1  o 867.2172 16.03435 146.2536       5.400167      145.5676       7.289716      147.0879       8.039146  864.6401 21.70937 868.8997 23.82387 -4.259521      32.23156 
1 1 1 3   20 2  o 631.0305 17.91908 77.46440       4.391310      80.08692       5.973796      74.38126       6.477204  641.1539 23.99165 617.6203 27.00462 23.53357       36.12269 
1 1 1 3   20 3  o 265.3412 34.63448 13.99267       3.483827      16.23441       4.610345      11.00874       5.319058  284.5539 43.06631 231.4437 59.00079 53.11018       73.04656 
1 1 1 3   20 4  o 1105.135 15.42711 237.4684       6.621067      240.8638       9.148446      233.7338       9.594689  1112.355 21.17756 1095.584 22.55055 16.77075       30.93569 
1 1 1 3   20 5  o 791.6949 16.34554 121.8864       5.025568      121.4402       6.671510      122.4717       7.641231  789.7954 21.75112 792.8302 24.81734 -3.034790      33.00017 
1 1 1 3   20 6  o 1150.678 15.49161 257.4418       6.922744      248.1213       9.186225      269.6922       10.53157  1129.039 20.95078 1176.796 23.04432 -47.75720      31.14443 
1 1 1 3   20 7  o 268.8296 39.51604 14.44849       4.002408      16.17487       4.576967      8.838197       8.250945  284.1071 42.81181 221.3987 77.63086 62.70842       88.65326 
1 1 1 3   20 8  o 732.9063 16.15608 104.4569       4.598460      106.4533       5.085280      95.50183       10.77014  739.7676 17.70075 697.0441 39.95289 42.72345       43.69840 
1 1 1 3   20 9  o 272.9537 31.79911 14.74690       3.307610      16.05267       3.596222      7.577396       8.426726  284.7149 33.14464 213.2312 78.00185 71.48367       84.75173 
1 1 1 3   20 10 o 1239.537 15.28753 298.7834       7.359102      297.5526       8.215441      303.7808       16.55485  1236.752 17.10489 1246.191 34.20682 -9.439209      38.24505 
1 1 1 3   20 11 o 718.1907 20.88401 100.4497       5.824810      103.7495       6.836218      91.70676       11.12755  729.5348 24.12914 681.8932 42.22770 47.64154       48.63532 
1 1 1 3   20 12 o 823.3749 17.68038 131.9351       5.653499      134.9038       6.412218      121.5702       11.98143  832.3474 19.83699 786.9504 39.20425 45.39697       43.93722 
1 1 1 3   20 13 o 517.1497 23.94336 52.15470       4.808718      52.22405       5.473973      51.92027       10.06432  516.4392 27.39119 509.5932 51.56464 6.846039       58.38826 
1 1 1 3   20 14 o 852.0285 21.25250 141.4592       7.032216      135.8229       8.327904      155.4642       13.12745  834.2051 25.70602 889.7936 37.98946 -55.58850      45.86937 
1 1 1 3   20 15 o 474.6049 24.24290 44.06039       4.453418      45.59842       6.792791      42.90096       5.897785  480.6177 36.66996 466.8938 32.73391 13.72391       49.15481 
1 1 1 3   20 16 o 273.4701 44.61218 15.13509       4.574580      7.886333       6.273722      23.36462       6.684684  202.4076 67.79248 339.1547 52.44442 -136.7471      85.71020 
1 1 1 3   20 17 o 523.5452 24.01861 53.52082       4.883488      57.73194       7.167363      49.87188       6.671822  541.1509 34.28171 502.7917 34.37481 38.35913       48.54753 
1 1 1 3   20 18 o 404.4635 29.72638 32.24567       4.636558      31.22679       6.676708      33.19466       6.443665  394.4027 44.36060 407.6483 41.27106 -13.24557      60.59012 
1 1 1 3   20 19 o 260.2875 48.33857 13.94910       4.706360      12.58392       6.635075      15.33147       6.676717  243.5579 67.70413 268.7372 64.74169 -25.17937      93.67677 
1 1 1 3   20 20 o 240.9134 60.46653 12.32834       5.648440      20.90447       9.612786      7.805754       6.980673  308.0740 79.73111 202.0574 71.35773 106.0165       106.9999 
1 1 1 3   20 21 o 465.5299 33.80074 43.12590       6.069179      66.54411       10.26128      30.52551       7.526906  573.0872 46.50663 384.7433 51.68219 188.3439       69.52637 
1 1 1 3   20 22 o 207.4461 59.18138 9.200950       5.001842      4.887144       6.820360      14.22096       7.357481  177.1607 68.94441 253.6629 71.57260 -76.50221      99.37791 
1 1 1 3   20 23 o 139.0727 60.08387 0.2665925      5.937058      0.2352170      11.09719      0.2791745      7.027364  182.1166 80.32972 149.9072 65.06564 32.20938       103.3750 
1 1 1 3   20 24 o 298.2102 52.69497 19.02409       5.879472      18.85469       10.88455      19.09388       6.986412  277.9720 89.07531 293.2185 63.21391 -15.24655      109.2264 
1 1 1 3   20 25 o 343.4496 56.24623 25.66516       7.242361      25.66516       7.242361      0.000000       0.000000  343.4496 56.24623 ?        ?        0.000000       56.24623 
1 1 1 3   21 0  o 663.8791 21.61923 85.81150       5.573874      86.78544       6.444320      82.91908       11.10564  667.3463 24.86554 648.3348 44.37473 19.01147       50.86661 
1 1 1 3   21 1  o 428.3759 28.01646 35.94382       4.635189      33.65199       5.263652      43.85889       9.781878  413.7128 33.03676 468.2164 54.83419 -54.50360      64.01731 
1 1 1 3   21 2  o 800.4772 16.75249 124.6210       5.207825      118.0212       6.980989      132.9030       7.820206  778.4325 23.09234 825.9098 24.38134 -47.47729      33.58133 
1 1 1 3   21 3  o 978.1315 15.93059 186.0465       6.051418      190.3488       8.397832      181.3996       8.727691  988.7433 21.87034 965.0450 23.28755 23.69836       31.94717 
1 1 1 3   21 4  o 1470.380 16.25629 420.4521       9.282802      411.5198       12.67146      430.7982       13.63743  1453.679 22.44554 1487.110 23.61356 -33.43115      32.57918 
1 1 1 3   21 5  o 825.6965 16.75705 132.6019       5.373361      134.6071       7.151324      130.0021       8.143060  831.4082 22.14849 816.6624 25.67539 14.74585       33.90843 
1 1 1 3   21 6  o 999.9552 16.06996 194.4601       6.240557      196.4885       8.424302      191.9935       9.290035  1004.532 21.59446 992.6358 24.09902 11.89600       32.35867 
1 1 1 3   21 7  o 329.8086 34.07875 21.49650       4.301957      19.61020       4.865200      28.25754       9.210890  313.5863 40.92577 371.2408 66.32147 -57.65454      77.93238 
1 1 1 3   21 8  o 532.6164 19.26703 55.21822       3.985267      55.08847       4.314526      55.97225       10.40131  531.8771 20.88785 530.0313 51.16710 1.845825       55.26640 
1 1 1 3   21 9  o 556.5818 18.88461 60.30048       4.081925      58.84343       4.471089      67.59422       10.00351  549.6615 20.94547 584.4337 44.40680 -34.77222      49.09864 
1 1 1 3   21 10 o 1248.388 15.58036 303.1488       7.553620      300.8466       8.422649      312.6102       17.07454  1243.364 17.44305 1263.329 34.80204 -19.96509      38.92868 
1 1 1 3   21 11 o 282.7189 35.63437 15.90865       3.825565      14.90498       4.230602      20.41019       8.959556  272.3633 41.29158 311.7543 74.93066 -39.39105      85.55466 
1 1 1 3   21 12 o 635.2050 23.74480 78.69067       5.857476      80.95146       6.924512      73.00342       10.98275  643.7594 27.69731 606.2479 47.01570 37.51154       54.56754 
1 1 1 3   21 13 o 434.8995 27.74110 37.09990       4.660904      36.93084       5.235988      37.74514       10.22949  433.3054 31.32657 429.9588 63.14431 3.346588       70.48800 
1 1 1 3   21 14 o 743.4691 19.94431 107.6911       5.758509      109.0312       6.529125      102.9981       12.21833  747.7417 22.48409 721.2180 43.83099 26.52374       49.26145 
1 1 1 3   21 15 o 472.8182 40.43065 44.36254       7.352527      44.36254       7.352527      0.000000       0.000000  472.8182 40.43065 ?        ?        0.000000       40.43065 
1 1 1 3   21 16 o 779.8032 18.77072 118.5006       5.684521      126.7367       8.570067      112.0302       7.596032  804.8211 27.41933 757.0075 25.83798 47.81360       37.67521 
1 1 1 3   21 17 o 448.5567 26.78912 39.53214       4.645316      49.06609       7.096945      32.38558       6.144456  497.4235 37.00294 402.8446 39.79540 94.57889       54.34052 
1 1 1 3   21 18 o 649.4608 21.42166 82.40817       5.402987      76.06366       7.844808      88.13360       7.452252  620.6265 32.66294 670.0303 28.63948 -49.40381      43.44062 
1 1 1 3   21 19 o 136.8578 57.45929 0.9526847      5.163300      -13.05863      8.984674      7.861758       6.309178  125.4718 60.65142 199.4048 67.97786 -73.93301      91.10205 
1 1 1 3   21 20 f 286.4576 50.98878 17.09329       5.464436      14.97166       9.164335      18.26377       6.806869  260.8046 81.50969 292.1855 61.91174 -31.38086      102.3567 
1 1 1 3   21 21 o 258.4941 50.91711 14.06676       4.929577      9.577106       7.124942      18.18941       6.827515  214.0296 72.24252 290.0497 62.45902 -76.02008      95.49928 
1 1 1 3   21 22 o 305.5009 44.54440 19.30914       5.129390      17.06120       7.333959      21.46171       7.176703  276.3547 68.64401 314.6786 60.92755 -38.32391      91.78326 
1 1 1 3   21 23 o 202.4353 65.52193 8.923085       5.878214      13.88408       11.11912      6.998785       6.925039  246.0364 89.66151 189.5750 70.47034 56.46138       114.0406 
1 1 1 3   21 24 o 263.1300 55.98847 15.21502       5.545574      14.03273       9.416707      15.84276       6.861635  242.6123 83.04662 262.7511 67.02877 -20.13873      106.7221 
1 1 1 3   21 25 o 469.1689 28.91214 44.13716       5.242239      53.61068       7.562142      35.37287       7.273566  511.2817 38.36495 409.6071 46.55169 101.6747       60.32354 
1 1 1 3   22 0  o 858.2119 17.13325 143.2863       5.710342      140.0913       7.654277      147.2965       8.575258  847.9194 23.24457 869.1592 25.40504 -21.23975      34.43438 
1 1 1 3   22 1  f 523.5490 25.45091 53.44573       5.174742      51.43908       5.902065      60.11545       10.76023  512.3835 29.78924 549.6072 50.99374 -37.22363      59.05726 
1 1 1 3   22 2  o 1067.428 19.08637 221.7659       7.912067      232.5615       9.561701      198.3209       14.09088  1092.596 22.53448 1006.402 36.05275 86.19366       42.51592 
1 1 1 3   22 3  o 506.3743 22.18516 49.95004       4.362769      56.21442       5.873961      42.24240       6.515575  535.9122 28.32399 462.9997 36.53313 72.91257       46.22681 
1 1 1 3   22 4  o 678.1896 28.01015 89.77667       7.377252      0.000000       0.000000      89.77667       7.377252  ?        ?        678.1896 28.01015 0.000000       28.01015 
1 1 1 3   22 5  o 257.4407 40.28625 13.31296       3.895684      19.76045       4.922917      2.511333       6.371944  314.5849 41.29293 162.3620 65.51463 152.2229       77.44206 
1 1 1 3   22 6  o 124.9359 50.18115 1.484117       3.719660      0.2163696      4.598976      3.882076       6.325076  126.7070 53.76634 171.3740 66.47700 -44.66708      85.49860 
1 1 1 3   22 7  o 891.1825 17.08644 154.5421       5.913523      149.7740       7.657854      161.5855       9.307368  876.6507 22.49327 909.9470 26.33800 -33.29633      34.63578 
1 1 1 3   22 8  o 294.6540 32.01739 17.18282       3.604790      17.91396       3.922784      13.21373       9.139827  300.5366 34.22021 255.8343 81.58704 44.70226       88.47298 
1 1 1 3   22 9  o 1014.610 19.03511 200.4480       7.500371      194.1867       8.707011      218.4592       14.76749  998.0953 22.46307 1055.444 36.02827 -57.34851      42.45734 
1 1 1 3   22 10 o 383.0154 26.88619 28.78599       3.973863      29.49123       4.387725      25.56776       9.373025  387.3115 29.39011 350.1481 71.35030 37.16336       77.16634 
1 1 1 3   22 11 o 313.7355 34.30038 19.51678       4.111090      17.74175       4.529712      27.81037       9.791284  297.7550 40.20040 365.2958 71.57856 -67.54083      82.09483 
1 1 1 3   22 12 o 733.1485 19.02112 104.6888       5.415717      103.7139       6.032877      108.7355       12.29151  729.4468 21.29624 741.4330 42.87091 -11.98621      47.86904 
1 1 1 3   22 13 o 525.6078 24.83973 53.94001       5.070336      55.44129       5.674813      47.99789       11.28996  531.8356 27.57014 485.6765 61.21729 46.15912       67.13918 
1 1 1 3   22 14 o 387.4877 36.98645 29.80077       5.498223      29.80077       5.498223      0.000000       0.000000  387.4877 36.98645 ?        ?        0.000000       36.98645 
1 1 1 3   22 15 o 127.7654 56.63780 -1.595242      5.584273      -7.545191      6.838537      10.31273       9.674433  118.4511 56.05383 234.4192 83.87405 -115.9681      100.8806 
1 1 1 3   22 16 f 238.3197 60.92217 11.96322       5.660102      11.71167       6.996336      12.43973       9.629370  236.2113 70.72941 247.4980 83.98271 -11.28674      109.7987 
1 1 1 3   22 17 f 367.2125 51.36699 27.61539       7.124866      27.61539       7.124866      0.000000       0.000000  367.2125 51.36699 ?        ?        0.000000       51.36699 
1 1 1 3   22 18 o 356.6855 38.93152 25.57940       5.305229      25.98607       10.12441      25.42547       6.228870  343.8041 77.66129 353.0554 46.56580 -9.251312      90.55192 
1 1 1 3   22 19 o 628.2318 25.18019 77.52210       6.143374      55.10430       10.34062      89.75078       7.637303  517.8298 52.12863 674.6594 29.14926 -156.8297      59.72498 
1 1 1 3   22 20 o 388.9025 32.91857 30.23072       4.925085      32.99077       7.009275      27.53914       6.921793  401.2503 45.80177 364.2493 50.27163 37.00104       68.00764 
1 1 1 3   22 21 o 483.2949 27.85000 46.34826       5.205022      52.58020       7.479949      40.49750       7.247576  510.2732 38.01851 445.3580 42.41650 64.91516       56.96110 
1 1 1 3   22 22 o 220.6719 55.88309 10.65215       4.794133      9.993124       6.922535      11.25953       6.645786  213.0342 71.21241 223.8131 69.32383 -10.77890      99.38310 
1 1 1 3   22 23 o 499.5748 32.86024 50.31473       6.339702      62.99594       11.61125      44.92865       7.567195  541.1957 56.05838 466.4094 42.23539 74.78632       70.18810 
1 1 1 3   22 24 o 118.0427 53.96317 -2.487294      5.532513      -5.015285      9.363926      -1.131545      6.857404  145.5226 67.81018 138.1462 61.89905 7.376404       91.81347 
1 1 1 3   23 0  o 372.0556 30.28344 27.23958       4.337666      24.64435       5.719943      30.75192       6.654307  351.3569 42.80404 392.6664 44.41769 -41.30951      61.68563 
1 1 1 3   23 1  o 826.7280 20.02797 133.1147       6.430245      133.2651       9.963110      133.0072       8.418312  825.4563 31.07942 825.5059 26.25892 -0.4956055E-01 40.68736 
1 1 1 3   23 2  o 556.3770 25.51534 60.40208       5.513134      60.59968       6.324477      59.77675       11.25094  556.0842 29.39010 546.5030 53.70493 9.581238       61.22089 
1 1 1 3   23 3  o 943.0511 19.72972 173.1978       7.225769      174.6612       8.497683      169.3774       13.73035  946.5099 23.11785 928.8971 38.06152 17.61279       44.53217 
1 1 1 3   23 4  o 653.8235 19.55152 83.24979       4.964426      76.36681       6.481567      93.01845       7.721634  625.4280 26.68546 689.9454 28.81818 -64.51733      39.27596 
1 1 1 3   23 5  o 430.5220 26.13751 36.31144       4.349380      31.55744       5.462291      44.54734       7.189532  399.6541 35.56519 474.5688 39.36517 -74.91470      53.05185 
1 1 1 3   23 6  o 1065.583 16.82033 220.9704       6.960648      222.3728       9.332593      219.2124       10.44951  1068.027 22.50050 1059.838 25.38799 8.188477       33.92377 
1 1 1 3   23 7  o 366.3533 38.75388 26.65534       5.429997      26.65534       5.429997      0.000000       0.000000  366.3533 38.75388 ?        ?        0.000000       38.75388 
1 1 1 3   23 8  o 538.6684 20.89427 56.54147       4.370958      51.86972       4.705363      85.94849       11.80536  515.6958 23.49479 658.0368 46.49490 -142.3410      52.09396 
1 1 1 3   23 9  o 747.6849 17.58896 108.8288       5.107247      110.8356       5.638244      99.65488       12.05513  754.3574 19.24592 709.4490 43.97114 44.90833       47.99861 
1 1 1 3   23 10 o 147.1466 52.29863 3.749700       3.755446      1.310211       4.105381      16.25709       9.295810  128.1595 52.26673 278.2496 81.07116 -150.0901      96.45902 
1 1 1 3   23 11 o 379.1955 29.34004 28.30224       4.287051      27.35035       4.744910      32.53275       10.00299  372.0207 33.19083 396.4094 67.38885 -24.38864      75.11916 
1 1 1 3   23 12 o 705.4672 21.74057 97.08317       5.956288      97.08317       5.956288      0.000000       0.000000  705.4672 21.74057 ?        ?        0.000000       21.74057 
1 1 1 3   23 13 o 219.3940 57.03656 10.02556       4.904768      10.02556       4.904768      0.000000       0.000000  219.3940 57.03656 ?        ?        0.000000       57.03656 
1 1 1 3   23 14 o 562.9337 24.79675 61.98656       5.421007      67.47861       6.176668      43.57053       11.31059  586.9263 27.09834 458.2257 65.41594 128.7006       70.80653 
1 1 1 3   23 15 o 293.4195 44.43388 17.51329       4.904797      21.44188       5.586375      4.296085       10.24663  324.9250 45.52036 200.8171 82.31254 124.1079       94.06092 
1 1 1 3   23 16 o 585.2150 29.02732 67.34508       6.597057      67.14828       8.021891      67.75626       11.59543  581.4689 35.69667 576.8625 52.32854 4.606384       63.34452 
1 1 1 3   23 17 o 607.8100 34.08782 73.35932       8.013811      75.79031       11.01038      70.62071       11.68628  611.9991 46.67787 587.9706 51.70474 24.02850       69.65776 
1 1 1 3   23 18 o 159.6259 59.72112 4.271993       4.989303      9.723178       9.507633      2.200342       5.861182  223.6726 82.68520 151.4666 62.18887 72.20604       103.4616 
1 1 1 3   23 19 o 407.8625 30.46517 33.12498       4.790698      25.02501       7.043365      40.09846       6.535270  344.6818 54.42432 445.9693 38.09941 -101.2875      66.43472 
1 1 1 3   23 20 o 322.3690 38.63805 21.19212       4.740843      28.30625       6.908100      14.85874       6.518020  367.9872 49.60281 258.5795 64.98412 109.4077       81.75190 
1 1 1 3   23 21 o 181.5913 58.25520 7.026872       4.654501      7.112118       6.487236      6.936430       6.682002  188.2072 68.50127 187.6359 69.32689 0.5713196      97.46098 
1 1 1 3   23 22 o 316.0722 58.43876 21.99389       6.909018      0.000000       0.000000      21.99389       6.909018  ?        ?        316.0722 58.43876 0.000000       58.43876 
1 1 1 3   24 0  o 699.0220 19.99736 95.19681       5.428646      87.67059       7.165412      105.3372       8.317239  669.8250 27.54558 733.9369 29.18048 -64.11194      40.12804 
1 1 1 3   24 1  o 333.3430 34.14745 22.00532       4.358173      23.39508       5.707050      20.06108       6.750226  341.6969 44.03185 312.5493 57.73935 29.14755       72.61292 
1 1 1 3   24 2  o 328.5648 39.14332 21.51493       4.896360      16.42919       7.090582      26.15058       6.769567  280.4902 66.16485 360.1451 49.72764 -79.65488      82.76851 
1 1 1 3   24 3  o 144.8550 54.60691 3.113005       4.186901      2.170956       5.347497      4.605402       6.730633  149.1696 60.07854 179.4523 68.85330 -30.28265      91.37948 
1 1 1 3   24 4  o 357.9393 35.92975 25.38738       4.927094      26.48379       5.594442      21.59665       10.40236  364.7688 40.15736 318.6524 83.17163 46.11636       92.35872 
1 1 1 3   24 5  o 571.6921 24.98077 63.79415       5.546206      61.43041       6.325739      71.65073       11.53265  559.7239 29.20232 599.2693 50.01092 -39.54541      57.91259 
1 1 1 3   24 6  o 162.6369 55.66046 4.876357       4.230073      7.228409       5.226346      0.4091319      7.202672  191.8065 61.75094 157.5067 67.07428 34.29980       91.17093 
1 1 1 3   24 7  o 643.2979 20.83364 80.66025       5.204813      83.75577       6.740513      76.08894       8.191167  654.7635 26.50821 621.9506 34.04184 32.81299       43.14548 
1 1 1 3   24 8  o 457.6631 24.11972 40.99657       4.271791      42.29625       4.661455      34.18329       10.67288  464.5961 25.93912 405.5539 70.31338 59.04227       74.94537 
1 1 1 3   24 9  o 451.2419 24.91331 39.88893       4.348937      41.63107       4.756667      31.01396       10.73606  460.7246 26.69926 383.9371 74.69260 76.78751       79.32109 
1 1 1 3   24 10 o 718.5673 18.49709 100.6072       5.161771      100.6901       5.699288      100.2289       12.17551  718.5927 20.42254 710.1309 44.37137 8.461731       48.84566 
1 1 1 3   24 11 o 299.2910 40.03436 17.99488       4.536629      17.99488       4.536629      0.000000       0.000000  299.2910 40.03436 ?        ?        0.000000       40.03436 
1 1 1 3   24 12 o 552.8283 25.29122 59.80152       5.429852      59.80152       5.429852      0.000000       0.000000  552.8283 25.29122 ?        ?        0.000000       25.29122 
1 1 1 3   24 13 f 273.2061 44.14287 15.21486       4.523890      13.74712       5.031052      21.41354       10.33912  257.2018 52.15282 312.2469 83.59963 -55.04507      98.53333 
1 1 1 3   24 14 o 471.7992 27.95000 43.86595       5.098320      41.24997       5.756818      53.37855       10.97778  456.2206 32.70932 509.8817 56.38276 -53.66113      65.18371 
1 1 1 3   24 15 o 346.2168 37.90374 24.08233       5.013077      21.46153       5.729129      32.64491       10.35557  323.7006 46.94355 389.5401 71.07202 -65.83954      85.17587 
1 1 1 3   24 16 o 397.0117 39.28326 31.74108       5.977264      26.80182       7.191939      42.77290       10.74827  359.1589 53.16865 449.8708 63.26939 -90.71198      82.64333 
1 1 1 3   24 17 o 99.00082 47.54002 -7.132081      5.306938      -12.03005      6.434319      3.289157       9.385428  99.26544 48.70945 185.5741 77.66389 -86.30870      91.67492 
1 1 1 3   24 18 o 392.1057 37.06734 31.04239       5.577517      33.31007       6.667455      25.75668       10.17937  403.6046 43.20925 335.1035 79.43085 68.50113       90.42290 
1 1 1 3   24 19 o 526.3901 24.69568 54.66523       5.048433      58.42152       7.184667      51.00180       7.095297  539.1590 34.49405 502.5439 36.60705 36.61505       50.29826 
1 1 1 3   24 20 o 281.0352 44.22717 16.54151       4.667493      23.02021       6.923816      11.14489       6.319204  325.6243 56.81884 222.1797 67.37612 103.4447       88.13582 
1 1 1 3   24 21 o 209.7338 55.00236 9.720182       4.535291      9.675601       6.518487      9.762012       6.314134  207.5982 69.09500 208.2302 67.94116 -0.6319580     96.90263 
1 1 1 3   25 0  o 447.0401 35.36201 39.48504       6.089084      19.67385       10.06456      50.92316       7.647453  303.7325 82.97396 507.1183 39.13375 -203.3858      91.73946 
1 1 1 3   25 1  o 179.4781 57.17361 6.349905       4.489296      0.8839868      5.780374      14.65819       7.126560  144.9137 60.81637 264.2525 68.77768 -119.3389      91.80959 
1 1 1 3   25 2  o 702.0472 20.38435 96.06731       5.557650      88.13491       7.232301      107.5065       8.685025  671.3582 27.73922 741.0018 30.18032 -69.64362      40.99165 
1 1 1 3   25 3  o 717.3607 20.13763 100.2979       5.610144      92.15378       7.220776      112.7012       8.911091  686.5880 27.08069 758.6542 30.24538 -72.06622      40.59737 
1 1 1 3   25 4  o 406.3501 34.08681 32.63052       5.329465      33.02336       7.392878      32.20548       7.689896  405.4480 47.87528 399.5316 50.70247 5.916412       69.73366 
1 1 1 3   25 5  o 415.3000 73.89128 36.12010       11.48067      0.000000       0.000000      36.12010       11.48067  ?        ?        415.3000 73.89128 0.000000       73.89128 
1 1 1 3   25 6  o 756.9777 22.23173 111.8091       6.535584      120.2098       7.652974      89.17612       12.56155  784.3731 25.12346 668.2411 48.74020 116.1320       54.83425 
1 1 1 3   25 7  o 212.7581 53.23737 9.391971       4.388066      8.417876       5.402283      11.28091       7.522913  203.4858 62.41603 234.6681 73.93284 -31.18230      96.75652 
1 1 1 3   25 8  f 497.1650 28.23320 48.56596       5.428676      49.02304       6.260380      47.18037       10.89985  498.5587 32.51171 480.3983 59.71214 18.16046       67.98934 
1 1 1 3   25 9  o 347.2379 32.00314 23.88648       4.267097      28.95669       4.705027      0.3905983      10.12850  382.6007 31.95823 182.5954 78.68291 200.0053       84.92543 
1 1 1 3   25 10 o 634.4121 22.16620 78.63799       5.461233      78.63799       5.461233      0.000000       0.000000  634.4121 22.16620 ?        ?        0.000000       22.16620 
1 1 1 3   25 11 o 309.9108 40.38588 19.36333       4.745150      19.36333       4.745150      0.000000       0.000000  309.9108 40.38588 ?        ?        0.000000       40.38588 
1 1 1 3   25 12 o 239.8939 55.69411 12.12314       5.088960      15.60130       5.976190      2.947985       9.706365  271.9579 58.33301 189.3265 79.08557 82.63147       98.27140 
1 1 1 3   25 13 o 437.4658 28.49864 37.80585       4.815248      38.11979       5.416831      36.62332       10.51318  438.3062 32.04502 414.9530 67.56384 23.35315       74.77805 
1 1 1 3   25 14 o 859.4569 22.41137 144.7208       7.480324      141.6629       8.792731      152.7327       14.23231  848.7547 26.67556 873.2339 41.96786 -24.47919      49.72813 
1 1 1 3   25 15 o 276.2477 53.16072 16.08903       5.496168      13.79608       6.483165      21.94725       10.36270  251.4505 65.67435 309.6181 84.03306 -58.16765      106.6521 
1 1 1 3   25 16 o 161.1992 59.81108 4.550761       4.983961      9.216198       5.833585      -8.058383      9.590300  207.4810 65.06256 142.6890 67.17212 64.79199       93.51594 
1 1 1 3   25 17 f 454.6501 28.51476 41.09389       5.009233      38.10723       5.610177      52.83728       11.12450  435.8644 33.39748 498.4060 58.59197 -62.54156      67.44191 
1 1 1 3   25 18 o 183.4398 56.94456 7.206189       4.481401      8.224749       5.050897      3.438061       9.714896  194.7434 60.45482 184.1597 78.14505 10.58368       98.79997 
1 1 1 3   25 19 o 264.8392 52.53671 15.18451       5.212694      16.91358       6.246777      11.21976       9.459282  275.8997 60.00948 224.3270 82.55440 51.57266       102.0606 
1 1 1 3   25 20 o 656.7466 20.88916 84.97966       5.327785      83.47925       7.473883      86.52985       7.596876  646.1179 29.78561 657.8494 29.73587 -11.73151      42.08806 
1 1 1 3   26 0  o 415.0437 33.23675 34.06224       5.312288      31.66439       6.363976      39.57277       9.647499  397.9690 41.80122 440.1036 57.84720 -42.13464      71.36975 
1 1 1 3   26 1  o 285.5377 57.11387 16.92523       6.112126      4.128340       9.896083      24.81746       7.771612  199.1758 81.17955 346.3584 59.94777 -147.1826      100.9151 
1 1 1 3   26 2  o 396.4606 40.22277 31.36565       6.107244      36.04230       10.11697      28.68435       7.660489  417.1558 64.53215 374.8426 54.19697 42.31323       84.27164 
1 1 1 3   26 3  o 95.01955 44.94239 -4.946510      4.385907      1.377813       5.447350      -16.60222      7.395160  143.8958 59.60371 101.4406 50.23455 42.45525       77.94942 
1 1 1 3   26 4  o 509.6617 25.72142 50.94963       5.074584      50.21101       6.385594      52.21561       8.359940  504.3697 32.77836 511.6208 42.45893 -7.251129      53.63937 
1 1 1 3   26 5  o 347.1014 45.82832 24.35890       6.026518      24.35890       6.026518      0.000000       0.000000  347.1014 45.82832 ?        ?        0.000000       45.82832 
1 1 1 3   26 6  o 920.3487 25.23759 165.7794       9.020451      170.4008       11.32882      157.7740       14.91028  931.1107 31.32964 891.1723 43.08202 39.93842       53.26919 
1 1 1 3   26 7  o 443.3843 31.53738 38.85606       5.395018      36.57088       6.075290      47.38017       11.73360  428.6956 36.84952 477.3465 64.98395 -48.65091      74.70476 
1 1 1 3   26 8  o 318.4881 41.96478 20.49511       5.064071      21.31113       5.737112      17.61647       10.77549  323.3120 47.07423 284.1201 88.31744 39.19186       100.0797 
1 1 1 3   26 9  o 604.7355 29.44445 71.91547       6.915076      71.91547       6.915076      0.000000       0.000000  604.7355 29.44445 ?        ?        0.000000       29.44445 
1 1 1 3   26 10 o 712.7510 24.49156 99.57635       6.779259      99.57635       6.779259      0.000000       0.000000  712.7510 24.49156 ?        ?        0.000000       24.49156 
1 1 1 3   26 11 o 700.1932 19.81862 95.83062       5.389139      96.46352       5.988994      93.13748       12.35420  701.9729 21.96876 678.4815 47.18008 23.49139       52.04408 
1 1 1 3   26 12 o 181.9148 55.39355 6.867072       4.264972      8.910770       4.720995      -2.204806      9.946578  204.9473 57.15881 166.9804 74.70285 37.96696       94.06192 
1 1 1 3   26 13 o 184.7217 56.27188 7.133164       4.400625      6.870615       4.941227      8.139930       9.675956  183.4363 60.11486 214.0713 82.44989 -30.63498      102.0381 
1 1 1 3   26 14 o 342.4196 39.48729 23.81791       5.154785      22.58134       6.036887      27.14625       9.904142  329.6479 48.61504 347.6710 75.51493 -18.02310      89.81051 
1 1 1 3   26 15 o 333.0797 40.93175 22.70401       5.183217      21.83684       6.034840      25.14258       10.12005  322.7643 49.74318 329.6810 79.88165 -6.916779      94.10346 
1 1 1 3   26 16 o 373.4803 30.86187 27.95310       4.436184      26.70939       4.895187      33.66760       10.49297  363.3700 35.12722 385.7555 72.70880 -22.38556      80.74956 
1 1 1 3   26 17 f 401.1688 29.32292 32.20631       4.536731      29.73208       5.055810      42.43351       10.27898  383.2663 34.33119 440.3015 61.81664 -57.03519      70.71017 
1 1 1 3   26 18 o 180.9391 55.92262 7.105993       4.327362      4.231001       4.902849      17.24126       9.205509  155.0601 58.93793 265.8021 81.46729 -110.7420      100.5515 
1 1 1 3   26 19 o 180.0700 54.85175 7.085901       4.181395      10.56326       4.805666      -3.750905      8.483582  217.5762 56.40557 142.4163 65.72989 75.15993       86.61413 
1 1 1 3   27 0  o 195.4139 58.36028 7.897152       4.767883      5.980468       6.045170      11.05190       7.755604  182.8367 66.19025 231.1161 75.29270 -48.27940      100.2504 
1 1 1 3   27 1  o 661.2094 22.53813 85.49700       5.787417      71.22497       7.254321      110.4842       9.598714  600.7899 31.19920 748.6266 33.01564 -147.8368      45.42492 
1 1 1 3   27 2  o 267.5987 68.42741 15.36335       7.139075      25.94127       10.05660      4.617259       10.13622  345.5397 76.92030 201.2554 82.10780 144.2843       112.5097 
1 1 1 3   27 3  o 620.0533 29.38304 75.57666       7.075446      58.41063       11.29178      86.67351       9.078771  534.4733 55.19601 661.2743 35.48184 -126.8010      65.61677 
1 1 1 3   27 4  o 1069.081 27.95424 224.4673       11.60610      0.000000       0.000000      224.4673       11.60610  ?        ?        1069.081 27.95424 0.000000       27.95424 
1 1 1 3   27 5  o 572.8207 24.42422 64.28671       5.433346      67.19053       6.794744      59.13728       9.048336  583.5303 30.08585 542.6740 43.29437 40.85626       52.72154 
1 1 1 3   27 6  o 944.5001 18.64919 174.1645       6.840533      166.3088       8.772757      186.3493       10.92572  921.1368 24.52359 973.2928 28.90538 -52.15607      37.90682 
1 1 1 3   27 7  o 157.2561 61.00367 3.560782       5.326623      3.811944       6.983521      3.211400       8.236581  172.6771 68.96951 178.8596 73.61185 -6.182556      100.8737 
1 1 1 3   27 8  o 388.3755 41.10003 30.44118       6.104814      30.44118       6.104814      0.000000       0.000000  388.3755 41.10003 ?        ?        0.000000       41.10003 
1 1 1 3   27 9  o 222.6324 59.13436 10.59653       5.199176      11.27557       5.764218      7.633473       12.04098  229.0014 62.89080 224.0008 90.17482 5.000595       109.9398 
1 1 1 3   27 10 o 429.1880 32.74028 36.70699       5.415882      37.89888       6.191046      32.82138       11.17835  434.6107 37.03380 384.2530 77.58153 50.35770       85.96741 
1 1 1 3   27 11 o 297.7599 47.04210 18.37873       5.259093      19.08730       5.954404      15.86521       11.21473  301.2262 52.82618 265.4057 90.63000 35.82053       104.9019 
1 1 1 3   27 12 o 224.0220 50.69759 10.67340       4.307790      9.784282       4.759791      14.69908       10.12808  213.0850 56.57193 255.1907 86.13225 -42.10567      103.0492 
1 1 1 3   27 13 o 438.7078 30.32251 38.38435       5.134466      42.40697       5.953994      26.71456       10.14112  459.8823 33.56946 340.8132 78.26993 119.0691       85.16508 
1 1 1 3   27 14 o 609.4354 24.19871 73.25813       5.727272      67.13521       6.568665      92.67123       11.69620  580.6681 29.22215 671.3857 45.12056 -90.71759      53.75686 
1 1 1 3   27 15 o 178.9099 54.98630 6.866543       4.190341      7.906653       4.628592      2.141141       9.865715  190.6631 57.62854 178.3700 77.25652 12.29306       96.38267 
1 1 1 3   27 16 o 145.4413 54.08960 3.789070       4.080711      -0.4993739     4.511042      23.10375       9.573501  116.6757 51.35153 309.7559 79.25765 -193.0802      94.43916 
1 1 1 3   27 17 o 357.9103 30.24771 25.80979       4.164939      27.18091       4.684252      20.63421       9.100864  365.9686 33.32369 291.2173 78.63057 74.75128       85.40044 
1 1 1 3   28 0  o 486.6395 28.40752 46.79004       5.345366      40.91020       6.872428      55.79478       8.504778  451.2166 39.62024 526.4257 41.94864 -75.20914      57.70140 
1 1 1 3   28 1  f 460.6373 29.18594 41.97830       5.194105      36.20152       6.528444      51.94196       8.573858  424.0943 40.11518 506.9389 43.98646 -82.84460      59.53181 
1 1 1 3   28 2  o 185.1633 58.75948 7.035974       4.745279      5.079399       5.962725      10.41555       7.836597  173.6780 65.22682 224.0503 75.76385 -50.37230      99.97350 
1 1 1 3   28 3  o 177.3993 70.07631 4.453046       7.135987      15.64379       9.649118      -9.056102      10.60162  265.7402 83.73235 150.4205 70.75462 115.3197       109.6236 
1 1 1 3   28 4  o 398.9904 51.91302 32.88486       7.853381      35.54992       10.70584      29.78002       11.55547  405.4742 70.54984 363.1449 83.65947 42.32935       109.4358 
1 1 1 3   28 5  o 162.2583 58.34987 4.792953       4.687813      0.5053686      5.681451      13.93781       8.297388  138.9772 59.38683 251.6961 77.37805 -112.7189      97.54055 
1 1 1 3   28 6  o 134.3940 56.45585 1.011744       4.988980      4.071566       5.531174      -12.34016      11.55422  162.0198 62.35594 149.4805 71.33707 12.53935       94.74831 
1 1 1 3   28 7  o 318.7736 44.72860 20.87489       5.384861      25.08353       6.073655      5.412607       11.64169  349.4611 45.86031 209.6819 87.01672 139.7792       98.36198 
1 1 1 3   28 8  o 258.5734 53.30012 14.19800       5.174371      19.43292       5.899527      -3.255978      10.77231  304.2517 51.78448 168.3233 76.30568 135.9285       92.21815 
1 1 1 3   28 9  o 205.5070 54.49805 9.058750       4.420452      6.838573       4.907875      18.60014       10.17432  182.1599 59.92207 282.6544 85.44263 -100.4945      104.3604 
1 1 1 3   28 10 o 371.2036 37.78779 27.92889       5.371471      31.58084       6.166715      16.44538       10.93524  393.5541 40.94752 265.6613 89.49947 127.8929       98.42182 
1 1 1 3   28 11 o 264.1240 51.54891 14.88303       5.097768      14.38533       5.811460      16.54423       10.61727  256.1851 59.54391 264.5633 88.18799 -8.378174      106.4077 
1 1 1 3   28 12 o 381.9692 41.48845 29.98330       6.055408      37.80013       7.787858      18.03193       9.629676  425.6049 47.95326 274.5502 83.15372 151.0546       95.98988 
1 1 1 3   28 13 o 158.1338 59.72133 4.431476       5.013695      8.729211       5.969148      -5.863634      9.238641  199.8562 66.10044 143.4349 67.01048 56.42131       94.12583 
1 1 1 3   28 14 o 132.5356 55.84745 1.266815       4.906503      2.777685       5.900834      -2.117899      8.832032  151.8100 62.37239 152.1816 69.02940 -0.3715668     93.03426 
1 1 1 3   28 15 f 119.7693 53.01514 -0.6715695     4.875280      3.899429       5.892516      -10.59043      8.680127  158.8693 63.38599 124.0313 59.87277 34.83803       87.19250 
1 1 1 3   29 0  o 313.4056 39.90283 20.01917       4.746511      15.59443       6.107405      26.76796       7.542684  268.3383 60.10001 355.5598 56.51543 -87.22147      82.49852 
1 1 1 3   29 1  o 219.1621 54.25004 10.29376       4.592626      8.472114       6.036474      12.79738       7.076776  201.0496 66.47106 240.4201 70.93313 -39.37045      97.21065 
1 1 1 3   29 2  o 338.9785 37.61649 23.26142       4.868472      25.29234       6.408403      20.48947       7.486822  349.1233 48.58202 306.1472 64.98090 42.97610       81.13403 
1 1 1 3   29 3  o 526.5859 25.82580 54.64764       5.281424      50.84079       6.880520      60.10760       8.240118  503.5345 35.41087 545.8392 39.13202 -42.30466      52.77542 
1 1 1 3   29 4  o 158.9786 63.00938 3.539525       5.787153      -3.371599      9.637141      7.437274       7.237372  157.9663 71.82777 196.5066 72.22662 -38.54028      101.8622 
1 1 1 3   29 5  o 334.7767 59.81605 24.12312       7.491416      21.93157       10.14905      26.74658       11.10418  306.3147 83.17307 337.6931 84.79279 -31.37842      118.7753 
1 1 1 3   29 6  o 261.4068 70.35648 15.38646       7.300103      21.64639       9.946121      8.076075       10.74829  304.0593 82.24419 215.1221 85.67748 88.93715       118.7634 
1 1 1 3   29 7  o 405.9007 31.44117 32.97525       4.917507      29.11644       6.301649      38.98425       7.863732  375.9264 43.99633 433.6998 47.46336 -57.77344      64.71822 
1 1 1 3   29 8  o 161.3395 59.16032 4.812299       4.851546      5.608914       5.596980      2.404920       9.729748  172.5586 63.50225 180.1048 77.35803 -7.546143      100.0840 
1 1 1 3   29 9  o 158.9642 53.91006 5.095611       3.967850      5.985285       4.350163      0.6910491      9.679245  169.9797 56.43889 171.5469 75.36739 -1.567169      94.15727 
1 1 1 3   29 10 o 361.8003 34.47221 26.52698       4.784997      26.10327       5.391660      28.09835       10.38312  356.5349 39.60917 344.4313 79.26888 12.10364       88.61401 
1 1 1 3   29 11 o 334.5665 36.89838 22.90005       4.714471      22.27479       5.312518      25.21755       10.22776  327.0979 42.85168 322.5054 81.59738 4.592438       92.16507 
1 1 1 3   29 12 o 102.1075 47.71538 -3.733641      4.689047      -0.8234016     5.492970      -11.55082      9.002596  126.1537 56.03598 124.8579 60.44083 1.295784       82.42042 
1 1 1 3   29 13 f 234.5706 54.57203 12.17056       4.877713      10.01836       5.695684      18.09114       9.446825  210.0454 64.02599 269.7912 82.50123 -59.74579      104.4307 
1 1 1 3   30 0  o 261.7108 46.51791 14.44388       4.554684      19.17314       6.057098      8.290249       6.909296  298.6364 54.22399 199.3301 70.92779 99.30634       89.28041 
1 1 1 3   30 1  o 134.6277 54.08659 2.242498       4.322270      2.616901       5.581012      1.681389       6.832301  149.2416 60.91108 154.2758 65.50304 -5.034149      89.44724 
1 1 1 3   30 2  o 256.1897 47.87626 13.91858       4.588175      11.80313       5.855076      17.28449       7.385560  229.8727 63.48948 275.5238 69.13588 -45.65112      93.86524 
1 1 1 3   30 3  o 387.9445 36.57623 30.56509       5.445524      31.73564       6.309281      27.14639       10.78241  392.6788 42.02512 336.8158 82.97408 55.86301       93.00972 
1 1 1 3   30 4  o 366.7395 38.80176 27.50834       5.442404      28.74045       6.272803      23.75694       10.94546  372.1970 44.26517 311.1280 87.12538 61.06897       97.72532 
1 1 1 3   30 5  o 504.2260 29.38834 50.78534       5.729827      48.16671       6.562197      59.18801       11.75496  488.2690 34.83543 523.7226 58.81182 -35.45361      68.35450 
1 1 1 3   30 6  o 245.1912 61.75575 13.48134       5.877264      13.05224       9.774708      13.72432       7.355371  237.1376 84.36480 243.2038 72.45327 -6.066177      111.2066 
1 1 1 3   30 7  f 136.9211 61.52637 -1.535010      6.826859      -2.423094      9.039850      -0.3562386     10.41475  153.0042 69.56950 170.8952 76.44844 -17.89093      103.3648 
1 1 1 3   30 8  f 278.0975 50.33269 16.62892       5.235825      21.96092       6.082075      1.367476       10.28975  320.3463 50.56585 176.1650 77.54471 144.1812       92.57476 
1 1 1 3   30 9  o 444.4502 29.49589 39.63232       5.062191      42.22890       5.781245      31.09839       10.48083  457.1314 32.78278 361.5478 77.00417 95.58359       83.69202 
1 1 1 3   30 10 o 114.2037 50.61037 -0.7272606     4.455618      -2.001897      5.006898      4.123650       9.767588  114.1328 51.84882 183.8459 78.19572 -69.71313      93.82362 
1 1 1 3   31 0  o 202.1268 55.46223 9.062604       4.485183      15.94256       6.074700      0.8170135      6.650325  266.3029 60.15772 146.0065 63.33428 120.2965       87.35091 
1 1 1 3   31 1  o 158.4537 56.31963 4.996921       4.355163      4.714892       5.636497      5.414753       6.860623  163.2142 62.90990 175.2924 68.88020 -12.07826      93.28525 
1 1 1 3   31 2  o 201.7415 58.98421 9.093287       4.913082      4.533771       5.780391      20.96010       9.325346  162.7221 63.43036 292.5877 79.84358 -129.8656      101.9726 
1 1 1 3   31 3  o 389.2687 36.12154 30.95943       5.398418      34.21220       6.270729      21.64669       10.61034  407.0150 40.19675 291.7255 87.04571 115.2896       95.87875 
1 1 1 3   31 4  o 321.1877 38.93221 21.33136       4.756974      35.55999       6.200731      0.9791856      7.415949  415.7204 38.85794 153.1282 66.65229 262.5922       77.15224 
1 1 1 3   31 5  o 152.8232 65.27583 1.802954       6.858868      0.000000       0.000000      1.802954       6.858868  ?        ?        152.8232 65.27583 0.000000       65.27583 
1 1 1 3   31 6  o 121.6579 52.11210 0.5835410      4.393895      -4.789521      5.597570      9.209003       7.092181  109.0437 51.32877 203.2351 71.90910 -94.19132      88.34909 
1 1 1 4   0  0  o 628.1641 14.95946 76.81830       3.644687      76.81830       3.644687      76.81830       3.644687  628.1641 14.95946 628.1641 14.95946 0.000000       0.000000 
1 1 1 4   0  1  o 408.2653 15.66270 32.53749       2.475047      32.53749       2.475047      32.53749       2.475047  408.2653 15.66270 408.2653 15.66270 0.000000       0.000000 
1 1 1 4   0  2  o 221.3317 23.11477 9.836173       1.937225      9.836173       1.937225      9.836173       1.937225  221.3317 23.11477 221.3317 23.11477 0.000000       0.000000 
1 1 1 4   0  3  o 136.1169 44.33908 4.596366       2.074731      4.596366       2.074731      4.596366       2.074731  136.1169 44.33908 136.1169 44.33908 0.000000       0.000000 
1 1 1 4   0  4  o 504.3473 16.85592 49.59472       3.293133      49.59472       3.293133      49.59472       3.293133  504.3473 16.85592 504.3473 16.85592 0.000000       0.000000 
1 1 1 4   0  5  o 1398.259 19.14768 380.1907       10.39318      380.1907       10.39318      380.1907       10.39318  1398.259 19.14768 1398.259 19.14768 0.000000       0.000000 
1 1 1 4   0  6  o 86.76207 46.28183 2.104459       2.121125      2.104459       2.121125      2.104459       2.121125  86.76207 46.28183 86.76207 46.28183 0.000000       0.000000 
1 1 1 4   0  7  o 1445.043 19.64166 406.0551       11.01809      406.0551       11.01809      406.0551       11.01809  1445.043 19.64166 1445.043 19.64166 0.000000       0.000000 
1 1 1 4   0  8  o 647.2824 17.34623 81.58977       4.353327      81.58977       4.353327      81.58977       4.353327  647.2824 17.34623 647.2824 17.34623 0.000000       0.000000 
1 1 1 4   0  9  o 469.2587 19.78584 43.03115       3.591166      43.03115       3.591166      43.03115       3.591166  469.2587 19.78584 469.2587 19.78584 0.000000       0.000000 
1 1 1 4   0  10 o 405.2784 22.50619 32.23716       3.517309      32.23716       3.517309      32.23716       3.517309  405.2784 22.50619 405.2784 22.50619 0.000000       0.000000 
1 1 1 4   0  11 o 117.8525 55.85245 3.992904       2.903206      3.992904       2.903206      3.992904       2.903206  117.8525 55.85245 117.8525 55.85245 0.000000       0.000000 
1 1 1 4   0  12 o 94.94725 54.52540 2.255033       3.204569      2.255033       3.204569      2.255033       3.204569  94.94725 54.52540 94.94725 54.52540 0.000000       0.000000 
1 1 1 4   0  13 o 308.3728 32.65641 19.18186       3.810537      19.18186       3.810537      19.18186       3.810537  308.3728 32.65641 308.3728 32.65641 0.000000       0.000000 
1 1 1 4   0  14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 4   0  15 o 223.0165 74.20387 12.68043       5.723062      12.68043       5.723062      12.68043       5.723062  223.0165 74.20387 223.0165 74.20387 0.000000       0.000000 
1 1 1 4   0  16 o 437.7494 27.77915 37.84071       4.678905      37.84071       4.678905      37.84071       4.678905  437.7494 27.77915 437.7494 27.77915 0.000000       0.000000 
1 1 1 4   0  17 o 879.6278 21.51553 150.9194       7.339926      150.9194       7.339926      150.9194       7.339926  879.6278 21.51553 879.6278 21.51553 0.000000       0.000000 
1 1 1 4   0  18 o 87.00497 56.66783 -0.3318106     4.637160      -0.3318106     4.637160      -0.3318106     4.637160  87.00497 56.66783 87.00497 56.66783 0.000000       0.000000 
1 1 1 4   0  19 o 152.9365 81.40739 6.754114       6.549247      6.754114       6.549247      6.754114       6.549247  152.9365 81.40739 152.9365 81.40739 0.000000       0.000000 
1 1 1 4   0  20 o 647.1654 26.00184 81.93518       6.511059      81.93518       6.511059      81.93518       6.511059  647.1654 26.00184 647.1654 26.00184 0.000000       0.000000 
1 1 1 4   0  21 o 190.6724 76.61880 9.937873       5.520532      9.937873       5.520532      9.937873       5.520532  190.6724 76.61880 190.6724 76.61880 0.000000       0.000000 
1 1 1 4   0  22 o 246.6042 72.69833 14.68970       6.051699      14.68970       6.051699      14.68970       6.051699  246.6042 72.69833 246.6042 72.69833 0.000000       0.000000 
1 1 1 4   0  23 o 1331.801 23.94168 345.6552       12.37387      345.6552       12.37387      345.6552       12.37387  1331.801 23.94168 1331.801 23.94168 0.000000       0.000000 
1 1 1 4   0  24 o 1256.199 34.71578 309.1135       16.90685      309.1135       16.90685      309.1135       16.90685  1256.199 34.71578 1256.199 34.71578 0.000000       0.000000 
1 1 1 4   0  25 o 169.9913 86.51217 8.618933       7.167481      8.618933       7.167481      8.618933       7.167481  169.9913 86.51217 169.9913 86.51217 0.000000       0.000000 
1 1 1 4   0  26 o 1337.710 25.83492 349.4487       13.41008      349.4487       13.41008      349.4487       13.41008  1337.710 25.83492 1337.710 25.83492 0.000000       0.000000 
1 1 1 4   0  27 o 436.5686 47.20723 38.93940       7.766640      38.93940       7.766640      38.93940       7.766640  436.5686 47.20723 436.5686 47.20723 0.000000       0.000000 
1 1 1 4   0  28 o 155.5511 86.65187 7.196689       7.774025      7.196689       7.774025      7.196689       7.774025  155.5511 86.65187 155.5511 86.65187 0.000000       0.000000 
1 1 1 4   0  29 o 105.8340 70.51595 -1.459950      7.847990      -1.459950      7.847990      -1.459950      7.847990  105.8340 70.51595 105.8340 70.51595 0.000000       0.000000 
1 1 1 4   0  30 o 1077.642 39.26618 232.4570       16.38366      232.4570       16.38366      232.4570       16.38366  1077.642 39.26618 1077.642 39.26618 0.000000       0.000000 
1 1 1 4   0  31 o 180.9709 106.5973 11.89274       12.76076      11.89274       12.76076      11.89274       12.76076  180.9709 106.5973 180.9709 106.5973 0.000000       0.000000 
1 1 1 4   0  32 o 113.1674 79.09660 -6.850523      12.82669      -6.850523      12.82669      -6.850523      12.82669  113.1674 79.09660 113.1674 79.09660 0.000000       0.000000 
1 1 1 4   0  33 o 226.6039 95.99357 17.37476       8.555280      17.37476       8.555280      17.37476       8.555280  226.6039 95.99357 226.6039 95.99357 0.000000       0.000000 
1 1 1 4   1  0  o 387.5108 11.10177 29.18689       1.670721      30.71422       2.379324      27.70136       2.346530  397.3413 15.41920 377.3224 16.01348 20.01892       22.23023 
1 1 1 4   1  1  o 940.9240 11.23512 172.0717       4.105446      178.3375       5.972345      166.4584       5.652782  957.4398 16.06221 925.0378 15.73529 32.40204       22.48542 
1 1 1 4   1  2  o 656.8859 11.12668 83.85544       2.838465      81.70873       3.971539      86.09691       4.058257  648.1569 15.77796 665.3389 15.70611 -17.18195      22.26265 
1 1 1 4   1  3  o 468.2458 12.26973 42.61108       2.231191      42.96532       3.195203      42.27396       3.117012  469.9771 17.50627 466.1941 17.21646 3.783081       24.55353 
1 1 1 4   1  4  o 1270.760 12.93608 313.8304       6.384017      324.4526       9.350550      304.5558       8.737340  1291.494 18.64305 1251.345 17.97936 40.14905       25.90021 
1 1 1 4   1  5  o 1083.283 12.27887 228.0241       5.165690      228.2962       7.310377      227.7527       7.300413  1083.556 17.37243 1082.265 17.36943 1.290405       24.56621 
1 1 1 4   1  6  o 941.1353 11.98859 172.0966       4.381755      184.1190       6.484313      161.9933       5.944316  973.1363 17.15783 912.8203 16.76828 60.31598       23.99097 
1 1 1 4   1  7  f 617.6060 17.04913 74.15810       4.089232      74.15810       4.089232      0.000000       0.000000  617.6060 17.04913 ?        ?        0.000000       17.04913 
1 1 1 4   1  8  o 1830.153 15.87700 651.1172       11.28454      660.3387       16.22903      642.4855       15.70153  1841.994 22.68696 1817.002 22.25147 24.99207       31.77776 
1 1 1 4   1  9  o 817.5029 17.56357 129.9657       5.576094      0.000000       0.000000      129.9657       5.576094  ?        ?        817.5029 17.56357 0.000000       17.56357 
1 1 1 4   1  10 o 1289.748 13.69326 323.3350       6.858666      313.1448       9.418177      334.8412       10.00790  1268.645 19.11607 1311.785 19.64501 -43.14001      27.41078 
1 1 1 4   1  11 o 705.4819 13.29722 96.75125       3.643130      99.10564       5.193996      94.47121       5.111326  713.6198 18.74161 696.7224 18.89060 16.89734       26.61020 
1 1 1 4   1  12 o 630.3568 14.15719 77.27463       3.465703      76.02322       4.866480      78.56244       4.936766  624.7499 20.05768 635.1018 20.01572 -10.35187      28.33619 
1 1 1 4   1  13 o 412.8545 18.14680 33.19722       2.909545      31.82773       4.000108      34.73572       4.239779  402.8362 25.70314 420.8474 26.06956 -18.01117      36.60975 
1 1 1 4   1  14 o 539.3290 18.65809 56.68526       3.907950      55.51871       4.793963      58.99599       6.747083  533.2336 23.14990 547.4279 31.87461 -14.19427      39.39428 
1 1 1 4   1  15 o 361.6603 25.82859 25.70649       3.603822      26.89498       6.530225      25.18600       4.321486  365.0451 47.16624 356.9139 31.50073 8.131226       56.71817 
1 1 1 4   1  16 o 695.4308 18.14748 94.22071       4.901153      86.04795       8.387528      98.45820       6.039545  662.1451 32.61766 710.3618 21.89256 -48.21667      39.28354 
1 1 1 4   1  17 o 461.4400 20.01969 41.49162       3.587571      41.34982       5.029087      41.63856       5.119300  458.9821 28.35288 460.5163 28.76857 -1.534180      40.39204 
1 1 1 4   1  18 o 344.3168 29.74152 23.34160       3.937904      29.17963       6.894840      20.51531       4.797325  381.6487 47.55055 320.8817 39.31967 60.76700       61.70163 
1 1 1 4   1  19 o 324.3499 35.97407 20.84214       4.455063      24.62504       5.681113      14.80056       7.179532  351.6463 42.46008 267.1141 68.79284 84.53223       80.84129 
1 1 1 4   1  20 o 602.9773 22.25961 70.79339       5.212506      73.91019       6.435542      64.84898       8.887620  615.7180 26.91381 573.9758 40.12403 41.74219       48.31450 
1 1 1 4   1  21 o 749.9747 17.91915 109.3966       5.219058      112.6646       7.446397      106.2411       7.317027  760.4839 25.21321 738.4576 25.51415 22.02631       35.87029 
1 1 1 4   1  22 o 940.6394 17.08532 172.0727       6.241290      173.1155       8.856705      171.0439       8.796636  942.7583 24.19044 937.1029 24.17137 5.655396       34.19697 
1 1 1 4   1  23 o 440.7018 32.22829 38.14815       5.477567      38.66763       9.404697      37.88146       6.738454  438.6299 56.52541 437.7887 40.07877 0.8412170      69.29235 
1 1 1 4   1  24 o 206.8084 55.71551 8.769250       4.575345      7.794448       6.335930      9.831511       6.614056  202.7285 68.12663 221.7083 69.23830 -18.97980      97.13485 
1 1 1 4   1  25 o 401.8751 32.91127 31.81975       5.091415      29.65137       7.015468      34.23279       7.400661  384.6552 48.00837 413.9872 46.85656 -29.33203      67.08458 
1 1 1 4   1  26 o 1627.336 21.06988 516.1011       13.31580      515.5595       16.23303      517.2153       23.28149  1625.033 25.72228 1622.983 36.93761 2.049927       45.01137 
1 1 1 4   1  27 o 183.6799 62.45516 6.376728       5.325538      9.164461       7.568917      3.643522       7.494529  218.0946 74.45518 178.5685 71.40372 39.52614       103.1604 
1 1 1 4   1  28 o 157.2949 63.90947 2.406981       6.109186      4.207548       7.537291      -1.041242      10.43058  181.3425 71.89729 178.7537 78.39277 2.588730       106.3703 
1 1 1 4   1  29 o 473.2289 31.95679 44.35085       5.838622      46.31964       8.224015      42.35008       8.290504  479.2966 44.69831 457.0792 47.39362 22.21741       65.14671 
1 1 1 4   1  30 o 461.2394 33.89840 42.40591       6.029482      41.76477       8.427649      43.07820       8.629897  451.5672 48.83474 458.4907 49.23832 -6.923462      69.34872 
1 1 1 4   1  31 o 403.3242 54.63194 34.24191       8.336917      27.76749       11.13446      42.50301       12.57732  345.1624 83.88623 434.5735 77.35970 -89.41110      114.1114 
1 1 1 4   1  32 o 544.6368 37.32199 60.13776       7.846438      50.90682       14.00288      64.36273       9.473403  467.7452 79.95953 559.0142 43.99250 -91.26898      91.26262 
1 1 1 4   1  33 o 307.6040 52.45528 20.44860       6.041500      12.76897       8.523510      28.20243       8.564580  232.6074 79.01289 353.7762 64.72263 -121.1688      102.1374 
1 1 1 4   2  0  o 288.6474 12.67805 16.19707       1.421177      15.89957       1.979998      16.51322       2.041091  285.2567 17.96491 290.7098 18.17015 -5.453064      25.55176 
1 1 1 4   2  1  o 1240.493 12.56581 299.1219       6.053587      298.8992       7.042701      299.7522       11.84553  1239.797 14.62719 1239.933 24.59962 -0.1364746     28.61985 
1 1 1 4   2  2  o 859.4001 11.34032 143.5262       3.784852      142.9746       5.334723      144.0852       5.370636  857.4109 16.02119 860.7307 16.06684 -3.319763      22.68969 
1 1 1 4   2  3  o 542.0496 10.31946 57.08600       2.172320      57.35832       3.621644      56.93297       2.714932  543.0606 17.17234 541.2331 12.91655 1.827515       21.48782 
1 1 1 4   2  4  o 1350.475 13.27808 354.4420       6.963853      347.8643       9.677611      361.5055       10.02851  1337.326 18.63386 1363.256 18.94222 -25.93030      26.57119 
1 1 1 4   2  5  o 1238.204 12.83048 297.9236       6.169691      302.0241       8.823141      294.0001       8.630567  1246.226 18.23050 1229.575 18.07408 16.65027       25.67145 
1 1 1 4   2  6  o 735.6157 11.77018 105.1377       3.362499      104.5773       4.716187      105.7170       4.795384  733.4395 16.55765 737.4151 16.74493 -3.975586      23.54885 
1 1 1 4   2  7  o 985.2617 17.37126 188.7395       6.646775      0.000000       0.000000      188.7395       6.646775  ?        ?        985.2617 17.37126 0.000000       17.37126 
1 1 1 4   2  8  o 274.0040 25.73305 14.75002       2.706190      0.000000       0.000000      14.75002       2.706190  ?        ?        274.0040 25.73305 0.000000       25.73305 
1 1 1 4   2  9  o 818.0700 12.43924 130.0508       3.951958      127.9774       5.540199      132.1987       5.638935  811.2112 17.58585 824.4797 17.61121 -13.26855      24.88809 
1 1 1 4   2  10 o 518.7084 14.07151 52.30298       2.834602      55.01843       4.025210      49.63155       3.992456  531.7322 19.49250 504.9821 20.35805 26.75018       28.18525 
1 1 1 4   2  11 o 224.4977 26.28035 9.962905       2.247885      14.13015       3.231527      6.056061       3.128933  267.0327 31.78579 172.4139 45.91197 94.61882       55.84125 
1 1 1 4   2  12 o 820.6490 13.41880 130.9567       4.276605      135.4017       6.138404      126.7641       5.961540  833.8738 18.95515 806.8292 19.02606 27.04456       26.85681 
1 1 1 4   2  13 o 699.1088 16.24381 95.13885       4.410223      94.58453       5.439369      96.20250       7.534624  696.6130 20.10615 701.3676 27.66228 -4.754578      34.19735 
1 1 1 4   2  14 f 812.0174 20.10415 128.5769       6.339852      128.5769       6.339852      0.000000       0.000000  812.0174 20.10415 ?        ?        0.000000       20.10415 
1 1 1 4   2  15 o 596.7489 16.08947 69.33939       3.728733      70.54845       5.239745      68.09892       5.307355  601.1459 22.44410 590.5176 23.14288 10.62836       32.23865 
1 1 1 4   2  16 o 767.4974 17.69154 114.7370       5.273156      105.0956       9.049276      119.6941       6.488632  732.0023 31.83270 783.3495 21.32895 -51.34729      38.31768 
1 1 1 4   2  17 o 333.4068 36.92667 22.09719       4.700970      0.000000       0.000000      22.09719       4.700970  ?        ?        333.4068 36.92667 0.000000       36.92667 
1 1 1 4   2  18 o 547.7499 21.79559 58.46232       4.636379      43.28885       7.766882      66.86259       5.778973  467.0332 43.31531 585.4152 25.41901 -118.3820      50.22292 
1 1 1 4   2  19 o 821.0780 16.29605 131.1261       5.196308      136.9677       7.498038      125.7278       7.207922  838.4740 23.02661 803.3250 23.10419 35.14899       32.61945 
1 1 1 4   2  20 o 496.1193 25.59821 48.09224       4.915199      44.26254       5.979175      56.07424       8.632076  474.9525 32.61390 533.1907 42.02813 -58.23828      53.19803 
1 1 1 4   2  21 o 1592.865 24.07984 494.1295       14.89568      501.9697       21.38487      486.7405       20.76037  1603.003 34.35139 1578.633 33.86304 24.37012       48.23612 
1 1 1 4   2  22 o 314.5499 35.67014 19.58499       4.280309      20.76258       6.046640      18.40221       6.059923  321.1960 50.11054 301.2077 53.77816 19.98828       73.50617 
1 1 1 4   2  23 o 523.0535 24.31835 53.31583       4.939786      54.01083       6.857787      52.56636       7.121498  524.5002 33.84811 517.0920 35.68134 7.408203       49.18184 
1 1 1 4   2  24 o 1709.650 18.01941 568.8384       11.96398      581.7196       17.14882      556.6235       16.69938  1726.934 25.56998 1689.307 25.45445 37.62744       36.07981 
1 1 1 4   2  25 o 431.5439 31.15079 36.60965       5.185532      34.32904       7.144198      39.14901       7.538583  414.9949 45.05210 443.6447 44.34908 -28.64972      63.21814 
1 1 1 4   2  26 o 498.1294 28.53161 48.66262       5.496490      57.36138       7.612514      39.18853       7.944533  539.3323 36.56088 442.8782 46.90472 96.45407       59.47058 
1 1 1 4   2  27 o 233.7699 72.15327 11.22645       7.206543      11.22645       7.206543      0.000000       0.000000  233.7699 72.15327 ?        ?        0.000000       72.15327 
1 1 1 4   2  28 o 495.2115 30.49541 48.34407       5.836278      43.31472       8.008909      54.03913       8.522499  464.5052 44.95966 520.1036 42.56675 -55.59842      61.91365 
1 1 1 4   2  29 o 226.7094 61.08006 10.91385       5.498667      12.62448       7.678761      9.113453       7.877630  242.9618 74.39525 215.6589 75.84109 27.30289       106.2381 
1 1 1 4   2  30 o 486.6823 37.70893 47.48446       7.071543      60.41597       8.548131      19.44648       12.58693  548.0470 40.44878 290.8085 95.97661 257.2385       104.1519 
1 1 1 4   2  31 o 562.9868 30.07881 63.01883       6.552575      68.55244       9.045183      56.90778       9.505420  581.9658 40.26892 526.1146 47.01786 55.85120       61.90530 
1 1 1 4   2  32 f 352.1069 53.93692 26.52991       7.140493      23.89154       11.89173      28.01755       8.929460  308.3067 92.18816 353.2761 67.54720 -44.96942      114.2860 
1 1 1 4   2  33 o 468.2115 41.10316 45.24519       7.398235      27.36246       12.72751      54.37096       9.092043  322.0216 95.16035 509.4842 46.46284 -187.4626      105.8975 
1 1 1 4   3  0  o 421.1226 11.45822 34.46492       1.873930      31.94704       2.607512      37.15445       2.694925  405.2638 16.56764 437.0779 15.87669 -31.81409      22.94680 
1 1 1 4   3  1  o 676.3558 11.28479 88.89616       2.964127      87.97630       4.182154      89.82466       4.201732  672.5850 16.01124 679.6198 15.91968 -7.034729      22.57866 
1 1 1 4   3  2  o 391.6336 12.05644 29.80649       1.833695      29.65394       2.583466      29.96137       2.603117  390.4721 17.03667 392.4895 17.07802 -2.017365      24.12275 
1 1 1 4   3  3  o 352.1980 13.14428 24.10756       1.797843      21.36532       4.065118      24.77434       2.004539  329.2931 32.20001 357.0026 14.45823 -27.70947      35.29704 
1 1 1 4   3  4  o 1231.604 12.81739 294.7628       6.130539      294.3178       8.660890      295.2095       8.678923  1230.204 18.12831 1232.065 18.13862 -1.860962      25.64460 
1 1 1 4   3  5  o 603.6486 16.60306 70.84246       3.892246      70.84246       3.892246      0.000000       0.000000  603.6486 16.60306 ?        ?        0.000000       16.60306 
1 1 1 4   3  6  o 1019.661 12.19561 202.0164       4.829336      194.0075       6.640633      211.0071       7.035921  998.9362 17.11763 1041.761 17.39100 -42.82526      24.40206 
1 1 1 4   3  7  o 667.4347 11.89831 86.55317       3.084054      83.36492       4.296901      89.94066       4.429128  654.8217 16.89679 680.1638 16.76783 -25.34204      23.80466 
1 1 1 4   3  8  o 1105.894 12.74278 237.6590       5.472752      233.3260       7.605671      242.3114       7.880946  1095.365 17.87931 1116.228 18.18014 -20.86377      25.49877 
1 1 1 4   3  9  o 233.1148 21.86140 10.67043       1.956019      10.92681       2.734195      10.40166       2.799415  234.6760 30.73992 228.5908 32.44463 6.085236       44.69448 
1 1 1 4   3  10 o 820.3929 12.72343 130.8131       4.053723      129.7735       5.688663      131.8857       5.778041  816.7468 17.93473 823.3547 18.07031 -6.607910      25.45959 
1 1 1 4   3  11 o 563.0443 14.20166 61.64239       3.105342      58.28802       4.344237      65.14720       4.440582  547.1078 20.44620 578.4575 19.76699 -31.34967      28.43907 
1 1 1 4   3  12 o 901.1733 15.20945 157.9965       5.322918      160.1977       6.659722      154.1029       8.857186  906.9556 18.90785 888.4285 25.67115 18.52710       31.88283 
1 1 1 4   3  13 o 638.8847 16.50091 79.46680       4.094100      79.46258       5.064486      79.47476       6.955165  638.4212 20.42679 637.3275 28.10068 1.093689       34.74049 
1 1 1 4   3  14 o 681.9946 14.79260 90.52459       3.917900      86.01189       5.461333      95.30965       5.623730  663.9718 21.17976 699.0099 20.71634 -35.03815      29.62683 
1 1 1 4   3  15 o 210.2504 36.76877 8.950141       2.892904      6.415523       4.043248      11.60862       4.140865  178.1358 53.86583 237.9265 46.48162 -59.79060      71.14822 
1 1 1 4   3  16 o 628.0461 18.90827 76.86002       4.611810      74.19441       7.731663      78.33223       5.745906  614.1268 32.53405 633.4509 23.35703 -19.32404      40.05016 
1 1 1 4   3  17 o 483.7169 28.18477 45.89231       5.271667      0.000000       0.000000      45.89231       5.271667  ?        ?        483.7169 28.18477 0.000000       28.18477 
1 1 1 4   3  18 o 154.6709 48.67879 4.674442       3.262207      4.602346       4.596191      4.747631       4.630919  162.8758 57.86075 164.5342 58.11857 -1.658447      82.00997 
1 1 1 4   3  19 o 683.2470 17.65219 90.82096       4.683865      91.53256       6.605495      90.10133       6.642631  685.2776 24.82052 679.8636 25.15882 5.414001       35.34154 
1 1 1 4   3  20 o 631.8200 21.99868 77.71754       5.397815      76.55506       9.513123      78.26952       6.555222  624.0613 39.45566 633.6746 26.63748 -9.613281      47.60572 
1 1 1 4   3  21 o 787.6072 20.50489 120.7113       6.271843      117.7052       7.661926      126.8163       10.91889  777.2957 25.38188 805.6442 34.89853 -28.34845      43.15260 
1 1 1 4   3  22 f 116.6682 50.00188 -0.1755398     4.049188      3.812421       5.588870      -4.581760      5.874645  164.8876 62.86588 118.4851 54.68913 46.40249       83.32478 
1 1 1 4   3  23 o 285.1135 40.46700 16.25268       4.354965      13.50584       5.989884      19.33290       6.342973  255.7930 61.13081 308.2616 55.00151 -52.46861      82.23225 
1 1 1 4   3  24 o 621.3121 22.03603 75.21328       5.317056      72.64108       7.277224      78.15894       7.787600  608.8337 30.87897 631.4077 31.86176 -22.57397      44.36984 
1 1 1 4   3  25 o 460.1312 33.30256 41.66665       5.910736      43.13264       7.240415      38.73776       10.23410  466.7697 40.33869 436.3541 62.14864 30.41556       74.09226 
1 1 1 4   3  26 o 303.5632 44.71706 18.56263       5.113775      25.60342       7.192906      11.36678       7.271677  355.1036 53.84708 235.9558 72.42081 119.1478       90.24567 
1 1 1 4   3  27 o 713.6151 22.46690 99.38840       6.226372      95.33605       8.567818      103.9237       9.063952  697.1772 31.64456 727.8019 32.06834 -30.62469      45.05281 
1 1 1 4   3  28 o 278.5818 51.28299 16.01688       5.343787      32.00505       7.493722      -0.5252288     7.622434  397.0157 49.69131 155.3880 67.60474 241.6277       83.90249 
1 1 1 4   3  29 o 331.8915 51.72716 22.74137       6.449880      31.22393       7.628822      1.480804       12.07762  389.9703 51.64344 199.0407 85.84471 190.9296       100.1816 
1 1 1 4   3  30 o 228.7664 69.31514 11.31297       6.690217      6.806578       8.025230      21.58014       12.11346  197.8959 75.36061 304.3057 93.48380 -106.4098      120.0768 
1 1 1 4   3  31 o 281.6525 55.21762 16.98676       5.823864      4.771689       8.141835      29.78493       8.333898  183.3887 74.03638 372.6715 59.59064 -189.2828      95.03910 
1 1 1 4   3  32 o 123.0038 55.93404 -2.416918      5.845341      -7.429407      8.165504      2.851619       8.371463  128.9779 61.09771 171.7634 72.69347 -42.78551      94.95930 
1 1 1 4   3  33 o 323.5976 67.90404 24.05679       8.261418      0.000000       0.000000      24.05679       8.261418  ?        ?        323.5976 67.90404 0.000000       67.90404 
1 1 1 4   4  0  o 784.5048 11.34454 119.5918       3.456292      120.7319       4.071999      116.6534       6.537065  788.1293 13.30400 774.0641 21.74593 14.06519       25.49278 
1 1 1 4   4  1  o 334.5762 13.80165 21.75871       1.793304      21.39001       2.488590      22.15698       2.586472  330.9941 19.44539 336.8571 19.85909 -5.862915      27.79401 
1 1 1 4   4  2  o 1086.476 12.10370 229.3815       5.107004      230.3431       7.206294      228.4113       7.238603  1088.356 17.04955 1083.769 17.19849 4.587402       24.21725 
1 1 1 4   4  3  o 185.7832 17.84885 6.773867       1.271938      5.862997       1.723924      7.862148       1.884346  171.4512 26.76558 199.3969 24.87509 -27.94566      36.53992 
1 1 1 4   4  4  o 921.8453 11.78618 165.1145       4.219481      158.6130       5.836698      172.2321       6.106966  903.2339 16.63945 941.2083 16.70751 -37.97430      23.57991 
1 1 1 4   4  5  o 1538.691 20.07957 460.5293       11.99869      0.000000       0.000000      460.5293       11.99869  ?        ?        1538.691 20.07957 0.000000       20.07957 
1 1 1 4   4  6  o 572.7152 11.91305 63.72965       2.649658      66.17843       3.785433      61.37741       3.710068  583.4419 16.70667 561.8680 17.00276 21.57385       23.83709 
1 1 1 4   4  7  o 1111.691 12.58240 240.1461       5.432198      250.7374       7.976349      230.9844       7.418522  1135.511 18.08777 1089.915 17.52657 45.59607       25.18626 
1 1 1 4   4  8  o 549.0305 12.70026 58.57774       2.707928      57.45137       3.786543      59.75684       3.874137  543.5136 17.93926 554.3089 17.99679 -10.79529      25.41066 
1 1 1 4   4  9  o 260.8069 19.72942 13.31093       1.983521      14.34547       2.766426      12.21641       2.845490  269.9773 26.73693 248.4271 30.10873 21.55019       40.26659 
1 1 1 4   4  10 o 1066.833 13.02995 221.2302       5.398428      214.8754       7.461877      228.2092       7.819752  1050.868 18.28403 1082.945 18.59340 -32.07654      26.07720 
1 1 1 4   4  11 o 1059.410 15.09361 218.2956       6.209911      213.6246       7.567511      227.9260       10.86597  1047.565 18.60133 1080.792 25.88798 -33.22729      31.87785 
1 1 1 4   4  12 o 426.6615 18.64399 35.45499       3.089231      33.36919       3.833143      39.32043       5.218156  412.8228 24.01284 447.2255 30.22169 -34.40265      38.60009 
1 1 1 4   4  13 o 435.3804 17.42412 36.91952       2.946102      36.53065       4.121339      37.32588       4.213008  431.7305 24.68334 436.3739 24.96390 -4.643433      35.10646 
1 1 1 4   4  14 o 939.2954 13.96087 171.6758       5.092635      168.6625       7.128486      174.8169       7.277988  930.0475 19.73623 946.8526 19.79251 -16.80505      27.95107 
1 1 1 4   4  15 o 480.6003 18.12634 45.00487       3.383157      45.13832       4.846380      44.87803       4.724945  479.7324 26.11131 478.4500 25.52135 1.282379       36.51219 
1 1 1 4   4  16 o 444.5345 22.98612 38.66630       3.954678      37.32561       6.603868      39.41591       4.937998  433.4639 39.66985 447.9207 28.53574 -14.45673      48.86702 
1 1 1 4   4  17 o 821.4072 15.56662 131.2728       4.965703      137.9156       7.192046      125.2213       6.864528  841.1016 22.01791 801.4528 22.05488 39.64880       31.16418 
1 1 1 4   4  18 o 165.6235 52.97279 5.323366       3.850870      4.611679       6.836728      5.654084       4.660501  180.9072 69.39803 173.7611 58.42876 7.146057       90.71938 
1 1 1 4   4  19 o 1377.507 15.92800 369.0169       8.520849      378.6876       12.34865      360.2275       11.77259  1394.327 22.80482 1360.012 22.28954 34.31494       31.88861 
1 1 1 4   4  20 o 614.7067 19.15328 73.51517       4.572346      75.26394       6.472399      71.77303       6.460166  621.3963 26.82061 606.7626 27.41554 14.63367       38.35305 
1 1 1 4   4  21 o 932.3611 19.30648 169.1190       6.990612      166.6091       8.416578      174.7017       12.55262  925.0015 23.42962 945.7096 34.17815 -20.70813      41.43782 
1 1 1 4   4  22 o 386.9280 34.30677 29.48407       5.101650      25.77556       6.152966      37.64156       9.125638  359.6284 45.04386 433.2839 55.50916 -73.65555      71.48577 
1 1 1 4   4  23 o 696.4936 20.39119 94.44522       5.515534      95.59418       7.670292      93.21503       7.936819  699.8724 28.22052 690.9366 29.57878 8.935791       40.88157 
1 1 1 4   4  24 o 250.0335 55.13831 12.86750       5.210104      9.072349       6.325129      20.87711       9.188835  213.8643 67.83638 315.4561 75.92244 -101.5919      101.8135 
1 1 1 4   4  25 o 614.6346 23.44701 73.66396       5.596706      79.65272       7.688700      66.91453       8.162398  638.1282 31.02537 583.0196 36.22936 55.10858       47.69843 
1 1 1 4   4  26 f 788.3351 21.20930 121.1432       6.493297      123.6618       9.057737      118.4803       9.313418  795.0889 29.33432 777.9546 30.82669 17.13428       42.55335 
1 1 1 4   4  27 o 290.4676 48.77869 17.21224       5.307396      22.36977       7.286992      11.38516       7.745564  328.9057 59.22736 235.9713 75.09127 92.93442       95.63774 
1 1 1 4   4  28 o 389.4441 36.64493 30.21653       5.477084      39.59377       7.453569      19.20977       8.075264  444.0366 43.79359 299.4081 70.59793 144.6284       83.07795 
1 1 1 4   4  29 o 502.5020 34.16008 50.16903       6.626716      47.62079       7.804537      56.75249       12.54452  486.8239 41.68267 521.0139 63.29798 -34.18991      75.78970 
1 1 1 4   4  30 o 561.3212 32.89288 62.69096       7.139063      64.67638       8.555922      58.14061       12.95282  567.3981 39.06659 522.6251 65.23936 44.77301       76.04192 
1 1 1 4   4  31 o 380.0766 60.97252 31.15735       8.695546      0.000000       0.000000      31.15735       8.695546  ?        ?        380.0766 60.97252 0.000000       60.97252 
1 1 1 4   4  32 o 530.3900 34.80086 56.82079       7.128499      57.34012       12.45523      56.56781       8.693039  510.2304 64.28451 523.8704 43.11138 -13.64005      77.40212 
1 1 1 4   5  0  o 1169.749 12.59913 265.9058       5.723496      263.7187       6.650051      272.1552       11.24097  1164.761 14.70144 1182.115 24.48590 -17.35303      28.56032 
1 1 1 4   5  1  o 1640.333 14.66793 523.0147       9.343914      521.7009       13.13519      524.3606       13.29483  1637.436 20.65590 1641.572 20.85427 -4.136108      29.35246 
1 1 1 4   5  2  o 956.2239 16.54369 177.7752       6.143559      177.7752       6.143559      0.000000       0.000000  956.2239 16.54369 ?        ?        0.000000       16.54369 
1 1 1 4   5  3  o 995.6671 14.09717 192.6701       5.450974      181.5479       9.518765      198.0972       6.649183  965.5353 25.38543 1009.391 16.96215 -43.85559      30.53088 
1 1 1 4   5  4  o 1576.070 16.76709 482.9272       10.26269      478.0873       17.98371      485.2645       12.49746  1566.129 29.56812 1579.418 20.37495 -13.28931      35.90839 
1 1 1 4   5  5  o 1772.228 17.97781 610.7260       12.37327      624.9139       15.41868      585.0620       20.73717  1792.045 22.15493 1732.239 30.82574 59.80542       37.96139 
1 1 1 4   5  6  o 714.7061 11.59818 99.24602       3.219180      98.36653       4.534927      100.1394       4.570498  711.3187 16.41641 717.7009 16.39804 -6.382263      23.20333 
1 1 1 4   5  7  o 583.8258 17.00975 66.27711       3.856641      66.27711       3.856641      0.000000       0.000000  583.8258 17.00975 ?        ?        0.000000       17.00975 
1 1 1 4   5  8  o 1152.865 12.87693 258.3023       5.765260      267.3079       8.357084      250.1245       7.963749  1172.271 18.35688 1133.995 18.08332 38.27527       25.76784 
1 1 1 4   5  9  o 591.5056 12.90404 68.00414       2.964235      71.37402       4.227648      64.74538       4.157358  605.7093 17.97242 576.8617 18.55742 28.84760       25.83381 
1 1 1 4   5  10 o 99.94024 38.36867 1.312702       2.090843      2.676052       2.626953      -1.043742      3.453641  124.3767 43.79037 101.2398 44.72654 23.13691       62.59441 
1 1 1 4   5  11 o 854.2207 14.63332 141.9297       4.854462      138.9595       5.992462      147.6000       8.279839  844.8371 18.26436 869.7903 24.51203 -24.95325      30.56839 
1 1 1 4   5  12 o 767.1097 19.00378 114.6487       5.661420      0.000000       0.000000      114.6487       5.661420  ?        ?        767.1097 19.00378 0.000000       19.00378 
1 1 1 4   5  13 o 825.0983 13.78773 132.4547       4.418007      132.4718       6.260031      132.4377       6.236049  824.3290 19.55455 824.2352 19.48186 0.9381104E-01  27.60296 
1 1 1 4   5  14 o 924.0160 14.04955 166.1416       5.041619      172.8217       7.285067      160.0016       6.984293  941.4005 19.92650 905.8248 19.85410 35.57574       28.12918 
1 1 1 4   5  15 o 284.5205 30.32886 16.04158       3.299525      21.79964       5.572320      12.93270       4.094494  328.8647 44.79607 252.2915 43.35205 76.57320       62.33849 
1 1 1 4   5  16 o 999.3066 14.71741 194.2907       5.711606      187.7915       7.917109      201.3443       8.247902  981.4922 20.77073 1016.268 20.89812 -34.77563      29.46447 
1 1 1 4   5  17 o 979.4727 17.58000 186.7346       6.687120      172.0829       11.37768      194.4668       8.265402  937.8405 31.23898 998.9850 21.30478 -61.14459      37.81226 
1 1 1 4   5  18 o 479.5632 24.50827 44.95065       4.549185      42.49015       8.009020      46.12260       5.527408  462.5556 45.16099 485.0939 29.48027 -22.53830      53.93145 
1 1 1 4   5  19 o 441.9213 26.78690 38.21712       4.575515      44.55574       8.244308      35.39570       5.500365  474.1239 45.32720 424.2542 33.66036 49.86978       56.45861 
1 1 1 4   5  20 o 688.5439 18.31399 92.21841       4.897141      88.19299       6.757667      96.67040       7.106716  672.7665 25.86452 704.3481 25.98087 -31.58154      36.66032 
1 1 1 4   5  21 o 319.1298 33.34512 20.10170       4.071610      16.59860       5.678994      23.80710       5.840662  285.9020 53.10258 345.6220 44.55159 -59.71994      69.31615 
1 1 1 4   5  22 f 1016.127 19.65856 200.9302       7.757603      206.4200       9.502370      189.9596       13.43293  1029.394 23.76963 985.6414 35.09325 43.75250       42.38551 
1 1 1 4   5  23 o 504.1013 28.60766 49.76565       5.577442      48.41782       6.695143      52.82227       10.08240  496.1614 34.97012 514.7777 51.10878 -18.61627      61.92751 
1 1 1 4   5  24 o 590.7924 23.40428 68.04374       5.369800      68.16337       7.371923      67.90852       7.837535  589.3883 32.33052 587.8624 34.48104 1.525879       47.26738 
1 1 1 4   5  25 o 856.2690 19.66500 142.7988       6.539314      135.8772       8.848896      151.1271       9.706451  834.0953 27.31778 879.4483 28.41988 -45.35303      39.42018 
1 1 1 4   5  26 o 172.8850 60.23902 5.427933       4.964369      6.666182       6.749950      3.968987       7.326832  194.7837 70.02032 179.6760 70.99717 15.10771       99.71681 
1 1 1 4   5  27 o 301.2728 46.00388 18.41262       5.211807      27.17933       7.082330      8.057572       7.697221  365.6797 51.28093 209.6168 74.83356 156.0629       90.71822 
1 1 1 4   5  28 o 210.9263 66.13369 9.164003       6.027481      10.49492       6.984988      5.283206       11.92753  224.9861 71.27888 216.2462 88.74201 8.739853       113.8236 
1 1 1 4   5  29 f 240.4792 58.22900 12.30353       5.380085      13.40030       7.160646      10.88182       8.152702  248.6938 70.76227 229.0696 77.27769 19.62419       104.7814 
1 1 1 4   5  30 o 247.9501 57.80590 13.20941       5.463651      16.08901       7.468935      9.894772       8.013291  269.4607 70.54507 218.8346 76.51743 50.62608       104.0746 
1 1 1 4   5  31 o 225.1176 62.72873 11.18461       5.688545      17.58128       7.951147      4.477382       8.141878  277.5400 72.84782 180.8643 73.66564 96.67575       103.6023 
1 1 1 4   5  32 o 394.1352 54.73021 33.37056       8.151131      44.59485       11.58775      22.37696       11.46806  444.5011 69.39470 297.3712 90.89378 147.1299       114.3560 
1 1 1 4   6  0  o 493.3149 12.74181 47.29054       2.441087      47.09422       3.410525      47.49677       3.495480  492.1112 17.84555 494.1948 18.21297 -2.083588      25.49855 
1 1 1 4   6  1  o 881.5945 11.83607 151.0128       4.052325      147.5626       5.634632      154.7090       5.832179  871.1927 16.65418 892.0267 16.83546 -20.83398      23.68110 
1 1 1 4   6  2  o 710.7079 11.71568 98.14008       3.233603      102.0099       4.642757      94.49438       4.506306  724.3663 16.50402 697.1650 16.64398 27.20123       23.43938 
1 1 1 4   6  3  o 852.2703 18.40841 141.2540       6.092867      146.5087       8.806108      136.4285       8.438852  867.3204 26.14426 836.9692 25.96247 30.35126       36.84525 
1 1 1 4   6  4  o 602.9891 19.53153 70.72056       4.573763      77.99088       6.608320      64.03546       6.336778  632.7507 26.89245 573.2422 28.46442 59.50848       39.15900 
1 1 1 4   6  5  o 1188.345 19.34019 274.6715       8.925475      280.0550       12.78200      269.5486       12.46887  1198.912 27.45260 1176.231 27.29647 22.68115       38.71360 
1 1 1 4   6  6  o 576.1353 29.39136 64.88521       6.554287      0.000000       0.000000      64.88521       6.554287  ?        ?        576.1353 29.39136 0.000000       29.39136 
1 1 1 4   6  7  o 271.5892 15.91724 14.39030       1.671504      13.08820       2.325431      15.78219       2.404269  258.2044 23.44620 283.8956 21.97828 -25.69125      32.13672 
1 1 1 4   6  8  o 1135.254 12.84532 250.4881       5.663254      248.2712       7.959926      252.7605       8.059097  1129.699 18.14339 1139.860 18.20569 -10.16077      25.70271 
1 1 1 4   6  9  f 550.2202 14.49609 58.86359       3.097528      56.56194       3.878021      62.91981       5.148157  539.1298 18.52204 568.2637 23.32780 -29.13391      29.78678 
1 1 1 4   6  10 o 459.8709 16.08274 41.14314       2.872261      37.34199       3.563048      48.19736       4.853875  437.8221 20.95540 496.4090 25.26141 -58.58688      32.82176 
1 1 1 4   6  11 o 163.4773 35.24396 5.443545       2.171666      8.980133       3.086617      1.976745       3.056011  210.3773 39.22240 120.9135 46.39473 89.46386       60.75251 
1 1 1 4   6  12 o 716.2122 13.71358 99.79181       3.814351      105.3132       5.489765      94.63839       5.303661  735.0950 19.23013 696.7946 19.59941 38.30048       27.45788 
1 1 1 4   6  13 o 915.7880 13.65962 163.1755       4.858046      159.5159       6.815327      166.9556       6.926654  904.5433 19.40123 925.4210 19.27330 -20.87769      27.34718 
1 1 1 4   6  14 o 587.0139 17.54856 67.13011       4.000534      75.28690       6.783096      62.77955       4.953829  620.0584 28.16874 567.0777 22.49419 52.98071       36.04811 
1 1 1 4   6  15 o 402.0192 24.34741 31.68005       3.783335      43.91866       7.310537      27.20324       4.421477  470.1518 40.43235 371.2908 30.94561 98.86099       50.91567 
1 1 1 4   6  16 o 388.5893 22.57533 29.54802       3.392166      33.24324       4.848798      26.00586       4.747308  410.9989 30.59762 362.5933 34.11426 48.40561       45.82573 
1 1 1 4   6  17 o 770.4594 15.80820 115.4765       4.729989      120.3455       6.684034      110.5923       6.694406  785.8737 21.90070 753.2344 22.88516 32.63934       31.67603 
1 1 1 4   6  18 o 528.2892 19.69020 54.32560       4.039708      54.91872       5.674305      53.71602       5.752517  529.8215 27.67355 523.8707 28.38108 5.950867       39.63977 
1 1 1 4   6  19 o 1118.247 18.42455 243.2721       8.001337      246.8994       14.23632      241.5973       9.673825  1124.297 32.60532 1113.894 22.36280 10.40271       39.53735 
1 1 1 4   6  20 f 397.0464 38.66475 31.13084       5.886253      0.000000       0.000000      31.13084       5.886253  ?        ?        397.0464 38.66475 0.000000       38.66475 
1 1 1 4   6  21 o 1651.423 19.79435 530.6470       12.69485      537.9791       15.54393      515.9601       21.99955  1661.976 24.08287 1624.914 34.86225 37.06165       42.37170 
1 1 1 4   6  22 o 533.0967 23.16850 55.35930       4.796583      54.08979       6.491513      56.88591       7.118553  525.2404 31.97661 538.3235 34.22806 -13.08313      46.84084 
1 1 1 4   6  23 o 886.3436 20.95321 152.9993       7.212415      155.2854       8.782730      148.2646       12.63929  892.3298 25.34406 869.7081 37.42150 22.62177       45.19613 
1 1 1 4   6  24 o 401.7148 32.44387 31.77923       5.018300      33.55560       6.901705      29.78660       7.309755  410.5422 43.97235 385.0745 50.06408 25.46777       66.63317 
1 1 1 4   6  25 o 677.2133 22.46279 89.41221       5.907683      96.96979       8.191675      81.22147       8.527917  704.1537 29.95555 642.8483 34.28290 61.30542       45.52639 
1 1 1 4   6  26 o 496.0643 28.36773 48.29308       5.442320      42.57828       7.367794      55.15551       8.073767  462.8391 41.42836 527.6943 39.68789 -64.85526      57.37105 
1 1 1 4   6  27 f 358.3256 45.18621 25.88778       6.148175      21.17239       7.217002      38.36531       11.73983  318.8646 60.49360 426.4548 73.54238 -107.5902      95.22582 
1 1 1 4   6  28 o 334.2179 50.44690 22.91553       6.343933      26.45204       7.412059      13.22878       12.26706  357.8336 55.10563 258.5844 94.18504 99.24921       109.1213 
1 1 1 4   6  29 o 711.4851 23.68195 99.25584       6.543518      97.63320       8.797059      101.2656       9.790282  702.7500 32.23359 714.4436 35.28574 -11.69360      47.79213 
1 1 1 4   6  30 o 169.2313 63.01794 5.034535       5.542571      3.927845       7.623389      6.275506       8.072648  176.0305 71.43871 193.4921 75.08874 -17.46167      103.6427 
1 1 1 4   6  31 o 238.1813 66.93093 12.73277       6.447770      9.791780       10.42352      14.55559       8.206163  221.5329 85.50484 251.2266 76.90464 -29.69373      115.0017 
1 1 1 4   6  32 o 529.2618 31.42239 56.26361       6.429642      62.41930       9.489591      51.03947       8.742107  548.2666 44.96420 494.7158 46.03032 53.55084       64.34725 
1 1 1 4   7  0  o 1093.576 17.83945 232.5545       7.576325      232.5545       7.576325      0.000000       0.000000  1093.576 17.83945 ?        ?        0.000000       17.83945 
1 1 1 4   7  1  o 1619.604 14.68975 509.8452       9.239559      509.1070       12.99289      510.6003       13.14181  1617.659 20.68190 1619.999 20.88875 -2.339355      29.39525 
1 1 1 4   7  2  o 2187.946 17.70552 930.8560       15.04434      928.9244       21.17516      932.8249       21.37812  2184.157 24.96404 2188.691 25.15110 -4.534668      35.43700 
1 1 1 4   7  3  o 1369.938 20.30971 365.0984       10.80519      365.3529       15.27820      364.8436       15.28350  1369.138 28.73406 1368.178 28.76418 0.9599609      40.65741 
1 1 1 4   7  4  o 1271.080 15.48450 314.0709       7.643605      324.2400       9.406620      294.3060       13.11411  1291.158 18.75971 1228.966 27.47709 62.19214       33.27037 
1 1 1 4   7  5  o 958.5322 19.06658 178.7235       7.097533      180.0521       10.04429      177.3984       10.03058  961.2445 26.90651 954.1141 27.07060 7.130432       38.16775 
1 1 1 4   7  6  o 548.7632 14.65410 58.53979       3.123001      59.09848       3.564232      56.69309       6.480100  551.2866 16.64794 538.1002 31.14234 13.18640       35.31288 
1 1 1 4   7  7  o 1382.116 16.08478 371.4639       8.633513      366.7227       10.18674      383.5533       16.26643  1372.858 19.10653 1401.939 29.87687 -29.08118      35.46388 
1 1 1 4   7  8  o 511.3994 13.70530 50.84235       2.721928      53.63101       3.546119      46.84300       4.246685  525.0501 17.39100 490.4025 22.29818 34.64761       28.27818 
1 1 1 4   7  9  o 1721.805 17.64236 576.9333       11.79692      568.3694       14.40219      594.3945       20.56494  1708.008 21.71255 1743.892 30.36545 -35.88452      37.32955 
1 1 1 4   7  10 o 630.3431 13.11930 77.26400       3.211557      83.86438       4.645425      71.22124       4.444866  656.2764 18.22681 604.7219 18.92670 51.55457       26.27616 
1 1 1 4   7  11 o 786.4538 13.09961 120.2969       4.000916      125.6170       5.769614      115.3689       5.552906  803.0038 18.50125 769.5411 18.58063 33.46277       26.22091 
1 1 1 4   7  12 o 822.3589 13.46675 131.5672       4.300828      126.2725       5.972105      137.2716       6.198809  804.8667 19.10625 839.2037 19.02011 -34.33698      26.95947 
1 1 1 4   7  13 o 72.80856 34.55089 -3.197413      2.633970      -6.452778      4.040403      -0.7914356     3.473526  83.82659 40.55733 102.8612 45.17101 -19.03460      60.70681 
1 1 1 4   7  14 o 707.7671 17.79653 97.58936       4.891632      98.65691       9.226725      97.17200       5.769126  708.6780 33.52514 705.7916 21.04774 2.886414       39.58463 
1 1 1 4   7  15 o 1197.353 14.55481 278.9352       6.767943      272.6981       9.343237      285.8210       9.816960  1182.774 20.34078 1210.773 20.87787 -27.99951      29.14846 
1 1 1 4   7  16 o 705.5183 15.71806 96.84503       4.306607      97.18387       6.002477      96.48557       6.182435  706.0935 21.88972 703.4592 22.63042 2.634338       31.48485 
1 1 1 4   7  17 o 339.2495 25.92637 22.58045       3.389910      21.70727       4.660927      23.56104       4.939287  330.8123 36.90881 344.6977 37.50272 -13.88544      52.61858 
1 1 1 4   7  18 o 982.4515 21.71596 187.9544       8.285488      187.9544       8.285488      0.000000       0.000000  982.4515 21.71596 ?        ?        0.000000       21.71596 
1 1 1 4   7  19 f 1346.722 23.25841 353.1881       12.16427      353.6329       17.17112      352.7401       17.23481  1345.642 32.85799 1343.904 33.02253 1.738525       46.58470 
1 1 1 4   7  20 o 808.9731 20.45632 127.3486       6.426725      122.1217       11.15482      129.9456       7.862863  790.3811 36.34109 816.7722 24.78859 -26.39105      43.99033 
1 1 1 4   7  21 o 907.4128 16.99544 160.1348       5.989151      164.8701       8.421708      155.2895       8.519006  920.0692 23.56957 892.8207 24.56952 27.24847       34.04682 
1 1 1 4   7  22 o 439.9871 26.91072 37.89926       4.576153      42.03545       6.403422      33.58196       6.542122  462.0533 35.96896 411.6501 41.48817 50.40323       54.90933 
1 1 1 4   7  23 o 735.8156 22.75982 105.5128       6.503778      97.00342       7.599111      128.8140       12.57481  704.9012 27.75917 809.9734 39.97631 -105.0721      48.66905 
1 1 1 4   7  24 o 442.8939 32.94530 38.60593       5.626032      40.22801       6.849755      35.24294       9.862836  450.8566 39.51973 415.5886 63.09246 35.26801       74.44775 
1 1 1 4   7  25 o 435.9958 31.08795 37.39095       5.229349      44.59201       7.126427      28.98985       7.697360  474.6918 39.00222 378.3491 53.91149 96.34274       66.54038 
1 1 1 4   7  26 o 430.3191 32.69741 36.53562       5.423398      42.20999       7.424407      30.04356       7.941349  460.4734 41.97861 384.2412 54.76844 76.23218       69.00569 
1 1 1 4   7  27 o 652.1357 28.24015 83.38263       7.152090      96.24512       8.491496      51.98172       13.26761  699.8774 31.24167 498.5264 70.49533 201.3511       77.10793 
1 1 1 4   7  28 f 279.6611 51.79486 16.24294       5.418148      21.53193       7.297262      9.744773       8.088519  319.6042 61.01785 221.3759 76.90558 98.22827       98.17152 
1 1 1 4   7  29 f 223.6759 60.25125 10.71651       5.351060      9.911780       7.154068      11.73849       8.062134  217.9164 72.37832 234.4198 76.78558 -16.50345      105.5208 
1 1 1 4   7  30 o 239.6203 66.74023 12.67251       6.440871      12.92194       9.862658      12.48703       8.504941  242.8080 84.88970 237.8752 78.91210 4.932831       115.9025 
1 1 1 4   7  31 o 269.4170 63.94532 16.22085       6.590239      18.55398       10.61465      14.75736       8.406779  276.4134 87.89960 251.7066 77.97037 24.70679       117.4977 
1 1 1 4   7  32 o 436.2461 35.99276 38.73222       6.043374      34.86750       8.868900      42.08212       8.257100  398.9746 59.02070 446.8847 48.34856 -47.91010      76.29565 
1 1 1 4   8  0  o 784.1277 12.48946 119.4795       3.803282      117.1140       5.289475      122.0115       5.472497  776.0468 17.55079 792.0909 17.79027 -16.04413      24.99048 
1 1 1 4   8  1  o 1726.305 15.37618 579.3224       10.30846      591.3348       14.89332      568.2751       14.28258  1743.087 22.00110 1708.847 21.52165 34.24011       30.77710 
1 1 1 4   8  2  o 664.7456 12.08144 85.86451       3.118906      84.35921       4.313448      87.51380       4.515054  658.6740 16.86266 670.8506 17.33042 -12.17664      24.18042 
1 1 1 4   8  3  o 608.1218 20.68320 71.96071       4.884682      84.16374       7.169074      61.38651       6.673487  657.0812 28.09416 560.1140 30.79781 96.96722       41.68677 
1 1 1 4   8  4  o 1058.406 14.66182 217.7609       6.026540      214.6907       7.059223      226.0126       11.57289  1050.692 17.30030 1076.757 27.67555 -26.06555      32.63796 
1 1 1 4   8  5  o 666.8374 20.26225 86.53598       5.247297      84.21118       7.351545      88.95049       7.492048  657.0793 28.80931 675.3414 28.56598 -18.26202      40.57082 
1 1 1 4   8  6  o 617.5720 30.08488 74.44559       7.215458      74.44559       7.215458      0.000000       0.000000  617.5720 30.08488 ?        ?        0.000000       30.08488 
1 1 1 4   8  7  o 497.9781 16.65228 48.23668       3.220415      48.23668       3.220415      0.000000       0.000000  497.9781 16.65228 ?        ?        0.000000       16.65228 
1 1 1 4   8  8  o 510.9127 15.54490 50.77332       3.084344      51.58796       3.466150      47.67468       6.760077  514.8878 17.33432 492.0388 35.61816 22.84894       39.61227 
1 1 1 4   8  9  o 952.5242 12.55504 176.4048       4.644319      181.3936       6.666974      171.7015       6.473419  965.2729 17.78487 939.1359 17.74914 26.13696       25.12635 
1 1 1 4   8  10 o 592.4654 13.25164 68.27076       3.049023      65.37263       4.260126      71.31438       4.365755  579.2604 18.93741 605.0504 18.57975 -25.78992      26.52984 
1 1 1 4   8  11 o 332.5402 26.75140 21.76821       3.425537      0.000000       0.000000      21.76821       3.425537  ?        ?        332.5402 26.75140 0.000000       26.75140 
1 1 1 4   8  12 o 984.4461 19.08225 188.9268       7.295405      0.000000       0.000000      188.9268       7.295405  ?        ?        984.4461 19.08225 0.000000       19.08225 
1 1 1 4   8  13 o 879.3121 15.57614 150.5233       5.319011      154.0828       8.801548      148.4755       6.675997  887.7225 25.53018 872.6368 19.69947 15.08563       32.24685 
1 1 1 4   8  14 o 308.9192 24.18033 18.74937       2.877765      19.33208       4.008127      18.12938       4.134357  312.0531 33.60377 301.5770 36.01289 10.47614       49.25587 
1 1 1 4   8  15 o 832.6343 14.66327 134.8697       4.741470      136.7508       6.637753      132.9098       6.775265  837.6925 20.40368 825.7373 21.12790 11.95520       29.37173 
1 1 1 4   8  16 o 780.3392 15.30233 118.4466       4.637340      120.1177       6.475998      116.6880       6.643592  785.1909 21.23750 773.7911 22.10809 11.39972       30.65615 
1 1 1 4   8  17 o 776.8398 15.78806 117.3700       4.763084      124.0751       6.760509      110.7613       6.711792  798.1404 21.81083 753.9835 22.92180 44.15692       31.64050 
1 1 1 4   8  18 o 498.1784 24.00624 48.34872       4.644480      49.89788       5.540447      44.68671       8.518378  504.9847 28.36619 474.5619 46.83139 30.42279       54.75235 
1 1 1 4   8  19 o 603.1979 19.01262 70.78301       4.453791      77.09591       6.177067      63.94760       6.427626  629.0709 25.28452 571.8956 29.03575 57.17535       38.50171 
1 1 1 4   8  20 o 748.0948 21.16465 108.9223       6.148877      103.9629       10.42706      111.5664       7.613580  728.2189 36.99139 756.6844 25.90873 -28.46558      45.16221 
1 1 1 4   8  21 o 1507.707 16.84684 442.1135       9.864233      434.3195       13.58565      450.8039       14.34561  1493.232 23.42746 1521.129 24.28428 -27.89673      33.74273 
1 1 1 4   8  22 o 692.3671 19.84811 93.32291       5.336832      95.45801       7.300531      90.87244       7.821181  699.4939 26.87463 682.1547 29.52307 17.33923       39.92315 
1 1 1 4   8  23 o 368.0603 34.15308 26.74761       4.826139      36.80219       6.645949      15.53013       7.019766  431.0462 40.16375 273.1802 66.73831 157.8660       77.89178 
1 1 1 4   8  24 o 115.5648 52.65432 -3.157913      5.212255      -2.095229      6.224836      -5.650844      9.534124  133.8233 59.53761 155.2819 70.92967 -21.45854      92.60532 
1 1 1 4   8  25 o 350.0802 38.74063 24.38960       5.178702      32.16105       7.253766      16.31065       7.395884  400.4120 47.57877 278.8310 68.73746 121.5809       83.59771 
1 1 1 4   8  26 o 531.2610 32.37680 55.60649       6.648020      53.98860       7.894153      59.55236       12.32824  521.6795 39.25261 540.8549 59.68814 -19.17542      71.43838 
1 1 1 4   8  27 o 312.0709 45.05342 19.77424       5.302076      17.93046       7.065296      22.15117       8.022033  291.0067 64.23636 323.5340 66.08021 -32.52734      92.15695 
1 1 1 4   8  28 o 427.7410 34.67004 36.42958       5.709666      38.40891       7.710935      34.02710       8.495305  435.1709 46.33960 405.6544 55.37188 29.51648       72.20391 
1 1 1 4   8  29 o 123.0996 55.02435 -1.681466      5.384089      3.856247       7.307940      -8.255804      7.962617  174.1907 70.20589 126.9464 60.19281 47.24423       92.47726 
1 1 1 4   8  30 o 637.5928 30.36690 80.68228       7.519203      102.0255       12.27442      67.86172       9.513165  706.7246 44.95583 577.2968 42.73605 129.4278       62.02739 
1 1 1 4   8  31 o 387.7205 39.90878 30.81888       5.923342      38.64276       8.696438      24.04792       8.090127  426.0004 53.76305 327.5711 65.87797 98.42929       85.03159 
1 1 1 4   8  32 o 340.7854 44.97836 24.39200       5.807224      24.85716       8.692383      24.01701       7.804488  327.3372 70.46366 326.3479 63.86615 0.9892273      95.10001 
1 1 1 4   9  0  f 1590.332 14.92258 491.6807       9.216366      498.5706       13.16383      485.0562       12.90776  1600.484 21.17889 1578.665 21.05392 21.81860       29.86323 
1 1 1 4   9  1  f 396.0467 15.06455 30.49387       2.317024      30.56481       3.260269      30.42147       3.293516  395.7007 21.29412 394.7432 21.56573 0.9575195      30.30709 
1 1 1 4   9  2  o 1271.975 13.39515 314.4659       6.616897      300.1740       8.899092      332.1371       9.895413  1242.199 18.44704 1306.522 19.50246 -64.32300      26.84472 
1 1 1 4   9  3  o 325.1681 14.97345 20.55656       1.890853      24.92595       2.846088      17.10411       2.529893  357.2748 20.59982 295.5620 22.20295 61.71289       30.28735 
1 1 1 4   9  4  o 592.0940 21.95025 68.26250       5.047288      73.08189       7.218043      63.65126       7.060454  611.8647 30.37638 569.9722 32.02687 41.89252       44.14120 
1 1 1 4   9  5  o 361.1373 40.68011 25.89415       5.605985      25.89415       5.605985      0.000000       0.000000  361.1373 40.68011 ?        ?        0.000000       40.68011 
1 1 1 4   9  6  o 579.6879 32.00212 65.88953       7.176546      65.88953       7.176546      0.000000       0.000000  579.6879 32.00212 ?        ?        0.000000       32.00212 
1 1 1 4   9  7  o 754.6544 20.62959 110.9304       6.045979      110.4541       8.604845      111.3949       8.496790  751.8130 29.47170 755.0879 28.97540 -3.274841      41.32983 
1 1 1 4   9  8  o 651.1679 14.71129 82.48376       3.720248      85.65806       4.308599      73.18340       7.375016  663.4044 16.72360 610.6560 31.20260 52.74841       35.40171 
1 1 1 4   9  9  o 518.6181 13.13354 52.31103       2.645193      55.93961       3.740469      48.68090       3.741266  535.9273 17.97182 499.8358 19.27362 36.09146       26.35258 
1 1 1 4   9  10 o 705.1591 18.28092 96.88717       5.006258      96.88717       5.006258      0.000000       0.000000  705.1591 18.28092 ?        ?        0.000000       18.28092 
1 1 1 4   9  11 f 782.9407 18.80654 119.4868       5.718285      0.000000       0.000000      119.4868       5.718285  ?        ?        782.9407 18.80654 0.000000       18.80654 
1 1 1 4   9  12 o 985.1712 13.49275 188.8315       5.162264      188.5054       7.307837      189.1563       7.293273  983.3448 19.13617 985.0555 19.06487 -1.710693      27.01226 
1 1 1 4   9  13 o 1098.006 13.88566 234.5627       5.921061      233.7724       8.319873      235.3736       8.428472  1095.100 19.56297 1098.803 19.75154 -3.702759      27.79988 
1 1 1 4   9  14 o 506.9132 16.99671 50.02718       3.346003      46.98779       4.593975      53.46129       4.883183  490.6222 24.11090 523.3382 24.02661 -32.71597      34.03842 
1 1 1 4   9  15 o 432.3820 19.74456 36.41428       3.315454      34.47660       4.560313      38.58675       4.828709  419.1245 28.18091 443.5083 28.18131 -24.38382      39.85411 
1 1 1 4   9  16 o 545.3914 20.80870 57.92937       4.407389      57.54799       5.207378      58.89251       8.275399  543.2670 24.68186 546.4832 39.25430 -3.216187      46.36911 
1 1 1 4   9  17 o 323.9753 27.41717 20.61754       3.417180      19.86271       4.619386      21.52984       5.078405  316.1672 38.41071 328.9366 40.61716 -12.76944      55.90292 
1 1 1 4   9  18 o 650.0394 17.68825 82.18774       4.465320      83.67106       6.186129      80.57412       6.452097  655.3907 24.30473 643.0149 25.83758 12.37579       35.47253 
1 1 1 4   9  19 o 745.4188 17.09809 108.0560       4.949665      102.4289       6.751030      114.5966       7.278454  725.2271 23.97001 767.0500 24.43360 -41.82300      34.22809 
1 1 1 4   9  20 o 1269.339 18.94305 313.4626       9.338030      306.1902       16.04579      317.1870       11.48284  1252.089 32.99877 1276.251 23.16782 -24.16150      40.31956 
1 1 1 4   9  21 o 252.3198 51.48874 13.00241       4.874531      12.99990       8.206808      13.00377       6.059132  253.0068 76.79541 250.9805 62.42385 2.026321       98.96601 
1 1 1 4   9  22 o 642.6080 20.86972 80.42381       5.208236      85.46916       7.229722      74.98064       7.509348  661.6537 28.13604 618.5444 31.36363 43.10931       42.13448 
1 1 1 4   9  23 o 433.1103 29.73451 36.83260       4.971059      37.35633       6.812788      36.23625       7.269716  434.0806 40.89556 426.6513 44.53115 7.429321       60.46049 
1 1 1 4   9  24 o 707.1461 24.40488 97.56313       6.702145      90.62860       7.832587      116.5210       12.95065  680.7858 29.62557 767.6258 43.62248 -86.83997      52.73135 
1 1 1 4   9  25 o 809.0172 28.25085 128.0297       8.875999      128.0297       8.875999      0.000000       0.000000  809.0172 28.25085 ?        ?        0.000000       28.25085 
1 1 1 4   9  26 o 170.3129 61.82323 4.993320       5.278958      3.485711       7.030381      6.942086       7.993081  172.9889 69.16274 203.0192 75.66201 -30.03023      102.5096 
1 1 1 4   9  27 o 502.7932 29.79373 49.86429       5.791642      50.26238       7.596415      49.31165       8.950357  501.9520 39.28225 494.2622 47.20275 7.689819       61.41006 
1 1 1 4   9  28 o 333.7007 44.41721 22.69668       5.613230      18.15942       7.488183      28.51651       8.480765  289.4725 67.80070 367.4850 61.60513 -78.01251      91.60856 
1 1 1 4   9  29 o 427.8837 41.43710 37.12329       6.799356      55.10453       10.66045      24.79208       8.828125  514.9500 54.11633 335.6922 69.98492 179.2577       88.46732 
1 1 1 4   9  30 o 283.2980 56.98569 17.35783       6.052343      17.55970       8.451648      17.14533       8.671186  275.7139 76.33022 271.7990 78.04417 3.914917       109.1659 
1 1 1 4   9  31 f 365.6652 43.89761 27.80978       6.109205      15.15584       8.708793      40.07008       8.572267  252.3121 79.55283 434.4463 51.83117 -182.1342      94.94800 
1 1 1 4   10 0  o 1259.176 13.76711 308.2239       6.732200      305.6537       9.395539      310.9359       9.651142  1253.224 19.30478 1263.954 19.66163 -10.72949      27.55457 
1 1 1 4   10 1  f 936.4011 12.82635 170.4334       4.664371      176.6730       6.707391      164.5903       6.490774  952.9149 18.12473 919.7482 18.17187 33.16669       25.66559 
1 1 1 4   10 2  o 182.5151 26.48833 6.630291       1.822666      7.160133       2.657485      6.159665       2.504583  187.9193 37.72515 173.9956 38.11931 13.92368       53.63086 
1 1 1 4   10 3  o 224.3140 21.35077 9.886855       1.837495      9.869118       2.509926      9.907340       2.697413  222.8802 29.73955 222.9107 32.08370 -0.3057861E-01 43.74706 
1 1 1 4   10 4  o 898.5480 17.06197 157.0822       5.953858      168.7173       10.33733      151.3066       7.283184  929.5889 28.63451 881.3983 21.27752 48.19061       35.67447 
1 1 1 4   10 5  o 439.7767 37.35128 38.19566       6.318837      38.19566       6.318837      0.000000       0.000000  439.7767 37.35128 ?        ?        0.000000       37.35128 
1 1 1 4   10 6  o 920.4042 20.35639 165.0322       7.276246      175.6237       10.64240      155.7355       9.970737  947.9150 28.90962 892.6601 28.76161 55.25494       40.77985 
1 1 1 4   10 7  o 671.6567 21.93006 87.96661       5.720252      91.22630       8.206910      84.88677       7.977291  682.5681 30.96034 658.3819 31.19964 24.18616       43.95407 
1 1 1 4   10 8  o 829.8257 14.64214 133.9884       4.718668      135.4515       5.496281      129.8871       9.202136  834.0496 16.96872 814.5586 29.08964 19.49103       33.67706 
1 1 1 4   10 9  o 920.8226 21.14140 165.4145       7.560276      169.9275       10.99420      161.3660       10.41314  930.9894 30.40822 907.4755 29.54735 23.51385       42.39936 
1 1 1 4   10 10 o 128.8015 38.16954 3.320910       2.045378      0.9233933      2.902287      5.686683       2.883011  107.8548 43.96139 166.4126 43.95538 -58.55779      62.16654 
1 1 1 4   10 11 o 608.2978 13.93864 72.00269       3.292795      71.57556       4.559553      72.46828       4.760365  605.8943 19.37749 609.5656 20.10906 -3.671265      27.92600 
1 1 1 4   10 12 o 211.3742 30.04721 8.926620       2.397083      7.879662       3.264851      10.15103       3.530712  195.7485 44.01591 223.0761 42.30300 -27.32761      61.04870 
1 1 1 4   10 13 f 398.4293 18.73690 30.92708       2.899192      33.51659       3.975038      27.98403       4.237711  413.5204 24.86797 377.0115 29.17035 36.50885       38.33178 
1 1 1 4   10 14 f 737.3924 14.73530 105.7731       4.219740      111.7116       5.944078      99.73956       5.991432  757.2112 20.21340 715.3198 21.56763 41.89142       29.55917 
1 1 1 4   10 15 o 842.7036 17.53813 138.1981       5.739660      140.1557       6.834838      133.5150       10.57126  848.2794 20.74729 826.0115 32.95434 22.26788       38.94147 
1 1 1 4   10 16 o 571.3289 17.69444 63.50739       3.926007      57.18758       5.297055      71.21073       5.848194  541.6115 25.18365 604.4049 24.91528 -62.79346      35.42580 
1 1 1 4   10 17 o 693.5694 16.72923 93.55328       4.506026      95.09650       6.304344      91.94148       6.442882  698.7582 23.23191 686.9857 24.14930 11.77258       33.50985 
1 1 1 4   10 18 o 198.9437 45.95083 8.075730       3.478607      5.351630       4.824599      11.02521       5.020216  172.3156 59.42197 231.8464 56.31512 -59.53087      81.86797 
1 1 1 4   10 19 o 859.5789 16.57804 143.6776       5.534100      147.0813       7.733774      140.1057       7.922433  869.1373 22.91264 848.1592 24.05211 20.97809       33.21887 
1 1 1 4   10 20 o 437.7213 24.87116 37.45473       4.210422      42.01824       5.830375      32.48102       6.086768  462.6435 32.66035 405.3921 39.14901 57.25140       50.98376 
1 1 1 4   10 21 o 625.3140 24.35412 76.21945       5.914236      76.76920       9.876992      75.91216       7.384425  624.0754 40.98075 623.3716 30.50294 0.7037354      51.08670 
1 1 1 4   10 22 f 858.8978 18.47535 143.5956       6.162575      140.8163       8.404676      146.8273       9.062891  849.6125 25.47253 867.3245 26.90650 -17.71191      37.05145 
1 1 1 4   10 23 o 1122.649 17.59789 245.3078       7.672421      249.0434       10.60274      241.2015       11.11636  1129.986 24.16112 1111.718 25.74778 18.26733       35.30875 
1 1 1 4   10 24 o 737.1106 45.82291 107.7696       13.05233      0.000000       0.000000      107.7696       13.05233  ?        ?        737.1106 45.82291 0.000000       45.82291 
1 1 1 4   10 25 o 839.0302 27.52172 137.7350       8.967700      137.7350       8.967700      0.000000       0.000000  839.0302 27.52172 ?        ?        0.000000       27.52172 
1 1 1 4   10 26 o 823.5237 21.22564 132.4249       6.788360      134.8872       9.033487      129.2305       10.28895  829.4286 28.04455 810.4477 32.69025 18.98096       43.07144 
1 1 1 4   10 27 f 624.2894 39.81492 77.78339       9.602621      0.000000       0.000000      77.78339       9.602621  ?        ?        624.2894 39.81492 0.000000       39.81492 
1 1 1 4   10 28 o 122.3083 56.12771 -3.654846      6.064144      -2.010900      9.185938      -4.924690      8.073369  161.2059 71.97816 139.4803 64.28591 21.72554       96.50665 
1 1 1 4   10 29 o 267.9944 63.05837 15.71285       6.453433      26.47667       10.26546      8.679142       8.298265  340.5876 79.12188 209.9436 77.31308 130.6440       110.6236 
1 1 1 4   10 30 o 163.6232 63.44700 4.390505       5.759978      2.206771       8.049816      6.681634       8.245383  166.9713 71.00227 193.6921 75.68649 -26.72078      103.7775 
1 1 1 4   10 31 o 373.4702 40.97830 28.81965       5.845790      26.84659       8.564506      30.54069       7.998844  344.4248 66.43701 374.8470 56.72010 -30.42227      87.35586 
1 1 1 4   11 0  o 597.0916 14.09206 69.32581       3.267710      75.07980       4.645614      63.69101       4.597245  620.9954 19.26312 571.8433 20.70106 49.15210       28.27723 
1 1 1 4   11 1  o 787.1572 14.40456 120.4949       4.403415      126.5434       5.739613      111.8413       6.865196  806.3002 18.32980 757.4487 23.33844 48.85156       29.67599 
1 1 1 4   11 2  o 247.5404 22.82447 12.04440       2.169479      16.18578       2.878273      6.596398       3.301250  286.8251 26.12617 179.5798 46.84546 107.2453       53.63836 
1 1 1 4   11 3  o 127.4613 35.33844 3.279554       1.810136      0.4840311E-01  2.420760      7.377563       2.726212  91.71323 38.96659 190.5600 38.16895 -98.84672      54.54598 
1 1 1 4   11 4  o 181.2017 24.72251 6.524164       1.694331      4.166401       2.309499      9.272229       2.493338  143.4695 39.96615 215.5973 30.64120 -72.12782      50.36046 
1 1 1 4   11 5  o 936.8184 20.55285 171.0488       7.477483      168.7724       10.48004      173.4094       10.67209  928.8486 29.05293 941.4897 29.18811 -12.64111      41.18275 
1 1 1 4   11 6  o 962.5203 14.88320 180.2693       5.563322      178.4276       6.436778      185.7077       11.06088  957.2393 17.31490 974.0391 29.24055 -16.79987      33.98257 
1 1 1 4   11 7  o 344.8233 18.17098 23.22927       2.424752      24.97037       2.647089      14.15154       6.044303  357.4337 19.13921 260.1639 60.89961 97.26984       63.83629 
1 1 1 4   11 8  o 188.3907 63.97643 6.774264       5.588066      0.000000       0.000000      6.774264       5.588066  ?        ?        188.3907 63.97643 0.000000       63.97643 
1 1 1 4   11 9  o 1205.791 18.71192 283.4127       8.762310      270.7330       10.80227      307.8050       14.98262  1177.162 23.62930 1252.490 30.80247 -75.32861      38.82185 
1 1 1 4   11 10 o 446.9344 20.59448 38.96696       3.574560      38.96696       3.574560      0.000000       0.000000  446.9344 20.59448 ?        ?        0.000000       20.59448 
1 1 1 4   11 11 o 375.9330 17.71313 27.53186       2.586031      27.07134       3.507980      28.08002       3.827239  371.4386 24.45559 378.0350 26.23139 -6.596436      35.86309 
1 1 1 4   11 12 o 855.9924 13.65877 142.5325       4.540561      139.9038       6.282680      145.4067       6.569568  847.3413 19.09231 863.7664 19.58450 -16.42511      27.35085 
1 1 1 4   11 13 o 893.7444 16.42948 155.4607       5.702497      156.0384       6.707102      153.9537       10.83237  895.0148 19.29642 886.6987 31.45714 8.316040       36.90397 
1 1 1 4   11 14 o 234.9295 31.78075 10.98874       2.825118      12.47679       3.787746      9.123037       4.241245  248.8787 40.58822 210.5706 52.13949 38.30811       66.07518 
1 1 1 4   11 15 o 788.1195 14.87690 120.7834       4.553364      118.8638       6.237389      122.9735       6.662467  781.3212 20.55631 794.6008 21.59027 -13.27966      29.81110 
1 1 1 4   11 16 o 636.5714 16.80526 78.81392       4.154514      77.93751       5.707331      79.80172       6.059184  632.5509 23.23323 639.9703 24.37959 -7.419434      33.67710 
1 1 1 4   11 17 o 687.3099 16.91175 91.86645       4.514077      88.50323       6.149610      95.79586       6.647116  674.1405 23.48925 701.2842 24.40682 -27.14374      33.87385 
1 1 1 4   11 18 o 880.8243 15.99509 150.8508       5.471470      148.9880       7.547873      152.9138       7.942884  874.8348 22.21624 886.1970 23.07916 -11.36218      32.03450 
1 1 1 4   11 19 o 1172.411 15.86148 267.2710       7.221901      265.9679       10.01773      268.6810       10.42081  1168.802 22.06991 1174.638 22.84386 -5.835693      31.76355 
1 1 1 4   11 20 o 367.0488 29.85459 26.47546       4.218744      23.08029       5.625633      30.83840       6.377210  340.0949 43.59719 394.1542 42.32440 -54.05930      60.76240 
1 1 1 4   11 21 o 382.8898 36.85730 28.99120       5.412858      31.71903       9.273485      27.58159       6.666286  394.4129 62.63689 371.1777 47.32263 23.23523       78.50358 
1 1 1 4   11 22 o 695.4865 24.85441 94.35420       6.713053      96.43973       11.43146      93.25642       8.293760  698.8819 42.31768 690.5657 30.92563 8.316223       52.41356 
1 1 1 4   11 23 o 647.3144 25.37711 81.78185       6.379482      80.28104       7.569941      85.45996       11.85066  640.6304 30.42685 656.1122 46.81623 -15.48175      55.83505 
1 1 1 4   11 24 o 807.0983 23.27606 127.1130       7.295648      120.1108       8.558105      145.7344       13.95620  783.6693 28.12010 859.5075 41.81089 -75.83820      50.38740 
1 1 1 4   11 25 f 1242.810 20.72262 301.3490       10.00178      304.5046       12.06344      294.4095       17.88902  1247.992 24.89035 1221.750 37.70305 26.24292       45.17797 
1 1 1 4   11 26 o 501.6183 32.66274 49.76563       6.328184      52.52045       7.527956      43.12957       11.68384  513.7460 38.00082 452.9831 68.56041 60.76291       78.38744 
1 1 1 4   11 27 o 292.8738 57.27485 18.06792       6.280968      25.44209       9.491665      12.32328       8.377553  341.6171 73.70779 240.7741 78.24444 100.8430       107.4943 
1 1 1 4   11 28 o 146.5165 61.92153 1.148897       6.060609      12.30421       9.173629      -7.491059      8.073393  239.4864 81.96780 130.3455 61.44334 109.1409       102.4402 
1 1 1 4   11 29 o 181.2788 63.74792 6.545041       5.565657      10.79980       7.613226      1.660875       8.156927  222.5395 74.67911 166.3541 71.12356 56.18539       103.1287 
1 1 1 4   11 30 o 570.3260 29.03347 64.87810       6.409320      73.58461       9.407660      57.33650       8.755709  600.0533 40.60955 527.7183 43.09922 72.33502       59.21721 
1 1 1 4   11 31 o 318.5009 47.28506 21.50865       5.671185      32.17023       8.903966      14.23118       7.356354  379.9233 62.52302 245.7953 72.26451 134.1280       95.55777 
1 1 1 4   12 0  o 870.2798 14.98786 147.3593       5.065549      149.7330       6.446428      143.5277       8.190170  876.7437 18.93296 857.4537 24.59542 19.29004       31.03855 
1 1 1 4   12 1  f 989.3548 14.86817 190.4407       5.712651      194.4074       7.302444      184.1844       9.170901  999.0117 18.82217 971.3658 24.31091 27.64587       30.74564 
1 1 1 4   12 2  o 316.8055 20.30026 19.64140       2.484456      18.82748       3.269764      20.75318       3.821506  309.1184 27.52527 324.1108 30.72795 -14.99240      41.25345 
1 1 1 4   12 3  o 369.0064 22.87637 26.67084       3.262142      26.67084       3.262142      0.000000       0.000000  369.0064 22.87637 ?        ?        0.000000       22.87637 
1 1 1 4   12 4  o 459.1505 14.39485 41.01949       2.566789      44.89390       3.629858      37.14454       3.630118  479.9410 19.47483 436.3881 21.42002 43.55292       28.94972 
1 1 1 4   12 5  o 430.6315 14.46159 36.08646       2.418521      31.19033       3.220144      42.42233       3.663128  399.3553 20.83510 466.4288 20.22268 -67.07343      29.03547 
1 1 1 4   12 6  o 746.6800 22.10821 108.8296       6.410856      109.1896       9.068599      108.4699       9.064043  745.9543 31.30401 743.4695 31.39286 2.484863       44.33342 
1 1 1 4   12 7  o 387.8796 19.69150 29.41429       2.956492      26.69987       3.279368      41.19844       6.832833  369.0297 22.99670 455.2015 39.02920 -86.17181      45.30040 
1 1 1 4   12 8  o 379.1844 21.15519 28.14462       3.102852      28.89520       3.530578      25.59773       6.503613  383.8190 23.80339 355.4657 48.36762 28.35330       53.90759 
1 1 1 4   12 9  o 445.8803 18.09936 38.74248       3.134077      37.61964       3.467216      43.75759       7.327621  439.1666 20.32936 468.8282 40.64815 -29.66159      45.44838 
1 1 1 4   12 10 o 453.7592 14.46908 40.06736       2.549732      38.56084       3.647565      41.50691       3.565563  444.6022 21.12533 461.3934 19.89889 -16.79117      29.02146 
1 1 1 4   12 11 o 604.3913 14.18670 71.06708       3.329873      71.87501       4.629189      70.20081       4.793405  607.2847 19.62839 600.0622 20.56931 7.222473       28.43185 
1 1 1 4   12 12 o 352.6515 23.36627 24.36606       3.181966      22.52161       3.572918      31.43765       6.995975  338.3899 27.42389 396.2071 46.34274 -57.81717      53.84904 
1 1 1 4   12 13 o 1176.751 14.09235 269.2857       6.440152      263.6158       8.872491      275.5995       9.362774  1163.483 19.63621 1189.522 20.26768 -26.03955      28.21984 
1 1 1 4   12 14 o 712.0794 15.10630 98.60788       4.177480      100.9644       5.722238      95.91869       6.112779  720.0839 20.46232 701.6639 22.43270 18.41992       30.36334 
1 1 1 4   12 15 o 539.9153 17.80636 56.71096       3.733609      58.57714       5.106503      54.56748       5.472743  548.3073 23.98124 528.3187 26.76088 19.98859       35.93389 
1 1 1 4   12 16 o 863.9044 15.29540 145.1026       5.131622      143.2943       7.013514      147.1860       7.528212  858.0232 21.04790 869.4706 22.29507 -11.44745      30.66079 
1 1 1 4   12 17 o 745.4195 16.44633 108.0450       4.760994      108.1077       6.545996      107.9746       6.937142  745.1734 22.61989 744.5922 23.99021 0.5811768      32.97256 
1 1 1 4   12 18 o 750.1550 17.24841 109.4425       5.024909      107.9063       6.817412      111.2698       7.435313  744.3610 23.58348 755.7017 25.33500 -11.34070      34.61275 
1 1 1 4   12 19 o 539.2321 21.05648 56.60941       4.409502      49.42130       5.834522      66.18359       6.733625  502.2696 30.04959 581.5186 29.91791 -79.24899      42.40353 
1 1 1 4   12 20 o 519.7949 22.78880 52.64542       4.600250      49.78456       6.226405      56.08418       6.826384  503.6373 32.00009 534.4891 33.04911 -30.85184      46.00272 
1 1 1 4   12 21 o 589.2350 29.96738 68.02867       6.834888      68.02867       6.834888      0.000000       0.000000  589.2350 29.96738 ?        ?        0.000000       29.96738 
1 1 1 4   12 22 f 207.9764 64.38289 8.675043       5.733111      4.855679       9.498430      10.86394       7.190670  202.3675 80.55959 231.8892 72.15666 -29.52167      108.1500 
1 1 1 4   12 23 o 431.6797 35.98063 36.82872       5.977010      35.10623       6.913941      41.92356       11.89086  419.8068 43.01543 450.6008 70.24060 -30.79398      82.36546 
1 1 1 4   12 24 o 372.9137 35.47082 27.58168       5.075097      21.25554       6.600698      36.72913       7.937258  321.9542 54.75227 427.2872 48.70263 -105.3330      73.27863 
1 1 1 4   12 25 o 158.8869 60.40601 3.806651       5.150865      8.731593       6.887260      -2.444414      7.759307  210.4825 71.02741 148.0748 66.13138 62.40770       97.04768 
1 1 1 4   12 26 o 470.6472 34.87232 44.01928       6.328536      44.41685       7.537897      43.06976       11.64912  470.5015 41.68510 451.3311 68.62322 19.17041       80.29193 
1 1 1 4   12 27 o 380.5807 44.71265 29.48407       6.482606      44.62153       9.859549      17.95699       8.603798  463.7992 55.86307 284.4425 76.30699 179.3567       94.56976 
1 1 1 4   12 28 o 424.3448 36.15548 36.19844       5.901459      40.35425       7.886305      30.90968       8.896571  443.4630 46.48284 379.3515 62.57007 64.11142       77.94657 
1 1 1 4   12 29 o 194.4310 63.92097 8.066913       5.585091      12.58568       7.772798      3.243505       8.030528  235.5916 75.24996 172.6981 72.01988 62.89351       104.1605 
1 1 1 4   12 30 o 271.1026 55.05003 16.05249       5.598012      10.56014       8.111364      21.04772       7.735568  217.3544 76.90282 303.8870 67.31969 -86.53255      102.2056 
1 1 1 4   13 0  o 126.4782 42.04094 3.010263       2.413515      2.873590       3.331770      3.161169       3.500963  133.4050 49.00968 138.1798 50.31803 -4.774857      70.24139 
1 1 1 4   13 1  o 281.7377 22.63078 15.59571       2.455231      17.71723       3.474959      13.48086       3.469488  299.1046 30.33535 259.4679 35.35152 39.63666       46.58286 
1 1 1 4   13 2  o 303.3013 20.35589 18.02249       2.383786      21.30716       3.400974      14.85045       3.342160  328.9041 26.86049 273.2151 32.11134 55.68903       41.86435 
1 1 1 4   13 3  o 279.9447 21.03572 15.37651       2.270235      18.88030       3.235963      11.98047       3.185817  309.4002 27.20774 244.4850 34.51358 64.91522       43.94825 
1 1 1 4   13 4  o 569.5891 17.10798 63.20318       3.784324      70.38685       7.843657      61.02364       4.320435  597.3069 33.95394 559.3617 19.88872 37.94519       39.35011 
1 1 1 4   13 5  o 555.7357 17.83554 60.18616       3.849306      57.18235       7.916807      61.11615       4.405063  536.9523 38.21468 559.7205 20.26530 -22.76819      43.25557 
1 1 1 4   13 6  o 503.9318 18.99401 49.51294       3.717203      49.13483       4.307055      50.61677       7.359072  501.6406 22.10852 505.1346 37.78725 -3.493988      43.77972 
1 1 1 4   13 7  o 298.1639 17.82529 17.38531       2.054592      16.55824       2.153269      25.79394       6.865736  290.7945 19.17469 356.0035 51.12709 -65.20905      54.60447 
1 1 1 4   13 8  o 648.3815 16.38089 81.86833       4.124736      79.39445       4.673487      90.58598       8.773075  638.2104 18.85598 678.9705 33.27155 -40.76007      38.24322 
1 1 1 4   13 9  o 563.1519 13.92014 61.70275       3.044369      60.04935       3.278066      72.07409       8.210050  555.4507 15.19652 604.4769 35.12487 -49.02625      38.27127 
1 1 1 4   13 10 o 457.3109 19.02125 40.74557       3.378147      41.60397       3.817811      37.64932       7.250841  461.9078 21.28292 434.4547 43.56177 27.45309       48.48288 
1 1 1 4   13 11 o 1020.589 13.31602 202.5558       5.277801      203.8375       7.479669      201.2848       7.448306  1023.054 18.82590 1016.622 18.86558 6.432495       26.65191 
1 1 1 4   13 12 o 654.9077 14.31347 83.41006       3.640432      85.84288       5.070719      80.82234       5.229656  663.9424 19.66578 644.1146 20.90653 19.82788       28.70237 
1 1 1 4   13 13 o 344.0556 22.24717 23.15654       2.956650      27.60322       3.936237      17.39961       4.478774  375.1409 27.20323 295.1526 40.11285 79.98825       48.46706 
1 1 1 4   13 14 o 828.5188 14.57740 133.4615       4.690407      133.6217       6.407142      133.2765       6.885092  828.5594 19.91190 827.3331 21.42897 1.226257       29.25209 
1 1 1 4   13 15 o 657.6257 16.21058 84.09647       4.140048      77.18759       5.533685      92.88011       6.239472  629.6058 22.63173 690.5928 23.26472 -60.98700      32.45678 
1 1 1 4   13 16 o 170.8368 47.65092 5.898776       3.280833      7.885455       4.243657      2.947079       5.172641  196.9145 53.91366 154.0958 60.02116 42.81874       80.67975 
1 1 1 4   13 17 o 602.1848 18.35340 70.53860       4.292145      71.19843       5.779507      69.72715       6.409240  604.5675 24.61603 598.0444 27.59594 6.523132       36.97952 
1 1 1 4   13 18 o 537.0208 20.71826 56.13716       4.320882      49.38833       5.586049      66.18994       6.817634  502.3250 28.75407 581.5343 30.29251 -79.20932      41.76641 
1 1 1 4   13 19 o 642.1971 19.67777 80.28260       4.907635      79.90477       6.528240      80.77361       7.442091  640.0595 26.26321 643.1198 29.79718 -3.060242      39.71937 
1 1 1 4   13 20 o 752.9119 18.55036 110.3431       5.424060      102.6180       7.211664      120.4052       8.230465  725.2790 25.60368 785.4250 26.98309 -60.14606      37.19725 
1 1 1 4   13 21 o 447.0799 27.54251 39.17931       4.758800      45.02274       6.380624      31.85451       7.143768  478.1576 34.59447 399.1138 46.98975 79.04382       58.35079 
1 1 1 4   13 22 o 686.1716 31.86495 92.18291       8.491297      95.76950       11.68008      88.16253       12.36629  695.6494 43.45176 665.9078 48.14306 29.74152       64.85221 
1 1 1 4   13 23 f 817.6027 23.69374 130.4849       7.523224      134.8457       12.75308      128.1574       9.317080  827.2520 39.69622 809.0804 29.65242 18.17151       49.54852 
1 1 1 4   13 24 o 322.1099 40.26660 20.81596       4.927013      27.96241       6.533816      11.39536       7.501728  372.3801 46.17097 234.9739 73.79671 137.4062       87.05006 
1 1 1 4   13 25 o 440.3004 32.38443 38.38175       5.498631      47.71879       7.445222      27.17757       8.155734  489.0225 39.54149 361.0854 60.28563 127.9371       72.09637 
1 1 1 4   13 26 o 430.3210 43.21547 37.39463       7.124458      39.27025       9.209638      34.59945       11.24282  435.7570 55.69563 398.9019 75.33522 36.85516       93.68777 
1 1 1 4   13 27 o 156.8863 62.87141 3.072060       5.824417      0.7807376E-01  6.970463      9.998602       10.60217  149.5729 64.86102 228.8877 86.74865 -79.31479      108.3157 
1 1 1 4   13 28 o 171.6713 62.69932 5.500965       5.441616      7.541630       7.399261      3.097161       8.030673  197.3415 72.94494 173.0403 72.07953 24.30122       102.5496 
1 1 1 4   13 29 o 227.3482 61.85899 11.53207       5.607099      9.132320       7.999813      13.84943       7.861273  208.2320 76.02654 244.3328 75.35075 -36.10078      107.0410 
1 1 1 4   13 30 o 136.2824 57.67775 1.303972       5.270272      -8.607076      7.411495      11.44178       7.495801  117.1557 56.23756 222.5862 74.09435 -105.4305      93.01955 
1 1 1 4   14 0  o 107.2183 41.58995 1.472126       2.475679      -1.664205      3.392446      5.045289       3.620998  95.62726 43.13326 160.1609 51.38235 -64.53369      67.08669 
1 1 1 4   14 1  o 227.9841 29.21527 10.35576       2.527171      10.94094       3.546646      9.752202       3.601915  231.8597 40.88209 217.9006 44.07852 13.95908       60.11872 
1 1 1 4   14 2  o 367.7930 19.22245 26.45189       2.736084      26.70932       3.834715      26.18493       3.905058  368.3414 26.99543 364.5370 27.79348 3.804321       38.74572 
1 1 1 4   14 3  o 625.9589 17.55889 76.35755       4.268457      77.28990       8.450752      76.03822       4.945712  625.5240 34.92699 624.2567 20.40035 1.267334       40.44835 
1 1 1 4   14 4  o 881.8983 14.87253 151.4059       5.093675      151.3505       8.025070      151.4432       6.591689  880.0657 23.48042 881.2474 19.26065 -1.181702      30.36943 
1 1 1 4   14 5  o 107.2139 39.97679 1.744681       2.231930      0.3535306      3.020768      3.417177       3.312172  104.4440 43.90519 139.1801 49.15281 -34.73616      65.90648 
1 1 1 4   14 6  o 285.4720 27.88313 16.10708       3.051773      16.11650       3.437699      16.07203       6.629237  284.8481 31.60909 276.5836 63.11111 8.264465       70.58433 
1 1 1 4   14 7  o 129.0464 34.79735 3.384620       1.783741      2.816520       1.860168      9.875029       6.287470  119.4908 36.62110 219.5084 67.33654 -100.0176      76.65060 
1 1 1 4   14 8  f 686.9440 13.16456 91.78614       3.512009      91.48822       3.808249      93.48061       9.082295  685.7238 14.30040 689.9737 33.89496 -4.249939      36.78817 
1 1 1 4   14 9  o 804.8068 13.26868 125.9694       4.147128      125.4344       4.545019      128.6301       10.13531  802.9653 14.57508 810.1482 32.21400 -7.182922      35.35781 
1 1 1 4   14 10 o 262.2051 30.30894 13.62427       3.029434      12.12416       3.360153      20.13924       7.002527  246.0240 36.25532 312.7103 59.84137 -66.68634      69.96741 
1 1 1 4   14 11 o 376.1523 17.85854 27.53777       2.608781      24.78262       3.767415      30.07589       3.615990  355.2280 27.52402 392.0330 23.86430 -36.80499      36.42906 
1 1 1 4   14 12 o 217.0564 30.09900 9.375319       2.468901      12.15163       3.568167      6.825276       3.419673  246.0842 38.60689 182.7771 47.67769 63.30710       61.34863 
1 1 1 4   14 13 o 289.5110 25.03975 16.45705       2.787574      20.15606       3.893454      12.56672       3.992874  319.6701 31.78350 249.6449 42.72043 70.02522       53.24684 
1 1 1 4   14 14 o 300.8657 26.55848 17.78060       3.071305      16.16709       4.078297      19.89462       4.668182  285.0080 37.77723 316.4799 38.79393 -31.47192      54.14877 
1 1 1 4   14 15 o 1078.571 14.73009 226.1445       6.169960      228.6441       8.602152      223.4960       8.854606  1083.951 20.43476 1071.580 21.27730 12.37036       29.50089 
1 1 1 4   14 16 o 896.6245 15.56188 156.3047       5.418770      146.9975       7.241159      168.1499       8.169070  869.0223 21.45602 929.3196 22.63495 -60.29724      31.18817 
1 1 1 4   14 17 o 297.7021 32.62282 17.51633       3.709883      19.06777       4.824144      15.27082       5.803768  309.2394 41.19430 273.1233 56.57786 36.11606       69.98589 
1 1 1 4   14 18 f 1022.053 16.15855 203.1726       6.413626      204.3777       8.728871      201.7587       9.455063  1024.363 21.94200 1017.485 23.92812 6.878357       32.46546 
1 1 1 4   14 19 o 901.0822 16.94007 157.9779       5.927991      157.3969       7.962356      158.7003       8.879291  898.6928 22.81405 902.0233 25.34735 -3.330505      34.10233 
1 1 1 4   14 20 o 185.3191 55.62978 6.900119       4.323986      10.62377       5.635241      1.568917       6.742803  226.9927 62.11887 159.8455 66.27025 67.14722       90.83226 
1 1 1 4   14 21 o 242.9386 55.58641 12.19048       5.130791      12.62099       5.810833      10.66739       10.92984  246.5786 61.01374 244.7815 88.94219 1.797089       107.8582 
1 1 1 4   14 22 o 660.1868 22.01634 84.99608       5.644687      85.80659       7.554969      83.97189       8.492635  662.2194 29.37669 653.5065 33.57637 8.712830       44.61348 
1 1 1 4   14 23 o 144.6814 60.86234 0.8551632      5.811322      12.71147       10.03949      -5.119254      7.126638  252.1101 85.75149 130.6383 60.27653 121.4718       104.8169 
1 1 1 4   14 24 o 1118.410 18.25320 243.9215       7.928078      259.7087       11.21643      228.1593       11.20757  1151.866 25.07407 1079.043 26.74512 72.82239       36.66075 
1 1 1 4   14 25 o 256.3270 58.28378 13.90560       5.670682      11.14869       8.280900      16.34001       7.781489  232.3085 77.88531 274.3402 72.09460 -42.03175      106.1308 
1 1 1 4   14 26 o 488.3372 30.51083 47.26780       5.757318      48.50122       7.696825      45.70105       8.674773  490.8448 40.74587 473.2162 47.86113 17.62857       62.85630 
1 1 1 4   14 27 o 197.7162 64.79967 8.193139       5.741343      10.05379       6.938468      4.152599       10.22471  216.6502 71.24689 194.2215 81.15343 22.42871       107.9907 
1 1 1 4   14 28 f 197.5109 61.21816 8.449668       5.181544      8.991724       6.990766      7.788825       7.718831  205.6546 71.49368 199.0686 74.32051 6.586044       103.1256 
1 1 1 4   14 29 o 163.6395 60.74725 5.017716       5.142486      10.02020       7.209980      -0.1623352     7.336826  211.9865 72.66688 148.0885 65.31867 63.89792       97.70877 
1 1 1 4   15 0  o 134.7729 43.95603 3.493221       2.643023      5.214397       3.617569      1.522572       3.870872  162.1547 51.28819 126.4130 51.04403 35.74168       72.36001 
1 1 1 4   15 1  o 406.7395 23.67568 32.44197       3.723609      28.61914       7.494996      33.69475       4.290575  374.4799 53.01790 413.9785 26.83210 -39.49860      59.42104 
1 1 1 4   15 2  o 450.9517 19.34075 39.65692       3.387126      44.69171       5.406904      36.40491       4.345445  476.5195 29.36025 430.5381 26.11271 45.98145       39.29247 
1 1 1 4   15 3  o 629.4539 16.15979 77.16074       3.950278      75.49459       6.103463      78.36179       5.182024  621.3062 25.29547 633.6883 21.05696 -12.38214      32.91286 
1 1 1 4   15 4  o 764.9743 15.50237 113.9254       4.605459      117.3984       7.279394      111.6074       5.946970  775.1064 24.18276 756.4601 20.24332 18.64636       31.53725 
1 1 1 4   15 5  o 341.7418 20.38706 22.85533       2.693387      25.41964       3.559028      19.41830       4.120379  359.6947 25.64624 312.4730 34.53150 47.22174       43.01342 
1 1 1 4   15 6  o 577.6632 15.08893 64.94074       3.385020      67.02123       4.513406      62.26594       5.117603  586.3692 19.82007 564.7659 23.33298 21.60327       30.61475 
1 1 1 4   15 7  o 522.9120 14.40164 53.19559       2.924614      52.13260       3.124423      60.71814       8.311675  517.5806 15.54404 554.0826 38.87265 -36.50195      41.86526 
1 1 1 4   15 8  o 363.2429 17.81566 25.68902       2.513200      26.25275       2.679945      21.57713       7.237864  366.6646 18.88454 323.8118 59.75739 42.85284       62.67034 
1 1 1 4   15 9  f 267.1183 23.80206 14.02411       2.443272      14.38999       2.617324      11.54445       6.813783  270.4108 25.21408 237.0462 69.50764 33.36461       73.93959 
1 1 1 4   15 10 o 117.1518 42.85140 2.182958       2.543112      2.955261       2.725126      -3.025974      7.077288  128.9009 44.64719 139.7041 62.72016 -10.80325      76.98824 
1 1 1 4   15 11 o 270.5506 32.66092 14.51352       3.362236      15.87153       3.787309      9.462023       7.304464  282.6378 35.27201 221.3009 73.11757 61.33687       81.18063 
1 1 1 4   15 12 o 1041.560 13.91458 210.8915       5.628366      211.9178       8.028966      209.8999       7.892220  1043.484 19.81280 1038.534 19.56819 4.950562       27.84710 
1 1 1 4   15 13 o 809.8149 14.32826 127.4828       4.506165      126.6560       6.338051      128.3279       6.407882  806.7401 20.22992 812.0391 20.31934 -5.298950      28.67272 
1 1 1 4   15 14 o 204.4413 38.50630 8.442176       2.945070      12.42517       4.018611      3.821094       4.328554  248.2556 43.25415 153.6002 55.94759 94.65535       70.71813 
1 1 1 4   15 15 o 319.6638 27.59272 20.06830       3.391866      22.97962       4.501843      16.24559       5.158594  341.2398 34.44180 283.6398 48.57861 57.59995       59.54930 
1 1 1 4   15 16 o 806.6580 16.34114 126.5417       5.119172      126.6241       6.873184      126.4390       7.671657  806.4313 21.94637 805.5690 24.52215 0.8623047      32.90864 
1 1 1 4   15 17 o 561.5112 19.94613 61.37713       4.349557      62.56301       5.726632      59.76025       6.686788  566.4098 26.03398 552.1811 31.31115 14.22870       40.72046 
1 1 1 4   15 18 o 537.6703 21.78695 56.31913       4.549258      57.83906       5.965463      54.20671       7.032712  543.5314 28.35957 525.0552 34.68515 18.47620       44.80317 
1 1 1 4   15 19 o 346.8103 42.11198 23.99385       5.555501      23.99385       5.555501      0.000000       0.000000  346.8103 42.11198 ?        ?        0.000000       42.11198 
1 1 1 4   15 20 f 279.2956 48.86281 15.85470       5.106900      17.40215       5.856678      10.94508       10.43197  291.7757 53.66360 244.3937 87.13277 47.38197       102.3323 
1 1 1 4   15 21 o 438.7987 38.23935 38.13470       6.451209      38.13470       6.451209      0.000000       0.000000  438.7987 38.23935 ?        ?        0.000000       38.23935 
1 1 1 4   15 22 o 294.5518 43.42767 17.51063       4.818662      11.84769       6.332862      25.29775       7.426220  238.1184 66.12728 351.4287 56.31466 -113.3103      86.85712 
1 1 1 4   15 23 o 529.4015 32.17734 55.29723       6.584136      57.84883       11.07939      53.90414       8.186510  533.9799 54.17743 520.1509 40.85545 13.82898       67.85545 
1 1 1 4   15 24 o 594.4986 37.93118 70.31985       8.711725      0.000000       0.000000      70.31985       8.711725  ?        ?        594.4986 37.93118 0.000000       37.93118 
1 1 1 4   15 25 o 268.8985 56.67120 15.30139       5.731435      4.901688       8.346970      24.57895       7.883792  188.9648 75.42606 340.3893 61.92021 -151.4245      97.58690 
1 1 1 4   15 26 o 194.2723 59.95007 7.951275       4.975303      6.384878       6.632519      9.966906       7.523728  186.7336 69.05455 218.0503 74.23360 -31.31676      101.3862 
1 1 1 4   15 27 o 115.6535 53.53446 -3.856354      5.688700      -4.217951      6.921104      -3.103364      9.987519  128.3428 59.28170 160.9484 73.15984 -32.60558      94.16306 
1 1 1 4   15 28 o 188.3344 64.91689 7.466302       5.757832      7.081166       7.215335      8.141571       9.554055  190.6473 71.72195 206.9471 81.29527 -16.29977      108.4111 
1 1 1 4   15 29 o 398.3112 35.44722 32.30300       5.425876      49.58257       7.777817      15.92160       7.572977  490.2989 41.23059 259.8304 72.36804 230.4685       83.28922 
1 1 1 4   16 0  o 431.7417 28.83120 36.67759       4.806292      0.000000       0.000000      36.67759       4.806292  ?        ?        431.7417 28.83120 0.000000       28.83120 
1 1 1 4   16 1  o 846.7302 16.28177 139.6061       5.353954      146.7455       8.730284      135.3026       6.778192  866.2468 25.95128 832.8126 20.95746 33.43427       33.35691 
1 1 1 4   16 2  f 162.5080 44.38443 5.400499       2.880236      9.733561       4.311942      1.909606       3.870292  216.7064 51.91746 130.0408 51.53197 86.66553       73.15030 
1 1 1 4   16 3  o 171.8924 40.21891 6.057847       2.637146      3.274956       3.471385      9.855698       4.055306  139.2585 50.19738 218.5767 48.98672 -79.31822      70.13898 
1 1 1 4   16 4  o 332.3658 22.00885 21.64119       2.824729      21.43998       3.795204      21.89109       4.229537  329.5695 29.98027 332.4400 33.20478 -2.870575      44.73672 
1 1 1 4   16 5  o 228.9512 35.56585 10.52828       3.059690      9.375204       3.396596      15.49102       7.046525  214.4295 42.29054 271.8274 67.14484 -57.39783      79.35313 
1 1 1 4   16 6  o 88.24068 38.33051 -0.3773068     2.442693      -0.3258654     3.010740      -0.4763892     4.178447  98.92190 42.76199 116.0221 50.26505 -17.10023      65.99366 
1 1 1 4   16 7  o 529.1959 14.84977 54.47176       3.051857      54.02457       3.276698      57.39889       8.383216  526.9461 16.01188 538.8525 40.35317 -11.90643      43.41380 
1 1 1 4   16 8  o 705.6176 17.23472 96.88604       4.722822      97.29922       5.375968      95.48885       9.885952  706.9019 19.58256 696.9693 36.65263 9.932556       41.55589 
1 1 1 4   16 9  o 562.5969 15.33850 61.55594       3.351262      64.45898       3.669365      46.95686       8.228621  575.6453 16.41376 486.7296 44.00826 88.91571       46.96955 
1 1 1 4   16 10 o 311.2886 23.94772 18.99286       2.872831      16.76585       3.101262      32.46122       7.626672  291.8596 27.69286 402.8889 49.80468 -111.0292      56.98597 
1 1 1 4   16 11 o 919.2709 14.45612 164.2866       5.160875      164.3889       5.730890      163.8476       11.87006  919.4299 16.05001 915.6853 33.37943 3.744568       37.03767 
1 1 1 4   16 12 f 354.2194 21.01538 24.50669       2.878004      18.26698       4.404129      29.15718       3.802130  303.1852 38.25613 385.9941 25.50784 -82.80899      45.98023 
1 1 1 4   16 13 o 864.1979 14.30960 145.1746       4.802516      142.5821       6.816096      147.7304       6.767727  855.9633 20.50466 871.3262 20.00019 -15.36292      28.64347 
1 1 1 4   16 14 o 768.7305 15.07712 114.8881       4.501120      111.9658       6.331962      117.8733       6.399667  758.4141 21.49829 778.1931 21.17591 -19.77905      30.17608 
1 1 1 4   16 15 o 217.5455 39.99885 9.560458       3.254765      17.31491       4.430392      0.4682737      4.797342  294.6954 39.72367 131.2630 55.26223 163.4324       68.05795 
1 1 1 4   16 16 o 834.4562 16.09973 135.4324       5.217351      129.6688       6.945024      142.8988       7.904671  815.9327 21.91752 856.3163 23.76958 -40.38361      32.33220 
1 1 1 4   16 17 o 730.1737 18.00822 103.7593       5.106520      100.5690       6.837605      107.7828       7.678789  718.1728 24.51586 743.2096 26.60440 -25.03680      36.17763 
1 1 1 4   16 18 o 467.6396 24.45006 42.76662       4.424946      45.17785       5.802903      39.41670       6.839797  479.6139 31.32693 446.2162 39.89088 33.39767       50.72139 
1 1 1 4   16 19 o 223.2917 54.82001 10.29180       4.718781      6.883240       5.356279      22.10869       9.973083  189.3107 62.61532 323.3663 79.88318 -134.0556      101.4988 
1 1 1 4   16 20 o 539.1748 24.83511 56.74475       5.200243      52.98741       6.606407      62.86494       8.431557  518.9768 32.94933 564.1324 38.72004 -45.15558      50.84191 
1 1 1 4   16 21 o 761.9955 20.37573 113.2016       6.029672      122.5939       8.196550      102.1243       8.901490  791.8455 26.65402 721.6819 31.76062 70.16357       41.46292 
1 1 1 4   16 22 o 272.8326 47.60614 15.23049       4.860667      18.87927       6.358468      10.10038       7.539483  301.9073 56.30259 224.3232 74.29263 77.58408       93.21682 
1 1 1 4   16 23 o 354.6105 59.54157 26.19897       7.909113      0.000000       0.000000      26.19897       7.909113  ?        ?        354.6105 59.54157 0.000000       59.54157 
1 1 1 4   16 24 o 203.4736 74.39157 7.651187       7.663218      0.000000       0.000000      7.651187       7.663218  ?        ?        203.4736 74.39157 0.000000       74.39157 
1 1 1 4   16 25 o 473.2590 30.20803 44.42851       5.523031      44.73922       7.483870      44.05690       8.184570  470.6369 41.36604 464.9459 45.92825 5.690979       61.81062 
1 1 1 4   16 26 o 375.9797 38.00896 28.62604       5.473595      32.08969       7.562935      24.81619       7.931903  392.2597 50.84256 338.2755 62.68645 53.98425       80.71281 
1 1 1 4   16 27 o 196.3156 65.42348 8.260374       5.843464      10.13462       7.091696      4.296690       10.31304  214.5834 72.07552 191.8038 80.90237 22.77965       108.3516 
1 1 1 4   16 28 o 364.4217 42.83299 27.58977       5.946285      33.48487       7.290766      15.87761       10.27652  398.6709 48.05908 254.7537 86.75734 143.9172       99.17918 
1 1 1 4   17 0  f 273.8608 33.20115 14.91804       3.458933      19.21171       5.312364      11.75814       4.557324  308.4736 45.72966 238.9849 50.67529 69.48875       68.25823 
1 1 1 4   17 1  o 198.6587 42.88503 8.079146       3.211645      9.466394       4.981308      7.092235       4.201510  214.0544 58.33123 186.7617 54.52904 27.29269       79.84953 
1 1 1 4   17 2  o 258.2245 29.64518 13.21314       2.919001      13.21032       3.994045      13.21638       4.276606  255.7757 41.64196 255.1305 44.79703 0.6452332      61.16230 
1 1 1 4   17 3  o 606.3123 16.16817 71.53727       3.807020      68.72967       5.117769      75.01574       5.696486  593.7269 22.19556 620.1128 23.65421 -26.38593      32.43708 
1 1 1 4   17 4  o 328.1436 27.45708 21.17767       3.466861      20.09264       3.878197      25.49411       7.735184  318.8702 31.73932 353.3149 58.41560 -34.44473      66.48133 
1 1 1 4   17 5  o 1238.316 14.60937 298.2326       7.025720      295.8396       9.706635      300.8659       10.18215  1232.425 20.28057 1242.694 21.09830 -10.26843      29.26499 
1 1 1 4   17 6  o 652.2544 15.37850 82.74825       3.895462      77.11450       5.063010      90.92173       6.098363  629.2305 20.71911 683.0042 22.99122 -53.77368      30.94959 
1 1 1 4   17 7  o 1197.802 16.96212 279.1250       7.890294      278.3117       9.300661      281.2133       14.90359  1195.605 20.03079 1199.347 31.99766 -3.741577      37.75026 
1 1 1 4   17 8  o 378.7145 24.29473 28.06640       3.554307      32.16387       3.996726      12.57163       7.772107  405.3727 25.51785 248.4903 74.57970 156.8824       78.82444 
1 1 1 4   17 9  o 223.4138 30.34204 9.920307       2.564480      9.169853       2.729623      15.56535       7.486427  214.0071 33.97886 274.0514 70.06954 -60.04434      77.87364 
1 1 1 4   17 10 o 210.4020 35.95729 8.895516       2.832551      8.378643       3.066288      11.90330       7.396801  203.3362 40.25475 242.5426 72.74819 -39.20631      83.14291 
1 1 1 4   17 11 o 407.7418 21.83536 32.45642       3.445038      30.80343       3.784542      40.44924       8.322011  396.8895 24.67581 451.1541 48.24593 -54.26465      54.19008 
1 1 1 4   17 12 o 211.4080 42.15657 9.064093       3.339701      10.16927       3.666028      3.672207       8.097491  223.9565 43.71957 185.9118 74.26289 38.04471       86.17643 
1 1 1 4   17 13 o 427.1485 20.33484 35.50919       3.373242      42.12606       5.177395      30.62855       4.446547  463.8283 28.88593 395.1727 29.18038 68.65561       41.05960 
1 1 1 4   17 14 o 1178.853 14.75330 270.1965       6.754246      269.4645       9.549492      270.9292       9.554402  1176.490 20.90086 1179.689 20.85489 -3.199707      29.52579 
1 1 1 4   17 15 o 361.1813 25.00013 25.55394       3.485107      27.99040       5.057981      23.35162       4.808824  376.5898 34.98424 343.3917 36.62471 33.19806       50.64846 
1 1 1 4   17 16 o 993.0011 15.66412 191.7987       6.040652      185.5265       8.264358      198.9936       8.851364  975.8419 21.80729 1010.522 22.55467 -34.67981      31.37310 
1 1 1 4   17 17 o 1095.589 22.08838 233.9191       9.398088      233.9191       9.398088      0.000000       0.000000  1095.589 22.08838 ?        ?        0.000000       22.08838 
1 1 1 4   17 18 o 649.1469 22.13283 82.13696       5.579661      82.94186       6.586792      80.09185       10.49922  651.8465 26.01960 636.3513 42.73259 15.49518       50.03093 
1 1 1 4   17 19 o 380.4444 36.40829 28.67029       5.313532      30.72954       6.169058      22.75192       10.45841  392.9829 41.02682 326.8939 82.40549 66.08908       92.05360 
1 1 1 4   17 20 o 280.8140 42.65287 15.91246       4.505227      18.41578       5.947021      12.54085       6.901758  299.8375 53.01150 245.0375 69.38423 54.80000       87.31776 
1 1 1 4   17 21 o 1032.347 18.19874 207.7197       7.296167      214.6678       9.888845      199.4181       10.80914  1047.937 24.29868 1009.060 27.58328 38.87610       36.75953 
1 1 1 4   17 22 o 385.5981 40.57225 29.81042       5.984491      36.86253       8.792378      23.72330       8.168692  424.2323 54.63709 335.2028 65.09705 89.02945       84.98728 
1 1 1 4   17 23 o 197.7803 64.83785 7.932001       5.747971      11.08999       8.375913      5.120939       7.902451  231.8003 78.32780 188.0336 73.91305 43.76677       107.6958 
1 1 1 4   17 24 o 321.9682 52.93878 21.63728       6.389220      28.69917       11.49948      18.48377       7.684492  355.5163 84.52785 290.6808 69.08907 64.83545       109.1708 
1 1 1 4   17 25 o 442.7950 31.38018 39.08137       5.361224      38.98776       7.440178      39.18246       7.732075  436.6774 44.49434 436.8961 46.27557 -0.2186890     64.19637 
1 1 1 4   17 26 o 144.7740 58.76456 2.470841       5.159372      7.388673       7.214633      -2.676586      7.381124  194.3158 71.98882 138.8495 63.02935 55.46625       95.68223 
1 1 1 4   17 27 o 333.2405 40.72281 22.93441       5.160508      20.09465       7.148023      26.02576       7.457961  299.4962 63.43036 345.7284 57.57116 -46.23221      85.66124 
1 1 1 4   18 0  o 455.3251 20.93886 40.39206       3.702564      44.48053       5.172968      36.09735       5.301842  476.3638 28.08657 428.2981 32.10886 48.06573       42.65952 
1 1 1 4   18 1  o 344.6563 25.13924 23.29649       3.341650      27.24429       4.620749      18.96808       4.838372  371.7517 32.32785 307.8976 41.52261 63.85413       52.62334 
1 1 1 4   18 2  o 468.6880 23.30489 42.82320       4.241884      40.96387       4.767781      49.88416       9.291166  457.3124 26.96505 500.3867 48.41729 -43.07428      55.41974 
1 1 1 4   18 3  o 191.5276 40.84043 7.475074       2.944989      7.081119       3.956156      7.964706       4.410473  186.5668 52.42768 197.5753 55.29818 -11.00858      76.20072 
1 1 1 4   18 4  o 1285.100 14.94039 321.1635       7.456359      315.2731       10.21161      327.8909       10.91308  1272.385 20.66557 1297.414 21.65912 -25.02808      29.93632 
1 1 1 4   18 5  o 1131.417 14.72501 248.9162       6.470030      240.6860       8.738315      258.9034       9.625965  1111.862 20.23713 1152.976 21.49790 -41.11438      29.52459 
1 1 1 4   18 6  f 832.4379 14.97897 134.7413       4.842414      129.3580       6.403249      141.9330       7.401015  815.1768 20.22649 853.6461 22.32469 -38.46936      30.12479 
1 1 1 4   18 7  o 1278.079 17.56032 317.7570       8.716015      325.4636       10.46006      300.2513       15.76498  1293.011 20.83070 1239.616 32.74752 53.39575       38.81132 
1 1 1 4   18 8  o 1241.996 14.50807 299.8793       6.997738      299.3994       7.777708      301.9183       16.03246  1240.830 16.14030 1243.134 33.20887 -2.304321      36.92341 
1 1 1 4   18 9  o 703.1841 15.04231 96.13155       4.107821      99.16525       4.515700      81.57761       9.890734  714.1187 16.28271 644.2348 39.72648 69.88385       42.93390 
1 1 1 4   18 10 o 341.4945 23.67397 22.82052       3.120281      24.60329       3.395057      13.12514       7.917396  354.5137 24.81611 253.9603 75.05616 100.5534       79.05230 
1 1 1 4   18 11 o 245.9265 34.77400 12.05061       3.228533      11.26393       3.520033      16.21887       8.102651  236.7053 39.69777 279.8543 73.57871 -43.14894      83.60467 
1 1 1 4   18 12 o 556.3875 18.94422 60.23439       4.093380      58.15255       4.483006      70.67336       10.03864  546.5517 21.12079 598.5326 43.48463 -51.98090      48.34254 
1 1 1 4   18 13 o 185.0493 55.53494 6.850883       4.309650      5.714230       5.008731      10.09163       8.457382  176.6895 60.56662 231.1561 78.70488 -54.46661      99.31150 
1 1 1 4   18 14 f 1333.333 15.38310 345.7530       7.965453      340.6477       11.12709      351.1192       11.40786  1322.419 21.66630 1342.549 21.87994 -20.12988      30.79221 
1 1 1 4   18 15 o 482.9234 20.82203 45.42593       3.905074      51.05379       5.769675      40.66845       5.304786  510.3769 29.23095 455.1796 30.18058 55.19724       42.01566 
1 1 1 4   18 16 o 701.1717 17.41104 95.68320       4.741078      89.86502       6.716179      101.4625       6.693672  678.6384 25.48331 721.3121 23.89534 -42.67371      34.93403 
1 1 1 4   18 17 o 197.2213 53.11535 7.982097       4.159063      11.83857       5.347120      2.075483       6.617499  239.1135 58.14399 161.5753 66.17920 77.53818       88.09319 
1 1 1 4   18 18 o 209.4490 55.30593 9.052376       4.565111      8.188257       5.555362      10.84930       8.011068  202.3827 63.49668 233.7005 76.54163 -31.31784      99.45074 
1 1 1 4   18 19 o 607.2951 21.69293 71.93824       5.116183      76.48032       6.776346      65.91651       7.802417  625.2510 27.90700 578.2385 34.90882 47.01251       44.69258 
1 1 1 4   18 20 o 243.5789 50.58084 12.26273       4.628205      21.80661       6.144245      -0.2549812     7.036693  327.1262 49.94796 151.3103 65.39133 175.8159       82.28502 
1 1 1 4   18 21 o 686.9008 24.71413 92.36053       6.592761      91.39298       9.926280      93.12424       8.818810  678.6588 37.81252 687.5696 33.02671 -8.910767      50.20508 
1 1 1 4   18 22 o 487.0238 31.79681 46.96913       5.980973      50.19957       9.009331      44.42354       7.997524  497.9385 47.15125 469.2757 44.41155 28.66278       64.77365 
1 1 1 4   18 23 o 589.7158 24.80317 68.28024       5.680387      74.22446       7.575257      60.64415       8.585889  611.8299 31.99264 549.3772 40.52884 62.45270       51.63444 
1 1 1 4   18 24 o 539.2716 33.07481 57.98999       6.893352      73.25270       12.74423      51.67774       8.195765  592.5240 56.04922 504.8101 42.19233 87.71390       70.15488 
1 1 1 4   18 25 o 211.8434 66.24378 9.815931       6.052104      2.222983       11.73197      12.56923       7.064682  192.7201 83.85935 236.4720 71.13436 -43.75191      109.9659 
1 1 1 4   18 26 o 223.3310 57.07212 10.99713       4.968441      18.52695       6.917922      2.975610       7.140224  287.6602 63.61386 163.5140 68.02647 124.1462       93.13605 
1 1 1 4   18 27 o 240.5968 55.37723 12.78121       5.066993      15.51119       7.202289      10.10585       7.129881  257.7165 70.10256 211.6527 72.26350 46.06372       100.6796 
1 1 1 4   19 0  o 747.8704 20.18731 108.8958       5.863174      114.0147       6.798124      94.03049       11.58480  764.9554 22.88363 690.3042 43.43505 74.65118       49.09445 
1 1 1 4   19 1  o 459.7344 21.07689 41.15787       3.763064      41.17372       5.092612      41.13881       5.584950  458.3732 28.75399 457.7442 31.61098 0.6290588      42.73226 
1 1 1 4   19 2  o 1277.027 15.43932 317.1383       7.656957      324.2070       10.76797      309.9082       10.89021  1290.275 21.48937 1261.373 22.23129 28.90210       30.91962 
1 1 1 4   19 3  o 305.0398 27.80342 18.30166       3.257513      12.99013       4.363548      24.98829       4.895913  253.2176 46.07010 355.5593 35.95023 -102.3418      58.43692 
1 1 1 4   19 4  o 348.7516 24.83888 23.82209       3.342174      27.41600       4.439463      19.12063       5.077658  373.4454 30.88812 309.1501 43.49559 64.29523       53.34737 
1 1 1 4   19 5  o 605.5618 17.51638 71.33040       4.119371      69.10996       5.415457      74.37938       6.345892  595.6528 23.41067 617.6775 26.45470 -22.02466      35.32578 
1 1 1 4   19 6  o 951.9581 22.22928 176.4509       8.218097      0.000000       0.000000      176.4509       8.218097  ?        ?        951.9581 22.22928 0.000000       22.22928 
1 1 1 4   19 7  o 817.9583 18.06886 130.1471       5.739709      132.7340       6.674870      122.8063       11.24407  825.8071 20.81307 792.3788 36.53951 33.42828       42.05140 
1 1 1 4   19 8  o 783.5624 14.92721 119.3634       4.542346      120.6652       4.971512      112.7847       11.17579  787.7354 16.25100 759.1639 37.90657 28.57153       41.24322 
1 1 1 4   19 9  o 424.3111 24.59932 35.19309       4.036155      31.39948       4.469660      51.95327       9.394795  400.1694 28.95654 511.8925 47.81216 -111.7231      55.89708 
1 1 1 4   19 10 f 99.59724 42.15757 0.1239912      2.816198      0.2272825E-02  3.009999      0.9789417      7.977352  101.8305 43.36234 169.3399 71.27570 -67.50940      83.42972 
1 1 1 4   19 11 o 843.4667 15.60215 138.3510       5.110699      137.4225       5.632378      142.6783       12.15923  840.4916 17.25562 853.6788 36.67613 -13.18719      40.53264 
1 1 1 4   19 12 o 535.2125 20.06933 55.76983       4.171451      56.10212       4.605868      54.25340       9.839308  536.6539 22.09984 522.2690 49.08720 14.38483       53.83266 
1 1 1 4   19 13 o 626.5341 19.38270 76.42382       4.716144      75.72668       5.210323      79.58477       11.09461  623.4797 21.51862 634.0980 45.35280 -10.61829      50.19888 
1 1 1 4   19 14 o 424.9912 31.12862 35.50732       5.101944      38.84310       5.975086      26.52972       9.802252  443.9259 34.94059 356.6930 73.21567 87.23291       81.12570 
1 1 1 4   19 15 o 240.8739 39.54475 11.68847       3.570781      11.65779       5.484958      11.71104       4.704175  237.2812 59.60170 238.6468 52.20938 -1.365555      79.23499 
1 1 1 4   19 16 o 595.4804 21.16473 69.10232       4.894499      71.79518       6.517133      65.61844       7.412771  606.2004 27.68295 577.8425 33.17163 28.35791       43.20536 
1 1 1 4   19 17 o 423.1390 28.81481 35.17686       4.706881      31.25110       6.197345      40.52835       7.235701  396.2948 40.85371 451.6084 41.72815 -55.31360      58.39747 
1 1 1 4   19 18 o 247.3710 45.72236 12.48888       4.230641      15.47661       5.941348      9.415821       6.025602  273.0572 57.82771 214.9149 65.91803 58.14230       87.68826 
1 1 1 4   19 19 o 439.6761 27.72647 38.01271       4.710048      32.55523       6.433243      44.31786       6.914827  403.4659 41.65730 472.4064 38.01274 -68.94052      56.39413 
1 1 1 4   19 20 o 831.2783 32.73727 136.0931       10.56859      136.0931       10.56859      0.000000       0.000000  831.2783 32.73727 ?        ?        0.000000       32.73727 
1 1 1 4   19 21 o 215.7644 62.41129 9.827927       5.526992      2.790821       8.238869      15.58628       7.452805  176.9920 73.30630 268.2790 70.58146 -91.28693      101.7623 
1 1 1 4   19 22 f 251.6541 51.13687 13.28335       4.827237      14.42530       6.328454      11.69441       7.464940  258.5770 63.48677 233.4606 73.65759 25.11641       97.24203 
1 1 1 4   19 23 o 473.1793 27.80641 44.32557       5.087282      55.64133       7.218426      33.15859       7.170815  527.2975 35.45605 401.7647 46.83799 125.5328       58.74460 
1 1 1 4   19 24 o 186.8174 63.31421 7.209078       5.472871      20.09420       10.96795      2.937173       6.315271  289.6110 88.95129 158.5347 64.75934 131.0762       110.0277 
1 1 1 4   19 25 o 113.8470 52.49615 -3.270803      5.393037      -3.097013      9.907647      -3.343978      6.428925  158.5280 72.37096 125.5764 57.68782 32.95164       92.54967 
1 1 1 4   19 26 o 231.1525 55.04836 11.78149       4.870840      12.85850       6.859500      10.68614       6.917685  235.5363 69.92277 216.6323 71.13524 18.90405       99.74676 
1 1 1 4   20 0  o 410.1545 24.15315 32.89072       3.830258      35.03738       5.269498      30.48604       5.577194  422.2625 32.38022 392.9576 36.98120 29.30484       49.15372 
1 1 1 4   20 1  o 1401.991 15.87422 382.2298       8.643026      375.6762       11.89073      389.5710       12.58496  1388.978 22.04374 1414.271 22.91351 -25.29309      31.79552 
1 1 1 4   20 2  o 588.9832 18.55789 67.49335       4.244822      63.77644       5.588580      72.56182       6.526023  572.0635 25.15528 609.9744 27.54920 -37.91089      37.30612 
1 1 1 4   20 3  o 1425.242 15.88136 394.9987       8.790312      382.1136       11.92651      410.3225       13.00632  1400.898 21.92193 1451.475 23.07369 -50.57629      31.82713 
1 1 1 4   20 4  o 743.4112 16.63091 107.4804       4.801458      111.0205       6.573640      103.4319       7.029872  755.0772 22.41747 728.5808 24.84515 26.49640       33.46378 
1 1 1 4   20 5  o 1547.834 16.19587 465.8892       9.735460      458.5597       13.34133      474.2375       14.23846  1534.588 22.38615 1560.379 23.49658 -25.79138      32.45349 
1 1 1 4   20 6  o 301.7473 29.81907 17.93909       3.448623      22.02162       4.374937      11.23933       5.604493  333.9546 34.21618 233.8726 61.05156 100.0820       69.98600 
1 1 1 4   20 7  o 1152.232 15.52005 258.1520       6.944818      271.9256       9.735434      243.8806       9.909797  1181.865 21.21092 1119.037 22.80301 62.82751       31.14290 
1 1 1 4   20 8  o 358.0271 23.29449 25.07508       3.221269      25.25847       3.449014      23.82243       9.014160  359.1560 24.88101 339.3598 70.69203 19.79617       74.94283 
1 1 1 4   20 9  o 1123.500 14.88889 245.4411       6.496259      243.8055       7.156251      253.1012       15.48722  1119.578 16.45899 1137.314 35.06428 -17.73657      38.73502 
1 1 1 4   20 10 o 577.3430 17.71944 64.85883       3.972938      64.43153       4.309841      67.27576       10.25021  575.3273 19.28938 582.8879 45.64606 -7.560608      49.55445 
1 1 1 4   20 11 o 1115.103 15.26875 241.8442       6.612209      240.3476       7.332688      248.3569       15.29648  1111.432 16.98839 1126.132 34.97634 -14.69922      38.88380 
1 1 1 4   20 12 o 637.6906 18.67652 79.16376       4.625237      76.08603       5.085833      93.88392       11.12251  624.9655 20.95453 689.7410 41.71931 -64.77545      46.68612 
1 1 1 4   20 13 o 321.9481 34.68285 20.53877       4.267948      21.54600       4.786066      16.62766       9.431113  329.1638 38.14735 282.0399 81.51083 47.12393       89.99575 
1 1 1 4   20 14 o 224.0290 49.00821 10.30196       4.145234      9.274755       4.636758      14.39095       9.251125  212.1393 55.60508 264.5922 81.76425 -52.45285      98.88033 
1 1 1 4   20 15 o 431.8025 37.09710 36.87832       6.160493      36.87832       6.160493      0.000000       0.000000  431.8025 37.09710 ?        ?        0.000000       37.09710 
1 1 1 4   20 16 o 487.8273 25.40231 46.60212       4.795824      41.97557       6.363076      52.68660       7.297098  460.9386 35.82795 516.5320 36.61409 -55.59335      51.22728 
1 1 1 4   20 17 o 812.3201 17.58677 128.5338       5.548060      128.5990       8.053943      128.4750       7.653638  811.1097 25.56825 810.9777 24.30138 0.1320190      35.27453 
1 1 1 4   20 18 o 213.9091 52.39549 9.523569       4.318145      6.342301       6.303374      12.33675       5.927503  188.2395 67.66478 242.0537 62.59203 -53.81425      92.17529 
1 1 1 4   20 19 o 332.9987 40.41209 22.30703       5.119074      17.10903       8.183289      25.64875       6.561381  281.4462 73.91830 354.7298 48.93132 -73.28366      88.64642 
1 1 1 4   20 20 o 398.5102 35.52642 31.67878       5.440520      20.52844       8.443538      39.59458       7.114226  307.4111 71.99169 443.7481 41.77393 -136.3370      83.23380 
1 1 1 4   20 21 o 113.0571 50.41144 -1.426259      4.489533      -12.70619      6.085642      12.04346       6.650167  93.73009 46.25962 236.0082 68.51542 -142.2781      82.66992 
1 1 1 4   20 22 o 196.0840 58.31441 8.162531       4.767821      2.261708       6.535625      14.87539       6.970832  157.4543 65.25869 259.6664 68.23486 -102.2121      94.41766 
1 1 1 4   20 23 o 579.4266 34.27116 67.28200       7.677497      67.28200       7.677497      0.000000       0.000000  579.4266 34.27116 ?        ?        0.000000       34.27116 
1 1 1 4   20 24 o 153.4131 60.19598 3.604664       5.232655      -2.629374      10.07404      5.908029       6.123507  161.6336 73.47314 177.1734 66.18634 -15.53978      98.88850 
1 1 1 4   20 25 o 156.4447 59.30386 4.336332       4.955492      10.94192       10.43052      2.410704       5.631662  223.8914 85.75868 147.1505 60.74924 76.74092       105.0953 
1 1 1 4   21 0  o 589.7726 23.98210 67.77390       5.492877      68.66987       6.326045      65.02866       11.07329  593.3417 27.45361 572.2601 50.33805 21.08160       57.33777 
1 1 1 4   21 1  f 424.6988 23.85145 35.25201       3.917979      37.55867       5.317216      32.51189       5.795324  437.3950 31.51390 405.8607 37.18150 31.53427       48.74002 
1 1 1 4   21 2  o 208.9458 44.24082 8.893690       3.478115      10.31380       4.632270      7.058397       5.266050  224.1471 53.88077 191.1941 62.03025 32.95297       82.16380 
1 1 1 4   21 3  o 749.4438 17.17884 109.2545       4.999895      109.2323       6.793491      109.2806       7.385372  748.8098 23.36111 748.7546 25.39831 0.5523682E-01  34.50820 
1 1 1 4   21 4  o 456.1179 22.49890 40.52062       3.985348      42.89945       5.320626      37.48000       6.015368  467.8996 29.43070 436.2193 35.82467 31.68030       46.36348 
1 1 1 4   21 5  o 1016.199 15.82339 200.8285       6.244621      205.7845       8.562745      195.1983       9.126661  1027.998 21.44830 1000.926 23.47913 27.07166       31.80093 
1 1 1 4   21 6  o 1064.751 15.70789 220.4847       6.495221      218.8361       8.713374      222.5464       9.744061  1060.083 21.16500 1068.681 23.47816 -8.597412      31.60983 
1 1 1 4   21 7  o 514.6161 20.67854 51.56959       4.132674      51.65125       5.184129      51.42722       6.845073  513.9448 26.05878 511.4519 34.66712 2.492889       43.36899 
1 1 1 4   21 8  o 403.7288 22.22447 31.85351       3.471149      30.12192       3.732575      42.93209       9.441236  392.2767 24.62617 462.7623 53.52191 -70.48560      58.91556 
1 1 1 4   21 9  o 361.0532 24.71947 25.54121       3.445219      26.77962       3.702011      17.53219       9.414457  369.5787 25.95769 289.3433 80.72405 80.23535       84.79489 
1 1 1 4   21 10 o 131.2909 48.16969 2.744323       3.217034      3.891283       3.467502      -4.345512      8.621062  146.5526 50.38535 150.9533 68.36211 -4.400696      84.92386 
1 1 1 4   21 11 o 710.1525 43.54042 99.70235       11.95008      0.000000       0.000000      99.70235       11.95008  ?        ?        710.1525 43.54042 0.000000       43.54042 
1 1 1 4   21 12 o 449.1034 24.16315 39.45604       4.198825      40.54332       4.651001      34.66584       9.762316  454.9391 26.43884 411.8727 63.03831 43.06631       68.35818 
1 1 1 4   21 13 o 563.5522 21.47628 61.90126       4.700253      63.97282       5.254392      53.60474       10.51529  572.6786 23.62564 516.9581 53.13278 55.72058       58.14862 
1 1 1 4   21 14 o 544.9713 25.66127 58.00016       5.430999      58.00016       5.430999      0.000000       0.000000  544.9713 25.66127 ?        ?        0.000000       25.66127 
1 1 1 4   21 15 o 550.4323 28.10714 59.42568       5.988228      67.27962       7.011991      38.26476       11.50972  585.1603 30.96613 428.5761 71.68444 156.5841       78.08688 
1 1 1 4   21 16 o 369.7911 39.54661 27.29158       5.591238      20.41852       6.616740      44.45428       10.45591  314.6595 56.20969 466.4998 59.03546 -151.8403      81.51512 
1 1 1 4   21 17 f 727.0114 18.69198 103.0733       5.277455      110.8599       7.877870      96.73372       7.108226  752.2311 26.96681 702.8832 26.04055 49.34796       37.48758 
1 1 1 4   21 18 o 453.7462 51.80541 41.95301       8.965207      41.95301       8.965207      0.000000       0.000000  453.7462 51.80541 ?        ?        0.000000       51.80541 
1 1 1 4   21 19 o 381.9925 35.54763 29.14050       5.212908      27.88302       8.893733      29.79860       6.433980  362.0810 65.66674 383.5706 43.98755 -21.48956      79.03812 
1 1 1 4   21 20 o 352.6402 34.42365 24.88848       4.654176      30.30758       6.390248      18.76637       6.792117  386.3186 43.34103 296.2886 61.05928 90.03003       74.87777 
1 1 1 4   21 21 o 362.5887 33.90981 26.35914       4.719493      33.41473       6.639907      19.15514       6.709377  405.0395 42.86335 298.5351 59.95288 106.5044       73.69949 
1 1 1 4   21 22 o 422.6760 30.05214 35.62781       4.900855      40.96576       6.895110      30.17771       6.967162  449.0074 39.95975 381.0097 48.16171 67.99774       62.58060 
1 1 1 4   21 23 o 228.1615 52.74242 11.28270       4.579843      14.61884       6.522094      8.037507       6.432585  254.6094 65.56490 195.6037 68.54724 59.00563       94.85505 
1 1 1 4   21 24 o 379.5443 32.96336 29.12809       4.810469      40.43163       7.054571      19.30434       6.576611  442.7536 41.51269 295.2563 59.41282 147.4973       72.47887 
1 1 1 4   22 0  o 797.8124 20.94698 123.9687       6.490083      125.9013       7.529044      118.3798       12.80354  803.6115 24.12491 774.8044 42.71605 28.80701       49.05785 
1 1 1 4   22 1  o 402.8590 31.44001 31.91691       4.879902      30.32071       5.503821      37.78405       10.55200  391.6951 36.60601 430.4731 65.15675 -38.77805      74.73554 
1 1 1 4   22 2  o 301.1447 33.45865 17.95885       3.846865      17.02001       5.143207      19.15097       5.795618  290.2692 47.25066 307.6025 50.25111 -17.33325      68.97680 
1 1 1 4   22 3  o 920.5745 16.58919 164.8721       5.930783      168.5888       8.120651      160.6236       8.682276  930.1492 22.48072 907.5910 24.63289 22.55817       33.34910 
1 1 1 4   22 4  o 490.3454 22.60206 46.85611       4.304058      46.46170       5.660142      47.39684       6.627363  486.6895 30.09425 490.7225 35.00538 -4.033020      46.16320 
1 1 1 4   22 5  o 872.6566 16.81671 148.1725       5.699179      152.8591       7.658249      142.3553       8.532088  885.6731 22.26527 854.1945 25.71998 31.47864       34.01852 
1 1 1 4   22 6  o 822.2374 17.07138 131.5594       5.451221      125.1668       7.002910      141.3893       8.683868  801.3806 22.50151 851.1582 26.27090 -49.77765      34.59015 
1 1 1 4   22 7  o 884.2643 16.81782 152.1545       5.775371      146.8732       7.443683      160.1424       9.154381  868.1158 22.07914 905.8394 26.02255 -37.72357      34.12714 
1 1 1 4   22 8  o 934.4158 15.73318 169.8649       5.709322      166.9292       6.238667      184.9948       14.16315  926.1168 17.34595 970.8209 37.56581 -44.70410      41.37719 
1 1 1 4   22 9  o 287.9455 31.62213 16.41600       3.477914      17.40678       3.740446      10.09202       9.449994  296.3500 33.06419 234.4160 82.99913 61.93407       89.34258 
1 1 1 4   22 10 o 170.8813 48.70653 5.922434       3.389483      5.025244       3.615307      12.43852       9.743078  160.6802 51.32019 251.5635 84.48142 -90.88332      98.84772 
1 1 1 4   22 11 o 573.0934 21.97027 64.02866       4.889774      59.43103       5.436744      83.49094       11.18585  551.7696 25.37191 648.9467 44.65638 -97.17706      51.36075 
1 1 1 4   22 12 o 722.5258 18.16259 101.6595       5.096350      97.51541       5.536970      124.6321       13.03662  707.4122 20.15448 793.8854 42.43800 -86.47321      46.98071 
1 1 1 4   22 13 o 458.6815 28.35822 41.31250       5.026697      41.31250       5.026697      0.000000       0.000000  458.6815 28.35822 ?        ?        0.000000       28.35822 
1 1 1 4   22 14 o 85.48168 41.33764 -6.636229      4.184355      -6.199332      4.599831      -8.732217      10.07504  93.41229 44.69781 149.5230 69.89611 -56.11073      82.96602 
1 1 1 4   22 15 o 416.5913 29.33245 34.19898       4.715255      33.89428       5.297699      35.36062       10.34389  413.8646 33.24152 411.6626 67.00639 2.201996       74.79877 
1 1 1 4   22 16 o 540.9772 24.22941 57.26527       5.090376      56.00917       5.662655      62.55439       11.61985  533.7603 27.41027 554.4382 54.67783 -20.67792      61.16362 
1 1 1 4   22 17 o 433.7705 42.07467 37.81499       6.998621      39.87177       9.411274      35.27044       10.46792  439.8279 56.39734 407.8083 68.52663 32.01950       88.74998 
1 1 1 4   22 18 o 177.9960 58.24766 6.351862       4.639660      6.913596       8.220289      6.089257       5.620488  201.0982 76.34469 180.2877 63.99074 20.81050       99.61589 
1 1 1 4   22 19 o 487.7308 25.39702 46.87732       4.793876      48.07570       6.954218      45.79221       6.617441  490.0542 36.80957 478.5773 35.86575 11.47690       51.39354 
1 1 1 4   22 20 o 235.7911 66.34652 12.20391       6.331327      12.20391       6.331327      0.000000       0.000000  235.7911 66.34652 ?        ?        0.000000       66.34652 
1 1 1 4   22 21 o 602.3796 22.44332 71.35118       5.250314      80.58941       7.421718      62.09626       7.428418  637.0658 29.99799 556.2392 34.55893 80.82660       45.76242 
1 1 1 4   22 22 o 345.8217 34.94906 24.25130       4.629290      21.82043       6.429102      26.86870       6.671216  318.9036 53.82771 357.0297 49.44106 -38.12610      73.08790 
1 1 1 4   22 23 o 310.1059 39.09976 19.83785       4.604148      17.01505       6.354755      22.95689       6.679903  275.8707 60.94065 325.4259 54.80281 -49.55518      81.95798 
1 1 1 4   23 0  o 263.3754 41.32349 13.96691       4.087587      16.18960       5.576200      11.38534       6.009532  281.2909 52.98912 234.5173 64.13651 46.77351       83.19458 
1 1 1 4   23 1  o 502.1923 27.95999 49.42313       5.431376      52.05138       6.178410      40.48347       11.39474  514.8754 31.04434 443.9385 68.28030 70.93692       75.00633 
1 1 1 4   23 2  o 203.0302 57.55589 8.432199       4.746338      7.533530       5.286386      12.16871       10.77934  195.2617 62.02511 253.5609 88.74156 -58.29918      108.2690 
1 1 1 4   23 3  o 593.9265 20.65348 68.72641       4.763803      57.82225       6.156614      84.99570       7.520212  543.0801 29.29948 659.3647 29.36814 -116.2846      41.48430 
1 1 1 4   23 4  o 617.7180 20.12964 74.33144       4.828967      70.60250       6.295963      79.65948       7.525809  601.2595 26.96325 638.1705 30.36606 -36.91101      40.60929 
1 1 1 4   23 5  o 282.1190 48.55917 16.16622       5.128334      16.16622       5.128334      0.000000       0.000000  282.1190 48.55917 ?        ?        0.000000       48.55917 
1 1 1 4   23 6  o 639.6506 19.74265 79.69711       4.904293      78.06066       6.224185      82.37679       7.964745  632.4100 25.34287 648.7322 31.61392 -16.32227      40.51791 
1 1 1 4   23 7  o 623.3661 20.19794 75.70441       4.889655      75.29841       6.123738      76.41859       8.121984  621.0977 25.38801 623.5883 33.66263 -2.490540      42.16306 
1 1 1 4   23 8  o 926.5225 19.25630 167.2018       6.928780      163.8646       7.943938      177.8130       14.16546  916.7492 22.31297 951.1642 38.34838 -34.41504      44.36741 
1 1 1 4   23 9  o 295.8708 32.56324 17.35324       3.679668      19.66935       3.956576      2.522569       10.01200  315.1692 32.80650 193.4902 80.52992 121.6789       86.95594 
1 1 1 4   23 10 o 898.9421 16.33192 157.2874       5.701604      158.5606       6.275109      151.2617       13.65153  902.3564 17.90668 876.3344 40.11284 26.02209       43.92823 
1 1 1 4   23 11 o 471.9996 25.03382 43.63649       4.572370      43.63649       4.572370      0.000000       0.000000  471.9996 25.03382 ?        ?        0.000000       25.03382 
1 1 1 4   23 12 o 716.7113 20.50209 100.1763       5.706508      100.1763       5.706508      0.000000       0.000000  716.7113 20.50209 ?        ?        0.000000       20.50209 
1 1 1 4   23 13 o 236.5476 47.59071 11.51893       4.220455      15.83650       4.697908      -6.542079      9.608510  279.1357 44.85639 151.4867 69.92882 127.6489       83.07909 
1 1 1 4   23 14 o 726.3365 23.98330 103.1898       6.765109      112.6072       8.313166      84.72494       11.64051  757.6923 28.25177 650.1979 46.40447 107.4943       54.32805 
1 1 1 4   23 15 o 567.5739 24.03750 63.06351       5.298338      60.32789       5.910894      74.24792       11.95176  554.4437 27.45161 605.2573 51.33060 -50.81366      58.21014 
1 1 1 4   23 16 o 427.0228 34.06218 36.27284       5.601743      35.48660       6.581076      38.34074       10.67287  420.1654 40.84829 425.5742 66.77468 -5.408752      78.27797 
1 1 1 4   23 17 o 432.6383 32.94611 37.24364       5.493895      33.21776       6.495208      47.36561       10.29900  405.4229 41.85537 477.7934 56.60492 -72.37045      70.39879 
1 1 1 4   23 18 o 249.3173 45.79841 12.92113       4.270948      11.27731       6.401186      14.24007       5.733834  228.0174 67.51354 257.5409 58.64226 -29.52353      89.42591 
1 1 1 4   23 19 o 105.1691 47.57050 -1.880328      4.160025      1.129064       6.161797      -4.400902      5.639204  146.5879 62.22052 113.1414 52.68841 33.44647       81.53197 
1 1 1 4   23 20 f 338.0523 34.68817 23.09809       4.489473      21.74954       6.481932      24.34147       6.224063  319.2588 54.21907 341.1211 48.33496 -21.86234      72.63592 
1 1 1 4   23 21 f 445.1624 27.50152 39.47155       4.731196      47.63992       6.733251      31.50541       6.649381  485.0125 36.00426 389.4290 44.78198 95.58353       57.46071 
1 1 1 4   23 22 o 240.4430 49.07283 12.44940       4.427174      16.52341       6.221795      8.271143       6.300893  271.8639 60.48987 195.5797 67.88106 76.28424       90.92229 
1 1 1 4   24 0  o 437.2567 27.82823 37.52202       4.700948      36.81511       6.429760      38.33385       6.890409  430.9441 38.83622 439.3453 40.85212 -8.401184      56.36619 
1 1 1 4   24 1  o 577.1119 24.67694 65.01018       5.530690      66.18748       8.194380      64.02515       7.495425  579.3966 36.60587 570.4129 33.99023 8.983704       49.95323 
1 1 1 4   24 2  o 688.6053 23.45463 92.50707       6.272303      91.89886       7.140501      94.56187       13.12461  685.8465 26.80858 689.0491 49.37379 -3.202637      56.18248 
1 1 1 4   24 3  o 695.3614 22.95564 94.31258       6.199090      95.93691       7.077641      88.96109       12.84657  700.8795 26.00263 668.0615 49.87532 32.81793       56.24664 
1 1 1 4   24 4  o 896.0056 17.94832 156.3214       6.245433      160.1119       8.396862      151.6281       9.343541  905.8444 23.86907 880.8562 27.31357 24.98822       36.27345 
1 1 1 4   24 5  o 430.1508 27.27578 36.30281       4.532867      42.21158       5.768518      26.76494       7.328946  463.0644 32.27897 363.1771 53.57180 99.88736       62.54495 
1 1 1 4   24 6  o 120.1976 50.59753 0.4372454      4.020849      0.9710723      4.961122      -0.5846594     6.864120  136.1088 56.67103 148.5434 64.38945 -12.43452      85.77650 
1 1 1 4   24 7  o 805.5544 18.48432 126.3971       5.782642      132.4208       7.547172      117.8335       8.998787  823.7225 23.59257 775.8510 29.86604 47.87152       38.06034 
1 1 1 4   24 8  o 426.8901 30.25726 35.86680       4.983687      33.65265       5.549947      45.08646       11.32512  412.4934 34.97469 469.1175 63.81963 -56.62411      72.77482 
1 1 1 4   24 9  o 268.9727 36.91807 14.49378       3.754618      14.11356       4.003135      17.27398       10.82481  264.6089 40.22194 285.7579 88.46886 -21.14899      97.18304 
1 1 1 4   24 10 o 661.3852 20.24947 85.31454       5.201110      85.31454       5.201110      0.000000       0.000000  661.3852 20.24947 ?        ?        0.000000       20.24947 
1 1 1 4   24 11 o 252.9491 42.92436 13.02032       4.065890      13.02032       4.065890      0.000000       0.000000  252.9491 42.92436 ?        ?        0.000000       42.92436 
1 1 1 4   24 12 o 1108.465 20.07728 239.8176       8.642808      260.3109       10.57811      198.6649       14.98999  1153.720 23.60911 1002.001 38.52170 151.7197       45.18087 
1 1 1 4   24 13 o 249.7597 45.58406 12.82203       4.258515      14.21909       4.690555      6.269179       10.15855  262.7177 47.73156 210.1907 83.42597 52.52701       96.11553 
1 1 1 4   24 14 o 240.1317 47.98886 11.96965       4.318746      14.15606       4.815039      2.973484       9.767041  261.2711 49.26147 189.5305 79.26540 71.74052       93.32574 
1 1 1 4   24 15 o 118.4673 52.68553 -1.400907      4.869972      -5.655313      5.663548      10.66973       9.539687  109.4152 51.54215 231.4368 83.23689 -122.0216      97.90288 
1 1 1 4   24 16 o 595.2944 25.56914 69.66472       5.911203      66.84115       6.859701      77.80974       11.65071  580.8425 30.51711 617.4512 48.98950 -36.60876      57.71711 
1 1 1 4   24 17 o 456.1367 27.78982 41.20840       4.899284      41.53454       5.419023      39.74865       11.46454  456.9603 30.71460 425.6057 71.92500 31.35461       78.20865 
1 1 1 4   24 18 o 203.4235 55.94806 8.923975       4.557909      11.15027       5.138991      0.7158809      9.867518  226.4208 58.14178 175.1740 76.54941 51.24678       96.12637 
1 1 1 4   24 19 o 252.6844 44.73273 13.39544       4.229023      18.66471       6.324443      9.133920       5.687604  293.0883 57.61829 204.4457 64.26492 88.64258       86.31250 
1 1 1 4   24 20 o 248.2339 45.14360 13.02332       4.191648      14.74279       6.217172      11.59038       5.675554  256.0445 62.96324 227.2445 62.40397 28.80000       88.64889 
1 1 1 4   24 21 o 163.4192 54.75374 5.556001       4.092526      2.002507       5.843912      8.976000       5.733091  146.1197 61.22720 200.7911 64.67871 -54.67137      89.06237 
1 1 1 4   25 0  o 612.3571 22.92907 73.18430       5.452795      59.18123       7.023151      94.43582       8.651978  548.1827 33.14559 693.9175 32.10551 -145.7347      46.14536 
1 1 1 4   25 1  o 793.2889 19.28718 122.6361       5.941938      126.8708       7.991210      117.3997       8.886203  805.7838 25.53677 774.3028 29.55136 31.48096       39.05649 
1 1 1 4   25 2  o 969.6033 20.45033 183.2904       7.700563      187.2273       11.90830      180.4609       10.09536  977.2991 31.37577 960.6382 27.06038 16.66089       41.43312 
1 1 1 4   25 3  o 122.4580 53.35534 -0.6967219     4.762342      -0.4577343     5.264587      -1.773021      11.17231  130.4184 56.46154 183.4814 80.78272 -53.06296      98.55838 
1 1 1 4   25 4  o 476.2382 29.46792 44.58392       5.423290      43.51623       6.104959      48.58002       11.81074  469.5968 33.69979 486.7486 64.03469 -17.15186      72.36102 
1 1 1 4   25 5  o 317.0524 36.55319 20.03488       4.418305      21.38186       5.531517      17.66088       7.343503  325.6338 44.93820 289.7039 66.65673 35.92990       80.39006 
1 1 1 4   25 6  o 488.2637 25.19379 46.72381       4.760945      48.83225       6.042990      43.27346       7.730410  497.9357 31.41103 465.6192 43.24464 32.31650       53.44859 
1 1 1 4   25 7  o 549.3169 23.15320 58.94155       4.939261      62.55288       6.210320      52.72474       8.148242  564.3535 28.42696 514.7291 41.10501 49.62439       49.97713 
1 1 1 4   25 8  o 910.7449 20.27853 161.8394       7.172346      163.7678       8.285019      156.0718       14.32858  915.4492 23.30404 887.5632 41.56960 27.88605       47.65617 
1 1 1 4   25 9  o 1097.056 18.09431 234.6592       7.709014      234.6592       7.709014      0.000000       0.000000  1097.056 18.09431 ?        ?        0.000000       18.09431 
1 1 1 4   25 10 o 493.3162 24.86532 47.76751       4.748414      47.76751       4.748414      0.000000       0.000000  493.3162 24.86532 ?        ?        0.000000       24.86532 
1 1 1 4   25 11 o 426.9294 25.72982 35.85836       4.246068      38.21289       4.615552      22.89348       10.83069  440.4617 27.11458 320.9292 85.39995 119.5326       89.60107 
1 1 1 4   25 12 o 705.7417 19.01863 97.26575       5.212582      97.85381       5.703508      94.28425       12.84261  707.4880 20.75846 682.5910 48.76786 24.89703       53.00205 
1 1 1 4   25 13 o 562.5499 22.18865 61.96804       4.847524      58.95547       5.310802      77.01030       11.86719  548.0997 24.95012 614.8845 50.13293 -66.78479      55.99839 
1 1 1 4   25 14 o 328.5069 39.72894 21.85685       4.965504      20.23219       5.659017      27.29341       10.35195  312.9314 48.10559 349.8114 78.16904 -36.88000      91.78533 
1 1 1 4   25 15 o 355.6309 34.88823 25.39772       4.756396      26.79634       5.437772      20.84242       9.813630  363.8831 39.09252 301.8561 81.71397 62.02701       90.58365 
1 1 1 4   25 16 o 249.0994 46.35989 12.99364       4.319755      10.94185       4.774228      22.25744       10.14451  225.4376 55.01615 309.1962 82.82023 -83.75862      99.42820 
1 1 1 4   25 17 o 475.2376 28.62332 44.93550       5.258087      42.32272       5.986733      53.75185       10.99722  458.9810 33.82505 502.7691 57.34927 -43.78812      66.58133 
1 1 1 4   25 18 o 469.5056 32.70730 44.31081       5.926420      48.71519       7.187053      34.95322       10.47587  489.4763 38.10904 392.7933 71.30093 96.68295       80.84628 
1 1 1 4   25 19 o 152.2426 58.92729 3.812402       4.961601      4.612532       5.783380      1.581692       9.656573  164.1915 63.60133 173.5475 75.78566 -9.355927      98.93733 
1 1 1 4   26 0  o 305.9012 53.99850 19.29800       6.180385      18.78932       10.44809      19.57180       7.665297  294.3753 86.00062 304.1562 66.72803 -9.780914      108.8519 
1 1 1 4   26 1  o 285.0696 44.33195 16.50113       4.748427      11.18750       6.068827      24.88933       7.625062  230.8599 64.95573 346.7643 58.71705 -115.9045      87.56106 
1 1 1 4   26 2  o 579.4783 23.91878 65.65092       5.382750      71.24361       7.099330      58.08821       8.255550  601.6332 30.48443 540.5210 39.60404 61.11218       49.97780 
1 1 1 4   26 3  o 657.0060 21.43917 84.28551       5.470227      83.34024       7.053620      85.71191       8.664713  652.0682 27.85422 658.9473 33.97474 -6.879028      43.93336 
1 1 1 4   26 4  o 400.7309 34.56367 31.86863       5.326370      35.71976       7.346017      27.59972       7.734217  421.2052 45.63870 366.1695 56.18233 55.03574       72.38332 
1 1 1 4   26 5  o 946.4507 20.79314 174.9039       7.642688      175.8596       8.858116      172.1205       15.11717  948.1468 24.05680 931.0981 41.80681 17.04865       48.23421 
1 1 1 4   26 6  o 1083.841 39.43217 232.8411       16.59756      0.000000       0.000000      232.8411       16.59756  ?        ?        1083.841 39.43217 0.000000       39.43217 
1 1 1 4   26 7  o 800.8278 21.14701 125.3097       6.576823      126.3064       7.610517      122.3701       13.07025  803.1797 24.39908 782.6137 43.17093 20.56598       49.58876 
1 1 1 4   26 8  o 245.7465 56.88334 12.73697       5.321442      12.73697       5.321442      0.000000       0.000000  245.7465 56.88334 ?        ?        0.000000       56.88334 
1 1 1 4   26 9  f 1186.884 22.95252 275.7914       10.57953      275.7914       10.57953      0.000000       0.000000  1186.884 22.95252 ?        ?        0.000000       22.95252 
1 1 1 4   26 10 o 264.4977 39.65999 14.22097       3.948239      17.49267       4.270918      -5.009159      10.35441  294.2972 38.27447 161.1863 73.73796 133.1108       83.07961 
1 1 1 4   26 11 o 171.7151 53.36259 6.035837       3.934146      10.17436       4.234790      -20.04538      10.63098  219.8332 50.64580 125.7722 61.89375 94.06104       79.97395 
1 1 1 4   26 12 o 409.4071 27.30297 33.15270       4.316137      35.39392       4.684557      20.56183       11.10335  422.6754 28.70886 298.7319 89.02428 123.9436       93.53887 
1 1 1 4   26 13 o 330.9620 35.86222 22.07386       4.535652      26.75310       5.198302      7.149975       9.283558  364.1940 37.27908 205.6022 80.31852 158.5918       88.54826 
1 1 1 4   26 14 o 317.7082 37.95384 20.50260       4.590174      16.87130       5.139480      34.81822       10.20452  283.9085 48.34615 398.6922 68.36720 -114.7837      83.73424 
1 1 1 4   26 15 f 137.3571 52.33076 2.995027       3.870857      3.486452       4.238267      0.5236087      9.504580  145.1548 54.88761 170.9740 74.91023 -25.81924      92.86654 
1 1 1 4   26 16 o 238.0008 42.81952 11.86108       3.812222      10.49274       4.199373      18.27244       9.089983  220.9196 50.09968 277.7201 79.95386 -56.80051      94.35358 
1 1 1 4   26 17 o 223.6448 47.81661 10.72318       4.027230      13.49315       4.516190      -0.3118430E-01 8.898693  251.4692 47.99536 161.7094 71.60001 89.75986       86.19811 
1 1 1 4   26 18 o 259.6544 41.91468 14.12669       4.082636      12.41691       4.561974      21.00427       9.149552  239.2733 50.67155 294.9424 78.49650 -55.66907      93.43076 
1 1 1 4   27 0  o 198.5746 60.14913 8.183491       5.038373      7.213068       5.983289      10.54887       9.341361  192.5102 66.18595 231.4676 82.46008 -38.95734      105.7367 
1 1 1 4   27 1  o 151.0023 69.77983 -6.244036      9.605575      -6.244036      9.605575      0.000000       0.000000  151.0023 69.77983 ?        ?        0.000000       69.77983 
1 1 1 4   27 2  f 366.4615 46.33898 27.30519       6.447429      35.54139       11.27512      23.30358       7.859137  406.2657 74.19742 331.8156 63.29862 74.45020       97.52934 
1 1 1 4   27 3  o 492.1805 43.06153 48.71151       8.147969      0.000000       0.000000      48.71151       8.147969  ?        ?        492.1805 43.06153 0.000000       43.06153 
1 1 1 4   27 4  o 486.1392 26.72131 46.53909       5.025465      46.01653       6.275635      47.47320       8.390522  481.3995 33.78184 484.9025 45.07185 -3.502991      56.32659 
1 1 1 4   27 5  o 339.8941 62.71054 24.47244       7.972786      0.000000       0.000000      24.47244       7.972786  ?        ?        339.8941 62.71054 0.000000       62.71054 
1 1 1 4   27 6  o 360.5526 51.58414 26.81599       7.017056      26.81599       7.017056      0.000000       0.000000  360.5526 51.58414 ?        ?        0.000000       51.58414 
1 1 1 4   27 7  o 227.6576 60.37411 11.07781       5.424964      11.07781       5.424964      0.000000       0.000000  227.6576 60.37411 ?        ?        0.000000       60.37411 
1 1 1 4   27 8  o 203.3796 58.32866 8.761809       4.846133      15.01577       5.418495      -16.23773      10.83345  266.8009 54.14560 134.9392 65.55037 131.8617       85.02116 
1 1 1 4   27 9  f 251.5419 43.33413 13.04966       4.080404      10.94198       4.422079      25.12919       10.58644  227.5660 51.26730 332.7476 82.36480 -105.1815      97.01699 
1 1 1 4   27 10 o 110.0381 47.67499 -0.2267832     3.759311      0.2898351      4.056215      -3.373168      10.01018  117.8094 50.25605 162.1480 73.52680 -44.33859      89.06100 
1 1 1 4   27 11 o 447.2906 25.66679 39.53455       4.439846      38.30118       4.802470      46.78875       11.64699  439.4168 28.29272 465.6478 66.27666 -26.23102      72.06299 
1 1 1 4   27 12 o 93.71783 43.97579 -3.796077      4.053342      -2.998452      4.523650      -7.044759      9.129426  104.3907 48.11591 140.9207 66.08434 -36.52992      81.74521 
1 1 1 4   27 13 o 266.6197 44.06427 14.81688       4.403158      16.70266       4.940430      7.533867       9.709009  282.3196 46.69265 206.5301 81.68994 75.78955       94.09277 
1 1 1 4   27 14 f 441.7356 25.44803 38.70045       4.347134      35.46550       4.780519      54.15446       10.44868  421.3265 29.40081 505.5732 54.05458 -84.24670      61.53296 
1 1 1 4   27 15 o 150.9991 52.82267 4.470730       3.819047      3.269310       4.161956      10.87352       9.608037  141.4953 54.17805 222.8562 82.97402 -81.36093      99.09566 
1 1 1 4   27 16 o 307.6582 31.58035 19.14990       3.719715      18.45307       4.120403      22.21904       8.647386  300.1466 36.07151 307.5027 73.42482 -7.356171      81.80684 
1 1 1 4   28 0  f 242.6787 52.80256 12.45175       4.834922      15.90130       6.209504      7.140129       7.705299  272.2589 60.31621 198.6697 74.23885 73.58923       95.65277 
1 1 1 4   28 1  o 402.1404 32.85851 32.23999       5.086772      33.04674       6.520168      30.98529       8.131284  403.8442 42.19670 384.9471 56.03576 18.89703       70.14676 
1 1 1 4   28 2  o 206.0611 72.03107 8.502983       7.100935      8.127394       10.68532      8.800044       9.502843  219.3762 86.03880 217.9432 82.24141 1.432999       119.0224 
1 1 1 4   28 3  o 579.6324 31.15187 66.63335       6.986651      67.99101       11.63171      65.86704       8.738688  574.5858 52.71454 572.6508 39.53635 1.934937       65.89344 
1 1 1 4   28 4  o 202.7410 57.47049 8.742769       4.732409      12.19096       5.845680      2.185128       8.061448  237.3478 62.54156 170.4346 71.68886 66.91325       95.13538 
1 1 1 4   28 5  o 176.8198 60.33168 6.190748       4.969726      9.896428       5.671068      -6.073171      10.31681  214.6977 63.54145 155.9157 72.14407 58.78200       96.13680 
1 1 1 4   28 6  o 279.4585 48.11111 16.27168       5.033071      14.63902       5.690252      22.14046       10.78840  261.2610 57.62988 308.9458 86.49226 -47.68488      103.9332 
1 1 1 4   28 7  o 251.1715 60.16750 13.67531       5.791749      22.87714       6.810066      -10.37816      11.01040  328.9742 55.26376 148.9352 70.66600 180.0391       89.70934 
1 1 1 4   28 8  o 266.3597 50.84163 14.98781       5.067302      17.20266       5.710196      6.779751       10.99256  284.6459 53.62286 210.9288 85.71763 73.71703       101.1085 
1 1 1 4   28 9  o 257.5056 51.32996 14.09056       4.953026      17.30620       5.584565      2.236507       10.72233  285.6562 52.26662 187.5266 80.88181 98.12965       96.29987 
1 1 1 4   28 10 o 117.9079 50.81842 0.9704305E-01  4.226727      -1.065901      4.625918      5.976173       10.40100  115.8004 51.43103 201.8609 82.85728 -86.06045      97.52168 
1 1 1 4   28 11 o 234.4227 48.76861 11.71874       4.295259      12.89552       4.762699      6.591093       9.941787  245.0001 51.68208 201.5151 81.65125 43.48500       96.63313 
1 1 1 4   28 12 o 502.9285 23.54980 49.90840       4.599615      49.64755       5.115840      51.00878       10.50720  499.9242 26.44430 488.0186 56.48394 11.90558       62.36775 
1 1 1 4   28 13 o 262.4798 40.66337 14.33708       4.010966      10.30407       4.399292      34.20361       9.764028  217.2213 52.68980 390.1607 66.84512 -172.9394      85.11454 
1 1 1 4   28 14 o 200.9149 50.34130 8.793641       3.919898      9.712675       4.414501      5.367935       8.522968  210.0274 53.86383 184.5243 75.28734 25.50313       92.57157 
1 1 1 4   29 0  o 150.4585 56.99235 3.727217       4.574577      1.294048       6.183078      6.669845       6.799645  147.4879 62.44964 188.3764 69.86805 -40.88857      93.70967 
1 1 1 4   29 1  o 415.3565 31.29614 34.45351       5.011146      30.78879       6.636654      39.31403       7.643102  386.8255 45.02013 437.2992 45.67946 -50.47369      64.13599 
1 1 1 4   29 2  o 484.5653 27.58083 46.55725       5.168777      44.62741       6.962397      48.92680       7.714893  469.8128 38.49787 490.8581 40.84197 -21.04529      56.12622 
1 1 1 4   29 3  o 336.8552 53.69079 24.00643       6.787986      21.07814       9.922301      26.58258       9.306579  300.2101 82.54047 344.4684 71.89198 -44.25827      109.4595 
1 1 1 4   29 4  o 224.1218 72.12684 11.06469       7.130774      -3.681982      9.896906      26.98453       10.28305  158.3455 72.30476 342.2115 78.97842 -183.8660      107.0774 
1 1 1 4   29 5  o 219.5566 53.35801 10.39295       4.505031      8.965753       5.679118      12.81539       7.398880  203.6597 64.24480 238.5465 73.02412 -34.88675      97.26211 
1 1 1 4   29 6  o 324.9767 61.83366 23.08385       7.518654      0.000000       0.000000      23.08385       7.518654  ?        ?        324.9767 61.83366 0.000000       61.83366 
1 1 1 4   29 7  o 462.0479 27.31507 42.42994       4.879589      43.38123       6.278749      40.97912       7.753947  463.7866 35.12047 445.1655 45.49024 18.62103       57.47007 
1 1 1 4   29 8  f 284.7152 46.22752 17.03430       4.936077      19.27951       5.661038      9.913677       10.08154  301.3867 50.12711 219.8267 84.28574 81.56000       98.06535 
1 1 1 4   29 9  o 565.5326 30.55264 63.98879       6.685288      70.71667       8.368111      52.11893       11.11504  590.8388 36.65039 490.5061 59.57240 100.3327       69.94370 
1 1 1 4   29 10 o 129.0049 56.44728 -0.1555857     5.381017      6.347238       6.702378      -11.94847      9.025848  182.2926 69.00090 124.6054 60.36712 57.68719       91.68050 
1 1 1 4   29 11 o 358.7795 37.02736 26.34145       5.084977      24.96299       5.862157      30.53082       10.21964  345.2019 44.78287 360.3754 75.44183 -15.17346      87.73241 
1 1 1 4   29 12 o 447.4020 25.46244 39.83625       4.405816      39.31619       4.879610      42.13091       10.24981  443.1067 28.50756 435.4653 62.39158 7.641357       68.59584 
1 1 1 4   30 0  o 367.6581 34.15915 27.36857       4.821539      23.77393       6.412971      32.04253       7.312634  334.2288 51.02425 389.8506 49.40886 -55.62183      71.02612 
1 1 1 4   30 1  o 273.6304 47.35945 15.86003       4.850468      18.68038       5.920249      10.10124       8.459678  294.1955 53.80003 215.6680 78.26638 78.52748       94.97404 
1 1 1 4   30 2  o 414.3109 32.93839 34.60497       5.256018      31.11963       6.288064      42.68661       9.575129  388.1123 42.40898 445.4951 56.62367 -57.38284      70.74434 
1 1 1 4   30 3  o 148.4251 57.41143 3.550138       4.707181      -0.2072767     5.475567      14.19074       9.214413  129.9399 56.89651 245.0207 82.15808 -115.0808      99.93579 
1 1 1 4   30 4  o 430.6939 37.72255 37.83143       6.245940      36.98452       10.77695      38.25978       7.664423  402.5454 71.55914 427.6971 46.91420 -25.15167      85.56666 
1 1 1 4   30 5  o 265.9530 68.85313 16.31313       7.167130      25.52513       10.54610      8.407017       9.770040  323.2634 83.43865 208.0260 82.05263 115.2374       117.0241 
1 1 1 4   30 6  o 201.3764 55.65821 8.941506       4.497894      7.928095       5.724680      10.57634       7.271028  191.4261 64.75498 216.0931 72.97918 -24.66695      97.56622 
1 1 1 4   30 7  o 187.3289 56.48038 7.690682       4.450043      7.638523       5.751654      7.768470       7.023927  188.5703 64.88868 193.3378 71.13976 -4.767471      96.28814 
1 1 1 4   30 8  o 543.0214 32.06878 59.41841       6.732808      58.35268       8.214568      61.59961       11.75194  532.8028 39.99173 532.0925 57.80115 0.7103271      70.28735 
1 1 1 4   30 9  o 121.2386 51.45983 0.8020370      4.214671      -0.2820035     4.657132      5.707567       9.906921  119.3690 52.36489 192.2389 80.06583 -72.86991      95.66932 
1 1 1 4   31 0  f 133.3089 55.82097 1.581827       4.852267      11.59506       5.989188      -17.54513      8.277585  224.0630 65.01379 104.9954 52.19244 119.0677       83.37173 
1 1 1 4   31 1  o 259.5316 50.01347 14.61042       4.858068      10.69355       5.940202      22.52141       8.442039  215.6637 65.30747 308.6307 71.78796 -92.96706      97.04935 
1 1 1 4   31 2  o 165.7150 56.66395 5.746865       4.383937      1.024886       5.649532      12.89358       6.950305  137.5916 59.01817 233.8496 70.60363 -96.25797      92.02183 
1 1 1 4   31 3  o 449.0759 28.49652 40.44002       4.944064      37.45741       6.340747      45.06568       7.896385  426.4917 38.70414 464.0768 44.35388 -37.58514      58.86661 
1 1 1 4   31 4  o 191.5497 55.26163 8.139688       4.338326      1.430977       5.396883      20.39217       7.293493  137.6346 58.31467 298.1781 64.83244 -160.5436      87.20004 
1 1 1 4   31 5  o 233.6372 63.48425 12.56371       5.910305      2.984555       10.24039      17.34846       7.237401  180.5465 78.45433 271.9203 68.55318 -91.37386      104.1855 
1 1 1 5   0  0  o 310.5688 18.78576 18.95133       2.246776      18.95133       2.246776      18.95133       2.246776  310.5688 18.78576 310.5688 18.78576 0.000000       0.000000 
1 1 1 5   0  1  o 1428.390 19.11783 396.7700       10.60078      396.7700       10.60078      396.7700       10.60078  1428.390 19.11783 1428.390 19.11783 0.000000       0.000000 
1 1 1 5   0  2  o 65.50665 40.28875 0.6505286      1.988521      0.6505286      1.988521      0.6505286      1.988521  65.50665 40.28875 65.50665 40.28875 0.000000       0.000000 
1 1 1 5   0  3  o 898.2056 17.54982 156.9508       6.116488      156.9508       6.116488      156.9508       6.116488  898.2056 17.54982 898.2056 17.54982 0.000000       0.000000 
1 1 1 5   0  4  o 1278.331 18.88585 317.7802       9.371176      317.7802       9.371176      317.7802       9.371176  1278.331 18.88585 1278.331 18.88585 0.000000       0.000000 
1 1 1 5   0  5  o 778.8075 17.27425 118.0305       5.218847      118.0305       5.218847      118.0305       5.218847  778.8075 17.27425 778.8075 17.27425 0.000000       0.000000 
1 1 1 5   0  6  o 819.9962 17.47746 130.8347       5.559973      130.8347       5.559973      130.8347       5.559973  819.9962 17.47746 819.9962 17.47746 0.000000       0.000000 
1 1 1 5   0  7  o 1421.279 19.82717 392.8615       10.93900      392.8615       10.93900      392.8615       10.93900  1421.279 19.82717 1421.279 19.82717 0.000000       0.000000 
1 1 1 5   0  8  o 727.4348 17.96000 103.0312       5.066754      103.0312       5.066754      103.0312       5.066754  727.4348 17.96000 727.4348 17.96000 0.000000       0.000000 
1 1 1 5   0  9  o 685.0062 18.43252 91.40998       4.895485      91.40998       4.895485      91.40998       4.895485  685.0062 18.43252 685.0062 18.43252 0.000000       0.000000 
1 1 1 5   0  10 o 669.8531 19.03627 87.45523       4.943055      87.45523       4.943055      87.45523       4.943055  669.8531 19.03627 669.8531 19.03627 0.000000       0.000000 
1 1 1 5   0  11 o 128.2207 58.15390 4.688004       3.126586      4.688004       3.126586      4.688004       3.126586  128.2207 58.15390 128.2207 58.15390 0.000000       0.000000 
1 1 1 5   0  12 o 54.04755 38.07692 -3.631462      3.154916      -3.631462      3.154916      -3.631462      3.154916  54.04755 38.07692 54.04755 38.07692 0.000000       0.000000 
1 1 1 5   0  13 o 89.10521 54.10733 1.486713       3.484520      1.486713       3.484520      1.486713       3.484520  89.10521 54.10733 89.10521 54.10733 0.000000       0.000000 
1 1 1 5   0  14 o 943.9166 28.51546 174.4257       10.43143      174.4257       10.43143      174.4257       10.43143  943.9166 28.51546 943.9166 28.51546 0.000000       0.000000 
1 1 1 5   0  15 o 312.6447 55.06205 20.96944       6.066135      20.96944       6.066135      20.96944       6.066135  312.6447 55.06205 312.6447 55.06205 0.000000       0.000000 
1 1 1 5   0  16 o 317.5789 38.15308 20.57686       4.525735      20.57686       4.525735      20.57686       4.525735  317.5789 38.15308 317.5789 38.15308 0.000000       0.000000 
1 1 1 5   0  17 o 926.4157 21.33902 167.3167       7.668098      167.3167       7.668098      167.3167       7.668098  926.4157 21.33902 926.4157 21.33902 0.000000       0.000000 
1 1 1 5   0  18 o 575.9669 27.68676 65.08636       6.160330      65.08636       6.160330      65.08636       6.160330  575.9669 27.68676 575.9669 27.68676 0.000000       0.000000 
1 1 1 5   0  19 o 188.1093 86.40527 10.25560       6.911526      10.25560       6.911526      10.25560       6.911526  188.1093 86.40527 188.1093 86.40527 0.000000       0.000000 
1 1 1 5   0  20 o 856.6890 23.64137 143.1330       7.851908      143.1330       7.851908      143.1330       7.851908  856.6890 23.64137 856.6890 23.64137 0.000000       0.000000 
1 1 1 5   0  21 o 793.5799 25.26882 122.9540       7.769718      122.9540       7.769718      122.9540       7.769718  793.5799 25.26882 793.5799 25.26882 0.000000       0.000000 
1 1 1 5   0  22 o 87.81905 59.11967 -2.378001      5.777899      -2.378001      5.777899      -2.378001      5.777899  87.81905 59.11967 87.81905 59.11967 0.000000       0.000000 
1 1 1 5   0  23 o 775.8675 39.56644 118.7220       11.85106      118.7220       11.85106      118.7220       11.85106  775.8675 39.56644 775.8675 39.56644 0.000000       0.000000 
1 1 1 5   0  24 o 551.7769 34.69662 60.22331       7.367571      60.22331       7.367571      60.22331       7.367571  551.7769 34.69662 551.7769 34.69662 0.000000       0.000000 
1 1 1 5   0  25 o 1015.065 25.99730 201.3319       10.23306      201.3319       10.23306      201.3319       10.23306  1015.065 25.99730 1015.065 25.99730 0.000000       0.000000 
1 1 1 5   0  26 o 594.1389 35.12350 69.88887       8.039429      69.88887       8.039429      69.88887       8.039429  594.1389 35.12350 594.1389 35.12350 0.000000       0.000000 
1 1 1 5   0  27 o 372.5044 56.01257 29.41447       7.562379      29.41447       7.562379      29.41447       7.562379  372.5044 56.01257 372.5044 56.01257 0.000000       0.000000 
1 1 1 5   0  28 f 192.1834 100.6495 11.93356       9.887605      11.93356       9.887605      11.93356       9.887605  192.1834 100.6495 192.1834 100.6495 0.000000       0.000000 
1 1 1 5   0  29 o 485.4832 45.11202 48.33693       8.336593      48.33693       8.336593      48.33693       8.336593  485.4832 45.11202 485.4832 45.11202 0.000000       0.000000 
1 1 1 5   0  30 o 102.8766 68.51154 -0.9734756     7.392057      -0.9734756     7.392057      -0.9734756     7.392057  102.8766 68.51154 102.8766 68.51154 0.000000       0.000000 
1 1 1 5   0  31 o 605.4426 61.04888 79.78253       14.01954      79.78253       14.01954      79.78253       14.01954  605.4426 61.04888 605.4426 61.04888 0.000000       0.000000 
1 1 1 5   0  32 o 187.2891 104.9929 14.48864       11.49901      14.48864       11.49901      14.48864       11.49901  187.2891 104.9929 187.2891 104.9929 0.000000       0.000000 
1 1 1 5   1  0  o 496.9167 11.52684 47.98269       2.224446      45.29616       3.077407      50.92223       3.219055  482.6227 16.41909 511.7283 16.19798 -29.10556      23.06429 
1 1 1 5   1  1  o 990.1274 11.73524 190.4998       4.512434      196.5284       6.546343      185.0422       6.228597  1005.293 16.76787 975.5016 16.44123 29.79187       23.48352 
1 1 1 5   1  2  o 769.3635 11.57591 115.0140       3.458714      117.3958       4.094568      109.0814       6.462135  777.1923 13.56599 748.5880 22.22825 28.60431       26.04095 
1 1 1 5   1  3  o 1036.602 12.47453 208.8042       5.021858      205.2121       10.06222      209.9957       5.795194  1026.490 25.24127 1039.433 14.35634 -12.94324      29.03835 
1 1 1 5   1  4  o 1083.708 12.68014 228.2102       5.336594      231.6358       7.634462      224.9370       7.462636  1091.411 18.01201 1075.526 17.86666 15.88464       25.37026 
1 1 1 5   1  5  o 912.9102 12.40779 161.9370       4.398965      167.4214       6.372677      156.9451       6.079805  927.9189 17.68414 898.4360 17.42507 29.48297       24.82663 
1 1 1 5   1  6  o 1450.991 14.07514 409.1724       7.931320      405.7468       11.09075      412.7580       11.34679  1444.292 19.77325 1456.680 20.05768 -12.38855      28.16544 
1 1 1 5   1  7  o 1314.689 13.58517 335.9053       6.936112      330.8538       9.656091      341.2902       9.969715  1304.224 19.06431 1324.597 19.38077 -20.37292      27.18570 
1 1 1 5   1  8  o 465.9557 14.17948 42.20159       2.565860      46.44701       3.710465      38.31091       3.552064  488.6075 19.55421 443.7065 20.61375 44.90103       28.41292 
1 1 1 5   1  9  o 120.1370 37.85304 2.787324       1.971991      2.003647       2.880993      3.478157       2.704957  119.3787 45.22637 135.7973 44.47673 -16.41862      63.43188 
1 1 1 5   1  10 o 926.4186 13.03471 166.8350       4.689610      175.5413       6.814218      159.0010       6.463864  949.7608 18.47455 903.9151 18.41351 45.84570       26.08383 
1 1 1 5   1  11 o 869.8301 13.32440 147.1144       4.501012      148.0334       6.381745      146.2047       6.349166  871.9524 18.84598 866.5473 18.86672 5.405090       26.66691 
1 1 1 5   1  12 o 383.8957 18.70065 28.70740       2.788033      34.00759       4.033878      23.85991       3.857763  416.5746 25.05104 348.0725 28.79760 68.50208       38.16879 
1 1 1 5   1  13 o 817.5480 16.10193 130.1277       5.112335      124.2105       6.140928      143.4883       9.227676  798.2044 19.81034 856.2749 27.74924 -58.07050      34.09501 
1 1 1 5   1  14 o 514.8350 19.28031 51.67037       3.854874      52.73604       4.724984      49.54913       6.666277  519.6332 23.41399 500.8601 34.48205 18.77313       41.68005 
1 1 1 5   1  15 o 128.2593 47.77372 2.534337       3.185799      0.4509198      5.683554      3.488826       3.846958  140.8494 59.76940 144.9251 52.75021 -4.075668      79.71804 
1 1 1 5   1  16 o 1037.931 16.97512 209.7299       6.842416      208.6611       11.84782      210.2648       8.381485  1032.575 29.54531 1038.584 20.78027 -6.008667      36.12125 
1 1 1 5   1  17 o 151.8662 47.66916 4.515211       3.130615      6.025383       4.465359      3.055373       4.390311  176.3114 57.11164 146.5046 55.75164 29.80681       79.81219 
1 1 1 5   1  18 o 647.0350 19.87484 81.50168       4.994125      91.05142       8.819031      76.99355       6.059314  682.3190 33.28169 628.4351 24.82762 53.88391       41.52206 
1 1 1 5   1  19 o 1202.360 18.05298 281.2310       8.429685      272.3098       10.07283      302.0823       15.39960  1182.620 21.93200 1243.725 31.88286 -61.10437      38.69792 
1 1 1 5   1  20 o 426.4594 28.29448 35.61088       4.659446      29.97549       5.671121      47.31740       8.173738  389.6851 37.95553 489.4480 43.45367 -99.76294      57.69613 
1 1 1 5   1  21 o 1012.133 19.03023 199.2756       7.480140      200.1434       13.04757      198.8507       9.129388  1012.481 33.18294 1010.605 23.26120 1.875671       40.52395 
1 1 1 5   1  22 o 888.4377 17.65597 153.5294       6.091814      153.4191       8.565959      153.6422       8.665150  887.3777 24.85647 887.9900 25.12696 -0.6123047     35.34414 
1 1 1 5   1  23 o 1261.802 16.97760 309.7191       8.319468      300.8492       11.43755      319.6846       12.12339  1242.535 23.70262 1280.710 24.37503 -38.17542      33.99936 
1 1 1 5   1  24 o 613.0074 26.03369 73.31087       6.197685      76.76697       7.401709      65.20329       11.33664  626.7559 30.40924 572.0210 51.58727 54.73486       59.88296 
1 1 1 5   1  25 o 1075.205 25.57271 225.5749       10.67815      225.5749       10.67815      0.000000       0.000000  1075.205 25.57271 ?        ?        0.000000       25.57271 
1 1 1 5   1  26 o 1166.255 18.41981 264.8701       8.342697      265.9196       11.68244      263.7780       11.91779  1166.958 25.77805 1162.089 26.40758 4.869507       36.90350 
1 1 1 5   1  27 o 774.8464 24.58615 117.3161       7.398337      124.5818       9.199802      104.0158       12.44715  797.3319 29.71060 723.1730 44.53661 74.15887       53.53718 
1 1 1 5   1  28 o 357.4072 39.31575 25.58493       5.366830      23.39786       7.389154      28.02686       7.807826  335.3885 58.87864 368.7361 56.30957 -33.34760      81.47062 
1 1 1 5   1  29 o 169.8797 64.13909 4.681690       5.781847      7.068964       9.321959      3.189130       7.370925  208.6615 80.76978 172.0815 70.09016 36.57999       106.9410 
1 1 1 5   1  30 o 189.0783 72.87756 5.899876       7.564008      5.899876       7.564008      0.000000       0.000000  189.0783 72.87756 ?        ?        0.000000       72.87756 
1 1 1 5   1  31 f 884.4273 26.06802 154.3879       8.953609      158.5253       10.94741      146.0286       15.56078  892.8303 31.57289 843.1306 47.71927 49.69971       57.21867 
1 1 1 5   1  32 o 155.4102 65.19401 2.227743       6.637928      7.108202       12.66737      0.3802947      7.793673  214.7292 90.06844 155.3451 67.95395 59.38408       112.8276 
1 1 1 5   2  0  o 194.2371 19.02215 7.409968       1.416478      7.353857       1.991773      7.467386       2.014831  192.3089 27.44817 193.8023 27.54539 -1.493362      38.88638 
1 1 1 5   2  1  o 935.5806 11.58793 170.0821       4.210318      170.7991       5.964393      169.3700       5.944236  937.2290 16.38674 933.2986 16.40014 3.930359       23.18382 
1 1 1 5   2  2  o 979.1899 12.14850 186.3119       4.619742      182.3767       6.432662      190.5033       6.638818  968.4559 17.10342 989.7842 17.27119 -21.32831      24.30681 
1 1 1 5   2  3  o 673.2953 12.20657 88.08627       3.191739      89.80333       6.737270      87.58938       3.624247  679.0364 25.54835 671.3251 13.90135 7.711365       29.08549 
1 1 1 5   2  4  o 1045.060 12.61797 212.2205       5.121047      223.5345       7.538649      202.5259       6.978276  1072.156 18.10538 1020.570 17.60667 51.58527       25.25470 
1 1 1 5   2  5  o 2151.889 17.63719 900.3852       14.73931      913.0353       21.27724      888.7143       20.43720  2165.397 25.30170 2136.518 24.63128 28.87915       35.31113 
1 1 1 5   2  6  o 1123.657 12.95712 245.3524       5.654186      261.8316       8.435043      231.9059       7.619463  1160.307 18.71916 1092.055 17.96602 68.25195       25.94580 
1 1 1 5   2  7  o 1267.378 13.40447 312.1627       6.597569      311.2137       9.310680      313.1197       9.350189  1264.912 18.95367 1268.777 18.97611 -3.864868      26.82041 
1 1 1 5   2  8  o 316.8493 17.75401 19.58693       2.175830      18.52020       3.051438      20.69030       3.103396  307.2304 25.81407 324.9742 24.77682 -17.74371      35.78068 
1 1 1 5   2  9  o 549.7853 13.81658 58.75741       2.949998      62.91677       4.243420      54.86700       4.103930  568.6196 19.21614 530.9586 19.90267 37.66101       27.66544 
1 1 1 5   2  10 o 613.5673 13.66093 73.19093       3.255147      74.18881       4.635254      72.21995       4.572336  617.3549 19.33351 609.1083 19.32928 8.246643       27.33872 
1 1 1 5   2  11 o 945.6595 13.29625 173.8881       4.883059      180.8522       7.065146      167.5190       6.756562  963.7319 18.87717 927.5432 18.75701 36.18872       26.61152 
1 1 1 5   2  12 o 122.1148 43.81079 2.508955       2.641263      2.180822       3.324568      3.070503       4.349146  126.2478 48.40247 145.8817 55.49561 -19.63387      73.63805 
1 1 1 5   2  13 o 595.3135 17.38071 69.02991       4.018290      71.52847       4.988582      64.41362       6.780789  605.5322 21.21348 572.4087 30.61418 33.12354       37.24567 
1 1 1 5   2  14 o 402.4945 19.34684 31.58173       3.024112      28.97145       4.182115      34.44238       4.378095  383.6300 28.27003 418.6852 27.07078 -35.05518      39.14105 
1 1 1 5   2  15 o 246.0106 30.66667 12.04059       2.866254      12.59882       4.026038      11.46686       4.081522  249.0193 43.19712 236.6634 46.06557 12.35590       63.15083 
1 1 1 5   2  16 o 749.0215 17.83071 109.2465       5.186699      114.3594       9.382113      106.9961       6.224324  764.0522 31.61911 740.7759 21.63602 23.27637       38.31299 
1 1 1 5   2  17 o 429.4434 24.78016 36.09377       4.115183      34.26171       7.038405      37.04534       5.072537  414.7387 44.38815 434.2600 30.26715 -19.52130      53.72530 
1 1 1 5   2  18 o 1226.962 15.40365 292.7641       7.339773      295.3786       10.45698      290.2252       10.30471  1231.483 21.86503 1220.715 21.73669 10.76831       30.83121 
1 1 1 5   2  19 o 793.1934 16.60916 122.3551       5.116285      123.4117       7.295770      121.3327       7.176739  795.9894 23.60129 789.2758 23.41372 6.713684       33.24490 
1 1 1 5   2  20 o 322.9231 45.05917 20.83691       5.496852      17.77604       7.975308      23.60674       7.586689  293.1988 70.83452 340.9730 59.45522 -47.77414      92.47947 
1 1 1 5   2  21 o 752.8076 20.51364 110.2749       5.997285      108.5027       7.281698      114.0120       10.57433  746.3436 25.12268 763.8435 35.64678 -17.49994      43.61012 
1 1 1 5   2  22 o 1126.527 16.67589 246.8025       7.295561      241.0860       10.10956      253.0148       10.53878  1112.576 23.39777 1139.707 23.81054 -27.13123      33.38259 
1 1 1 5   2  23 o 793.8619 18.70243 122.6456       5.765954      117.4082       8.017346      128.2567       8.298499  775.8463 26.60890 810.9338 26.35034 -35.08759      37.44828 
1 1 1 5   2  24 o 1225.620 17.26798 292.2892       8.219125      283.6795       11.32163      301.8828       11.95110  1206.234 24.16848 1244.214 24.73345 -37.97998      34.58119 
1 1 1 5   2  25 o 1311.497 20.33924 335.0250       10.35929      341.0735       12.71394      323.0778       17.86866  1322.298 24.75842 1283.729 35.84188 38.56921       43.56167 
1 1 1 5   2  26 o 583.6037 29.14495 66.61721       6.605556      67.64579       7.841420      64.10353       12.25830  586.2375 34.59568 564.2408 56.70978 21.99670       66.42937 
1 1 1 5   2  27 o 425.2601 33.45366 35.74310       5.480318      30.68340       7.599328      41.22594       7.910729  388.9819 51.57769 453.7076 45.50991 -64.72568      68.78525 
1 1 1 5   2  28 o 438.1004 33.14495 38.01127       5.597490      32.60643       7.733129      43.95956       8.112590  400.1611 50.91443 467.5631 45.24347 -67.40207      68.11205 
1 1 1 5   2  29 o 350.5983 39.55576 24.75229       5.291618      30.15809       7.365226      18.98483       7.607615  383.3476 50.71800 296.7507 67.53165 86.59686       84.45614 
1 1 1 5   2  30 o 305.0383 56.62140 19.71209       6.460587      23.76640       7.929232      11.70475       11.14338  332.3026 63.76164 240.7263 89.41118 91.57628       109.8176 
1 1 1 5   2  31 o 272.5096 63.27241 16.36142       6.567572      22.76666       10.74170      12.53757       8.299570  309.5047 86.18342 236.7791 77.92504 72.72563       116.1890 
1 1 1 5   2  32 o 808.3868 23.61147 128.9558       7.412596      133.8616       10.89939      124.7342       10.11094  816.3373 34.37990 789.0527 32.99572 27.28461       47.65181 
1 1 1 5   3  0  o 676.7939 11.39769 89.00100       2.995721      88.78918       4.217233      89.21674       4.256215  675.7700 16.06944 677.3890 16.17921 -1.619019      22.80337 
1 1 1 5   3  1  o 1720.908 15.09310 575.6945       10.08705      576.6586       11.74120      572.9780       19.70968  1722.013 17.55691 1714.154 29.60750 7.858643       34.42163 
1 1 1 5   3  2  o 1050.095 17.34997 214.4215       7.075467      214.4215       7.075467      0.000000       0.000000  1050.095 17.34997 ?        ?        0.000000       17.34997 
1 1 1 5   3  3  o 482.0620 12.66027 45.15637       2.370140      40.62913       3.230418      50.43487       3.488168  457.0820 18.19854 509.2847 17.63636 -52.20267      25.34222 
1 1 1 5   3  4  o 1011.443 12.41788 198.7821       4.877723      207.4440       10.63135      196.4726       5.489614  1031.993 26.52673 1005.454 14.05891 26.53888       30.02199 
1 1 1 5   3  5  o 1071.570 17.93398 223.2831       7.463203      0.000000       0.000000      223.2831       7.463203  ?        ?        1071.570 17.93398 0.000000       17.93398 
1 1 1 5   3  6  o 505.4709 13.36215 49.65289       2.623014      50.39616       3.720663      48.91847       3.698441  509.0360 18.82105 501.5104 18.98938 7.525604       26.73627 
1 1 1 5   3  7  o 384.0399 21.81083 28.79741       3.239525      28.79741       3.239525      0.000000       0.000000  384.0399 21.81083 ?        ?        0.000000       21.81083 
1 1 1 5   3  8  f 589.7174 18.33788 67.64957       4.199726      0.000000       0.000000      67.64957       4.199726  ?        ?        589.7174 18.33788 0.000000       18.33788 
1 1 1 5   3  9  o 614.0549 13.30952 73.29486       3.173931      70.03876       4.421468      76.75656       4.558920  599.9316 18.97740 628.0646 18.69088 -28.13293      26.63626 
1 1 1 5   3  10 o 365.8089 17.57184 26.03946       2.496315      24.41449       3.491240      27.73929       3.570748  352.8673 25.65202 376.3867 24.56318 -23.51938      35.51585 
1 1 1 5   3  11 o 933.8204 15.08286 169.6453       5.469847      167.7566       6.749573      173.2590       9.336148  928.1355 18.72565 942.0663 25.51868 -13.93085      31.65206 
1 1 1 5   3  12 o 908.5278 15.46135 160.6436       5.455237      159.7358       6.733936      162.3770       9.304893  905.4072 19.15125 911.4586 26.28733 -6.051392      32.52374 
1 1 1 5   3  13 o 569.6070 15.38817 63.15708       3.404005      68.63268       4.891342      58.01465       4.740195  593.1241 21.23511 545.1742 22.38891 47.94995       30.85762 
1 1 1 5   3  14 o 196.1587 36.72395 7.814786       2.694774      9.576137       3.837412      6.101134       3.785097  215.5478 47.15392 173.6619 52.02934 41.88593       70.21783 
1 1 1 5   3  15 f 443.6770 18.95799 38.35899       3.266534      38.32987       4.604968      38.38849       4.634327  441.9073 26.96187 442.2196 27.11580 -0.3122253     38.23884 
1 1 1 5   3  16 o 499.1591 21.12835 48.56729       4.095741      45.30941       6.762108      50.45501       5.147339  478.9386 36.63366 507.5801 26.20198 -28.64148      45.03964 
1 1 1 5   3  17 o 217.6577 52.99294 9.754960       4.437449      0.000000       0.000000      9.754960       4.437449  ?        ?        217.6577 52.99294 0.000000       52.99294 
1 1 1 5   3  18 o 460.6355 24.65749 41.47519       4.394973      46.81277       7.754235      38.94901       5.334568  486.6897 41.41987 445.4646 31.02978 41.22513       51.75377 
1 1 1 5   3  19 f 275.7986 34.90306 15.10034       3.654705      19.68670       5.177038      10.54399       5.160071  313.8680 43.65431 226.6819 58.28896 87.18605       72.82377 
1 1 1 5   3  20 o 1167.145 15.88020 264.8450       7.197950      268.7206       10.25564      261.0825       10.10491  1174.916 22.47647 1158.099 22.46771 16.81702       31.78034 
1 1 1 5   3  21 o 195.3835 55.44416 7.721073       4.402139      13.13828       5.352944      -3.597210      7.737405  253.3203 55.90931 145.3049 65.37774 108.0154       86.02383 
1 1 1 5   3  22 o 571.3291 21.65247 63.55055       4.804207      65.69696       6.655065      61.21480       6.942388  579.4776 29.67200 558.9393 32.11776 20.53833       43.72617 
1 1 1 5   3  23 o 485.8206 25.99187 46.15922       4.886121      47.98138       6.742243      44.14369       7.090977  493.8671 35.38789 472.9356 38.95439 20.93152       52.62839 
1 1 1 5   3  24 o 587.5026 26.75528 67.35957       6.104462      75.84638       7.687430      52.87376       10.04339  621.9546 31.93460 514.7767 50.90520 107.1779       60.09292 
1 1 1 5   3  25 o 983.8745 18.50721 188.4536       7.071454      188.6680       9.839624      188.2246       10.16963  983.2385 25.76865 981.9078 26.66898 1.330750       37.08447 
1 1 1 5   3  26 f 875.4533 19.72684 149.3282       6.706847      154.1671       9.313517      144.1160       9.666135  888.2075 27.00047 858.3481 28.99756 29.85944       39.62175 
1 1 1 5   3  27 f 622.4214 27.96711 75.86359       6.760207      82.72556       8.059467      59.57684       12.41649  649.1250 31.97054 540.4712 60.17769 108.6538       68.14301 
1 1 1 5   3  28 o 573.4266 37.03713 65.27622       8.203814      65.27622       8.203814      0.000000       0.000000  573.4266 37.03713 ?        ?        0.000000       37.03713 
1 1 1 5   3  29 o 208.4679 66.94056 8.999035       6.144752      9.580024       7.365309      7.668700       11.14519  216.8757 73.44979 221.2928 87.52532 -4.417084      114.2609 
1 1 1 5   3  30 o 358.1846 48.52479 26.49074       6.576149      30.13251       7.879978      18.13502       11.93604  379.2981 55.10780 280.9393 93.49790 98.35876       108.5298 
1 1 1 5   3  31 o 109.1429 51.06869 -4.549653      5.400467      -6.292121      7.575166      -2.748709      7.701223  127.7831 60.01078 142.1209 64.46325 -14.33775      88.07272 
1 1 1 5   3  32 o 570.7688 31.94617 65.34687       7.052773      59.52950       11.88138      68.51192       8.763812  524.8052 59.33866 579.8865 39.14461 -55.08130      71.08710 
1 1 1 5   4  0  o 525.1694 11.94647 53.59143       2.436504      54.91759       3.436796      52.25138       3.454748  531.4554 16.65172 518.3726 17.16115 13.08282       23.91202 
1 1 1 5   4  1  o 706.1844 14.00404 96.92472       3.840604      96.92472       3.840604      0.000000       0.000000  706.1844 14.00404 ?        ?        0.000000       14.00404 
1 1 1 5   4  2  o 587.7517 12.21996 67.12463       2.789276      67.68902       3.893863      66.52981       3.997441  590.0297 16.99334 584.9277 17.59754 5.101929       24.46318 
1 1 1 5   4  3  o 769.8896 16.64814 115.2374       4.977624      115.2374       4.977624      0.000000       0.000000  769.8896 16.64814 ?        ?        0.000000       16.64814 
1 1 1 5   4  4  o 1046.719 12.52304 212.8928       5.090586      225.9461       11.20546      209.4982       5.714295  1076.989 26.79109 1038.239 14.17220 38.75000       30.30865 
1 1 1 5   4  5  o 456.5690 14.24464 40.51444       2.525724      44.76115       3.671149      36.69777       3.480312  479.7003 19.70625 434.3127 20.63420 45.38770       28.53255 
1 1 1 5   4  6  o 581.0156 12.81730 65.60155       2.892094      64.73595       4.125182      66.43826       4.055777  576.9293 18.41164 584.4930 17.86762 -7.563782      25.65620 
1 1 1 5   4  7  o 917.2012 12.50296 163.4841       4.453542      171.0298       6.483113      156.7417       6.128368  937.7430 17.80212 897.7368 17.57793 40.00623       25.01798 
1 1 1 5   4  8  f 1830.383 16.02725 651.4929       11.39276      647.5724       15.96496      655.5610       16.26275  1823.579 22.54319 1834.727 22.82415 -11.14807      32.08017 
1 1 1 5   4  9  o 984.7313 12.84341 188.4890       4.911636      193.4297       7.068299      183.8759       6.830032  997.0238 18.25498 972.1079 18.09174 24.91589       25.70127 
1 1 1 5   4  10 o 726.3945 14.79733 102.6232       4.174302      99.69667       5.153545      108.2060       7.117931  715.6323 18.54335 744.8290 24.60760 -29.19672      30.81216 
1 1 1 5   4  11 o 249.7094 27.10881 12.32577       2.586669      9.855969       3.262712      16.50465       4.244023  220.5845 39.53934 287.1147 39.07740 -66.53026      55.59139 
1 1 1 5   4  12 o 575.1263 14.87610 64.36910       3.322617      59.83720       4.610089      69.26782       4.793029  553.8584 21.43298 595.9975 20.70798 -42.13910      29.80256 
1 1 1 5   4  13 o 309.3784 22.27362 18.77858       2.658234      18.91381       3.750449      18.64206       3.768235  308.8840 31.71525 306.5531 32.12976 2.330872       45.14619 
1 1 1 5   4  14 o 516.7361 16.82436 52.00204       3.376256      47.85479       4.709249      56.38832       4.843055  494.8839 24.50306 537.3719 23.20686 -42.48801      33.74846 
1 1 1 5   4  15 o 1024.839 16.38171 204.4701       6.519929      192.5705       10.63575      211.6340       8.252372  992.2227 27.60139 1041.900 20.39505 -49.67712      34.31902 
1 1 1 5   4  16 o 395.2987 24.44226 30.60841       3.733866      26.18165       6.179949      33.15344       4.685841  361.5174 44.99107 410.6668 29.57931 -49.14941      53.84359 
1 1 1 5   4  17 f 1015.752 17.70362 200.7854       6.983576      188.5857       11.89488      207.2025       8.626931  982.1360 31.18606 1031.311 21.53966 -49.17456      37.90155 
1 1 1 5   4  18 o 910.3507 18.15177 161.2440       6.417349      154.5878       11.21373      164.4856       7.825455  889.4119 32.46527 919.0345 21.92551 -29.62268      39.17553 
1 1 1 5   4  19 o 687.0891 17.49193 91.81902       4.667439      85.84453       6.369766      98.74619       6.858848  663.8210 24.70839 711.9495 24.80698 -48.12854      35.01273 
1 1 1 5   4  20 o 761.7670 17.39149 112.8477       5.145018      107.4561       7.049695      118.9924       7.525939  742.8048 24.43811 781.6280 24.79320 -38.82318      34.81270 
1 1 1 5   4  21 o 810.9440 17.82424 127.9036       5.613451      139.0918       7.978459      116.9360       7.899371  845.0812 24.31043 774.6635 26.25738 70.41766       35.78333 
1 1 1 5   4  22 o 622.3216 24.27717 75.45853       5.867335      76.16066       7.235723      74.11044       10.02610  624.6689 29.82662 613.1930 42.36213 11.47589       51.80905 
1 1 1 5   4  23 o 449.0631 27.45392 39.49593       4.764844      37.27015       6.492282      42.09459       7.015055  434.2680 38.90816 461.6028 39.51306 -27.33481      55.45382 
1 1 1 5   4  24 o 373.2531 33.50076 27.48186       4.804381      26.11898       6.676828      28.94518       6.918455  360.5793 48.94555 380.1495 47.92789 -19.57013      68.50364 
1 1 1 5   4  25 o 928.5679 18.66786 167.8779       6.731876      167.3358       9.338501      168.4643       9.713171  925.9050 25.97065 928.8412 26.92723 -2.936157      37.41056 
1 1 1 5   4  26 o 615.6987 23.57035 73.97839       5.635887      77.49991       7.860167      70.25227       8.085297  627.9948 32.33886 597.2088 35.01421 30.78595       47.66337 
1 1 1 5   4  27 o 377.2762 35.62805 28.26852       5.158310      29.59875       6.951305      26.63835       7.695184  382.8329 47.79649 360.0045 56.93412 22.82840       74.33706 
1 1 1 5   4  28 o 745.4556 30.32059 109.2748       8.777835      109.2748       8.777835      0.000000       0.000000  745.4556 30.32059 ?        ?        0.000000       30.32059 
1 1 1 5   4  29 o 467.2731 36.12672 43.56834       6.504896      39.06403       7.625678      55.60283       12.46460  438.8880 45.39621 514.7399 63.71490 -75.85190      78.23302 
1 1 1 5   4  30 f 180.1855 62.69315 6.374102       5.376185      15.04520       7.560287      -2.496106      7.646595  260.1329 72.25594 143.9586 64.86171 116.1743       97.09769 
1 1 1 5   4  31 o 475.5722 33.06384 45.34085       6.068608      55.83806       8.500742      34.43085       8.666268  523.0073 42.21210 401.6732 57.16933 121.3341       71.06472 
1 1 1 5   4  32 o 279.7458 58.90414 17.25570       6.197101      15.83356       10.41977      18.03406       7.708655  256.0067 87.35907 279.3528 70.92708 -23.34619      112.5267 
1 1 1 5   5  0  o 708.2543 12.12086 97.47077       3.333886      99.00779       3.944891      93.62949       6.236399  713.7240 14.23235 693.5281 23.15484 20.19586       27.17916 
1 1 1 5   5  1  f 1288.481 13.36378 322.6343       6.687059      319.6428       9.327714      325.7975       9.591668  1281.986 18.73545 1294.230 19.08336 -12.24426      26.74306 
1 1 1 5   5  2  o 508.8420 12.64798 50.31287       2.499379      53.48369       3.499385      47.01091       3.571016  524.4704 17.18077 491.6499 18.70285 32.82053       25.39637 
1 1 1 5   5  3  o 697.4330 11.86483 94.51031       3.213601      94.49899       4.494301      94.52216       4.596869  697.1790 16.59930 697.2445 16.97654 -0.6555176E-01 23.74320 
1 1 1 5   5  4  o 811.3624 12.06520 127.9137       3.801695      131.3600       8.543212      127.0628       4.245178  821.1451 26.79003 808.5902 13.51884 12.55493       30.00775 
1 1 1 5   5  5  o 588.1203 15.23334 67.23735       3.479280      60.83058       6.427261      69.89301       4.138014  557.7451 29.78077 599.5026 17.77350 -41.75751      34.68128 
1 1 1 5   5  6  o 968.3622 12.49065 182.2287       4.697329      185.0649       6.748896      179.5638       6.541988  975.4703 17.81520 960.8875 17.53110 14.58282       24.99442 
1 1 1 5   5  7  o 710.5735 12.43984 98.12560       3.432827      101.2300       4.937838      95.22169       4.775719  721.4200 17.62466 699.6865 17.57548 21.73352       24.89028 
1 1 1 5   5  8  o 498.1549 13.65290 48.24101       2.641297      54.22488       3.845969      42.89923       3.633772  527.8839 18.76028 469.4663 19.93082 58.41754       27.37126 
1 1 1 5   5  9  o 1179.881 15.12154 270.7426       6.928868      270.3018       8.637111      271.5384       11.60561  1178.405 18.87322 1179.944 25.32669 -1.539063      31.58544 
1 1 1 5   5  10 o 916.3238 14.59579 163.3197       5.194033      164.4484       6.537051      161.3869       8.554143  919.0338 18.31565 909.5248 24.21776 9.508972       30.36384 
1 1 1 5   5  11 o 842.8313 13.24491 138.1611       4.335284      140.4800       6.162570      135.8891       6.099944  849.1915 18.68651 835.1829 18.80686 14.00861       26.51195 
1 1 1 5   5  12 o 429.5013 17.05533 35.92750       2.844805      37.22653       4.048908      34.66100       3.997900  435.9081 24.01005 420.4804 24.58973 15.42761       34.36768 
1 1 1 5   5  13 o 776.4334 14.01216 117.3050       4.225103      123.8643       6.109829      111.2936       5.849093  797.0250 19.73918 755.4678 19.93630 41.55725       28.05515 
1 1 1 5   5  14 o 503.8438 18.98924 49.47593       3.715622      50.47516       6.132440      48.89632       4.670544  506.3599 31.33905 500.3286 24.03721 6.031281       39.49587 
1 1 1 5   5  15 o 632.0996 22.64094 77.95290       5.557865      0.000000       0.000000      77.95290       5.557865  ?        ?        632.0996 22.64094 0.000000       22.64094 
1 1 1 5   5  16 o 707.2327 15.97683 97.32053       4.388144      92.68382       6.072518      102.3878       6.348205  689.4702 22.67908 724.6816 22.55671 -35.21136      31.98665 
1 1 1 5   5  17 o 557.7587 18.23575 60.54314       3.950008      64.04916       5.551987      56.94945       5.620962  573.1221 24.94441 540.2512 26.79088 32.87091       36.60567 
1 1 1 5   5  18 o 591.7266 21.79521 68.17966       5.008528      83.50366       9.146544      61.61688       5.985701  652.2647 36.25114 562.0697 27.42186 90.19501       45.45441 
1 1 1 5   5  19 o 188.3248 55.37143 7.116008       4.318889      8.558424       7.766778      6.470338       5.196381  217.0304 75.36251 185.4012 61.69051 31.62920       97.39213 
1 1 1 5   5  20 o 1639.449 16.93433 522.6482       10.78187      525.7419       15.31918      519.6115       15.17753  1643.119 24.00702 1633.527 23.92472 9.592041       33.89291 
1 1 1 5   5  21 o 708.5443 21.85962 97.72674       6.015027      102.5451       7.325469      87.75461       10.53848  725.4272 26.00241 668.1456 40.80997 57.28168       48.38987 
1 1 1 5   5  22 o 385.2149 33.56391 29.22394       4.970982      34.56416       6.161142      19.26392       8.414180  418.3557 38.34847 304.3774 72.26189 113.9783       81.80701 
1 1 1 5   5  23 o 290.9940 45.79060 17.05988       5.003755      15.46230       6.129728      20.25064       8.662786  273.9220 59.33771 311.4841 72.90338 -37.56210      93.99929 
1 1 1 5   5  24 o 625.2498 22.53483 76.18854       5.471869      81.77932       7.644072      70.31305       7.836291  646.8150 30.43103 598.3562 33.86162 48.45880       45.52644 
1 1 1 5   5  25 o 918.4996 18.93428 164.2816       6.753918      174.3660       9.540204      154.1493       9.562799  945.0865 25.99310 888.2854 27.72072 56.80109       38.00105 
1 1 1 5   5  26 o 618.4851 24.03959 74.67999       5.774100      81.91499       7.999867      66.81193       8.342529  646.4341 31.86622 581.6965 37.12315 64.73761       48.92427 
1 1 1 5   5  27 o 287.8036 46.65278 16.87820       5.035866      21.77606       6.890813      11.26380       7.377667  324.6321 56.72232 233.4224 73.16356 91.20969       92.57607 
1 1 1 5   5  28 o 331.1469 49.04881 22.44720       6.117027      17.05669       7.058342      38.71066       12.26011  282.6330 65.57410 423.5854 77.38042 -140.9525      101.4283 
1 1 1 5   5  29 o 491.9465 30.03975 47.90077       5.711576      60.96567       7.911088      33.67651       8.254637  552.5931 37.07892 403.2878 54.06659 149.3053       65.55946 
1 1 1 5   5  30 o 366.5866 47.65998 27.74851       6.624645      19.79417       7.725241      49.85159       12.87764  299.7286 67.93653 477.5300 71.65063 -177.8014      98.73796 
1 1 1 5   5  31 o 127.3397 56.34991 -0.8865744     5.504029      1.854325       7.696206      -3.756014      7.874604  162.8930 69.35033 139.4305 63.97578 23.46259       94.35236 
1 1 1 5   5  32 o 430.5542 40.27571 38.05400       6.656165      48.13176       11.35079      32.77234       8.217309  466.5357 64.36266 389.8611 55.87135 76.67468       85.23003 
1 1 1 5   6  0  o 1606.418 14.74321 501.6010       9.197686      508.3947       10.90398      484.8446       17.12462  1616.942 17.36452 1577.273 27.95671 39.66858       32.91055 
1 1 1 5   6  1  o 884.7238 12.40683 152.0984       4.262815      149.2818       5.972177      155.0238       6.086512  876.1796 17.55139 892.8712 17.55301 -16.69153      24.82256 
1 1 1 5   6  2  o 635.5693 12.47222 78.49430       3.078468      77.59383       4.273808      79.46532       4.438060  631.6959 17.42124 639.2446 17.87714 -7.548645      24.96181 
1 1 1 5   6  3  o 980.1851 17.15076 186.8172       6.528592      186.8172       6.528592      0.000000       0.000000  980.1851 17.15076 ?        ?        0.000000       17.15076 
1 1 1 5   6  4  o 561.2513 11.98841 61.20928       2.613046      61.53461       3.660309      60.87117       3.731531  562.5529 16.75430 559.4926 17.17373 3.060242       23.99257 
1 1 1 5   6  5  o 1079.825 12.53497 226.5972       5.256595      233.9447       11.83404      224.7911       5.867185  1095.463 27.81680 1075.402 14.04853 20.06104       31.16305 
1 1 1 5   6  6  o 1744.853 15.55980 591.9551       10.54365      607.3829       15.42947      578.4398       14.44145  1766.176 22.49516 1723.772 21.57263 42.40430       31.16746 
1 1 1 5   6  7  o 259.7339 19.13771 13.19895       1.916799      13.64237       2.840622      12.82826       2.597226  262.9433 28.26141 255.1272 26.60487 7.816116       38.81400 
1 1 1 5   6  8  o 83.77369 34.39882 0.4413337      1.793481      2.409942       2.428040      -1.922469      2.660614  118.7949 42.07023 81.02301 37.18029 37.77193       56.14515 
1 1 1 5   6  9  o 278.2141 20.95887 15.16483       2.247882      16.17722       2.923278      13.70014       3.516174  286.6621 26.56038 262.0591 35.46031 24.60300       44.30448 
1 1 1 5   6  10 o 420.1862 15.50541 34.35571       2.530189      34.52728       3.550223      34.17862       3.606905  420.2392 21.82876 418.0442 22.29749 2.195038       31.20373 
1 1 1 5   6  11 o 424.9077 16.19014 35.14947       2.671610      38.41712       3.747000      31.77057       3.810249  443.7558 21.74261 402.5643 24.48831 41.19150       32.74780 
1 1 1 5   6  12 o 236.3839 26.20525 11.06035       2.365179      10.08355       3.302737      12.08864       3.388654  222.8551 39.61276 245.1731 36.71996 -22.31801      54.01413 
1 1 1 5   6  13 o 687.9116 16.09628 92.14170       4.300175      88.39046       6.912554      94.50980       5.492258  672.1921 26.47995 696.1296 20.31575 -23.93756      33.37540 
1 1 1 5   6  14 o 1063.803 19.91852 220.6096       8.228983      0.000000       0.000000      220.6096       8.228983  ?        ?        1063.803 19.91852 0.000000       19.91852 
1 1 1 5   6  15 o 115.0605 43.79488 1.848476       2.709464      4.413356       3.819286      -0.7501917     3.844359  154.7878 52.88924 109.1861 47.74507 45.60168       71.25211 
1 1 1 5   6  16 o 228.1131 36.10303 10.44538       3.091849      13.87896       4.222355      6.475811       4.539969  262.2739 42.94098 181.4909 57.46154 80.78299       71.73392 
1 1 1 5   6  17 f 740.5205 16.14174 106.6592       4.642110      106.8914       6.463167      106.4117       6.671666  740.7466 22.46714 738.9986 23.24677 1.747986       32.32932 
1 1 1 5   6  18 o 1314.224 15.54981 335.8358       7.936376      337.0230       11.25933      334.6635       11.18847  1315.643 22.03670 1311.040 21.97488 4.603271       31.12091 
1 1 1 5   6  19 o 400.6817 38.30179 31.68576       5.887396      26.01431       8.232840      37.62149       8.422471  357.8482 61.45504 434.4861 50.87892 -76.63788      79.78337 
1 1 1 5   6  20 f 711.2393 26.28431 98.56470       7.260060      0.000000       0.000000      98.56470       7.260060  ?        ?        711.2393 26.28431 0.000000       26.28431 
1 1 1 5   6  21 o 547.9901 21.67086 58.45816       4.611868      51.13528       6.189240      67.60001       6.915331  510.8668 31.34770 587.7878 30.39854 -76.92096      43.66634 
1 1 1 5   6  22 o 303.8844 36.76888 18.33881       4.250991      15.78738       5.737650      21.44369       6.329442  277.8718 55.11562 325.8034 51.75509 -47.93161      75.60635 
1 1 1 5   6  23 o 1033.396 20.29765 207.9505       8.145932      214.8806       10.00026      194.2844       14.04321  1049.792 24.52900 995.7736 36.31430 54.01880       43.82237 
1 1 1 5   6  24 o 585.7437 32.26843 67.32919       7.311978      67.32919       7.311978      0.000000       0.000000  585.7437 32.26843 ?        ?        0.000000       32.26843 
1 1 1 5   6  25 o 368.3299 35.32798 26.84946       4.991405      23.30160       6.770258      31.07424       7.387946  338.6984 53.22676 393.2061 49.47655 -54.50775      72.67061 
1 1 1 5   6  26 o 454.2212 30.53295 40.60833       5.354681      35.63006       7.319020      46.34191       7.854646  421.8005 45.39529 482.5145 42.34493 -60.71396      62.07919 
1 1 1 5   6  27 o 873.9456 23.23194 149.2892       7.884928      148.4198       9.269759      151.5646       14.99603  870.2723 27.42744 871.9545 44.43209 -1.682190      52.21566 
1 1 1 5   6  28 o 124.2542 54.75780 -1.073956      5.145040      -2.802422      6.667654      1.469941       8.088954  133.8815 60.42160 168.9114 71.46974 -35.02983      93.58789 
1 1 1 5   6  29 o 640.6260 25.21938 80.61269       6.274324      79.49778       8.403760      82.01694       9.431345  632.2230 34.35651 640.4670 38.09005 -8.244019      51.29544 
1 1 1 5   6  30 o 203.6607 62.71729 8.884474       5.448413      -1.234618      7.416702      20.74705       8.030258  146.6899 65.13767 305.7990 69.22971 -159.1091      95.05613 
1 1 1 5   6  31 o 487.4443 37.30891 48.13378       7.008989      51.79913       11.46957      45.94920       8.854677  489.0245 61.77110 469.0515 49.35010 19.97308       79.06390 
1 1 1 5   6  32 o 315.9041 57.96439 21.87400       6.849165      26.29086       8.578550      14.10804       11.37509  340.7500 67.21394 244.3275 90.41769 96.42250       112.6635 
1 1 1 5   7  0  o 1143.127 13.21568 253.9575       5.866943      253.0720       8.262395      254.8580       8.332269  1140.645 18.65209 1144.653 18.74396 -4.008301      26.44308 
1 1 1 5   7  1  o 412.6694 14.87389 33.10375       2.383717      32.40723       3.370509      33.80075       3.371662  407.5116 21.37196 416.7723 20.83134 -9.260681      29.84469 
1 1 1 5   7  2  o 377.1830 15.08218 27.65640       2.209247      26.32826       3.055408      29.11156       3.198174  367.1728 21.52147 386.1663 21.40933 -18.99350      30.35677 
1 1 1 5   7  3  o 834.4007 17.12978 135.3944       5.550784      0.000000       0.000000      135.3944       5.550784  ?        ?        834.4007 17.12978 0.000000       17.12978 
1 1 1 5   7  4  o 232.0460 23.88788 10.59737       2.121921      2.466687       5.186686      12.23175       2.325430  150.4578 59.64507 249.4181 24.31682 -98.96022      64.41150 
1 1 1 5   7  5  f 612.7879 21.34270 73.10102       5.079110      77.82419       7.304072      68.67866       7.067652  631.5150 29.78197 592.3558 30.82957 39.15918       42.86523 
1 1 1 5   7  6  o 1062.906 17.50465 219.7804       7.225639      239.6909       12.28910      209.2603       8.932874  1108.313 28.55155 1036.575 22.19025 71.73755       36.16073 
1 1 1 5   7  7  o 926.9686 13.81646 167.0612       4.973817      173.5445       6.557798      158.2804       7.631813  944.3828 17.88060 901.4329 21.80049 42.94983       28.19534 
1 1 1 5   7  8  o 631.0687 12.62044 77.42237       3.092993      72.66475       4.301232      82.51688       4.450913  610.9866 18.12730 651.1357 17.60150 -40.14911      25.26681 
1 1 1 5   7  9  o 603.1183 12.90625 70.73319       3.022947      70.82091       4.275854      70.64554       4.274333  603.0615 18.25716 602.3129 18.27335 0.7486572      25.83097 
1 1 1 5   7  10 o 201.3603 26.44809 8.059508       2.018189      7.610485       2.767067      8.569868       2.950011  193.3538 38.20493 205.4285 38.38882 -12.07477      54.16012 
1 1 1 5   7  11 o 693.2733 13.48431 93.50497       3.630455      95.32182       5.139035      91.69491       5.129456  699.3311 18.92216 685.8516 19.25809 13.47949       26.99856 
1 1 1 5   7  12 o 692.9555 19.90294 93.63924       5.356122      0.000000       0.000000      93.63924       5.356122  ?        ?        692.9555 19.90294 0.000000       19.90294 
1 1 1 5   7  13 o 969.2885 15.63591 182.8957       5.885784      182.2036       9.631115      183.3082       7.435895  965.3813 25.68915 969.6519 19.74647 -4.270569      32.40147 
1 1 1 5   7  14 o 213.0550 33.26803 9.112008       2.662654      9.052464       3.600314      9.183893       3.955874  209.9779 45.46771 210.9895 49.18590 -1.011566      66.98183 
1 1 1 5   7  15 o 272.7299 28.04616 14.68689       2.928201      14.92117       4.091339      14.44085       4.192725  272.6874 39.80736 267.7720 41.67374 4.915436       57.63095 
1 1 1 5   7  16 o 159.0841 45.76908 5.099332       2.979597      4.178062       4.185338      6.046084       4.242825  155.4904 55.21659 175.6435 55.54278 -20.15308      78.31905 
1 1 1 5   7  17 o 458.6058 20.79450 40.94655       3.703532      42.78400       5.099637      38.89590       5.387370  467.4269 28.22536 445.1476 31.36394 22.27930       42.19440 
1 1 1 5   7  18 o 708.1932 19.77508 97.59198       5.438736      97.67479       6.492297      97.39711       9.959274  708.1777 23.60631 704.7811 36.51213 3.396606       43.47865 
1 1 1 5   7  19 o 587.6882 19.36871 67.18980       4.420543      68.56046       6.250894      65.81852       6.252290  593.1196 27.13763 581.0933 27.70545 12.02631       38.78199 
1 1 1 5   7  20 o 1109.740 18.85710 239.5657       8.126886      236.9776       14.16631      240.8353       9.921949  1101.662 33.11162 1112.192 22.97150 -10.53003      40.29974 
1 1 1 5   7  21 o 247.4480 57.32003 12.58373       5.400179      12.58373       5.400179      0.000000       0.000000  247.4480 57.32003 ?        ?        0.000000       57.32003 
1 1 1 5   7  22 o 120.2043 51.05668 0.1369241      4.153737      0.7592599      5.618536      -0.6131930     6.168440  142.9876 59.98099 141.2475 61.13313 1.740097       85.64449 
1 1 1 5   7  23 o 403.9589 34.86918 32.18844       5.416636      33.79617       6.434174      28.27665       10.03629  412.8722 40.65558 368.9796 72.62531 43.89258       83.23048 
1 1 1 5   7  24 o 168.1424 62.14688 4.521736       5.370558      6.712895       6.454650      -0.4081590     9.681767  193.9768 68.60445 177.5821 76.72421 16.39464       102.9231 
1 1 1 5   7  25 o 634.1339 23.55383 78.45528       5.800569      80.89441       7.962630      75.69733       8.467077  642.6464 31.90483 620.0873 35.30637 22.55908       47.58632 
1 1 1 5   7  26 o 282.5219 56.17295 16.52647       5.946191      19.36517       6.909735      8.423903       11.67382  305.1537 60.44388 233.2842 90.36227 71.86942       108.7143 
1 1 1 5   7  27 o 455.4444 36.44702 41.21592       6.392513      47.84139       7.426934      22.27624       12.55704  490.0070 39.36041 316.7084 94.73903 173.2986       102.5901 
1 1 1 5   7  28 o 435.1171 33.15358 37.60251       5.560115      29.84193       7.434737      47.45117       8.375426  381.1414 51.55144 484.8049 44.99791 -103.6634      68.42780 
1 1 1 5   7  29 o 153.3893 60.73639 3.110655       5.372423      2.024518       7.331165      4.370512       7.895712  163.6136 68.56831 181.7135 73.06717 -18.09981      100.2019 
1 1 1 5   7  30 o 209.8121 67.60773 9.481528       6.263695      7.047449       10.12586      10.99021       7.971929  207.3300 82.96452 225.0609 76.41373 -17.73093      112.7926 
1 1 1 5   7  31 f 280.3889 59.14468 17.26597       6.237661      26.37016       10.56438      12.39333       7.728683  332.3352 82.28866 232.9752 75.10179 99.36000       111.4078 
1 1 1 5   8  0  o 1179.591 13.40083 270.4484       6.138910      277.2014       8.849107      264.1831       8.523505  1193.630 19.08982 1165.295 18.83451 28.33496       26.81716 
1 1 1 5   8  1  o 530.7471 19.24979 54.80845       3.967725      54.80845       3.967725      0.000000       0.000000  530.7471 19.24979 ?        ?        0.000000       19.24979 
1 1 1 5   8  2  o 606.2078 12.86948 71.42299       3.029776      76.79433       4.400132      66.58030       4.177994  628.3130 18.03274 585.0175 18.38955 43.29553       25.75568 
1 1 1 5   8  3  o 304.1207 16.16663 18.03659       1.902527      15.93736       2.703420      20.09640       2.677919  284.9419 24.67386 320.5573 21.63781 -35.61542      32.81759 
1 1 1 5   8  4  o 283.9192 55.32085 16.45867       5.880480      16.45867       5.880480      0.000000       0.000000  283.9192 55.32085 ?        ?        0.000000       55.32085 
1 1 1 5   8  5  o 374.9212 42.40225 27.94294       6.065342      27.94294       6.065342      0.000000       0.000000  374.9212 42.40225 ?        ?        0.000000       42.40225 
1 1 1 5   8  6  f 846.1256 28.72346 139.7978       9.438426      139.7978       9.438426      0.000000       0.000000  846.1256 28.72346 ?        ?        0.000000       28.72346 
1 1 1 5   8  7  o 1166.580 15.62022 264.7461       7.076682      264.6331       8.412423      265.0194       13.08809  1165.884 18.57966 1164.569 28.93898 1.315186       34.38995 
1 1 1 5   8  8  o 301.8173 21.49784 17.84748       2.503337      17.81324       2.757914      18.00767       5.965490  301.2252 23.76864 296.5914 53.77173 4.633789       58.79070 
1 1 1 5   8  9  o 337.8798 16.20205 22.22338       2.125984      25.49909       2.954717      18.70707       3.061306  360.9944 21.16854 308.3491 25.80157 52.64526       33.37406 
1 1 1 5   8  10 o 785.8458 12.87000 120.1218       3.927749      116.6939       5.474258      123.7588       5.638746  773.8832 18.21469 796.9645 18.21862 -23.08130      25.76225 
1 1 1 5   8  11 o 1017.688 18.87029 201.8828       7.457978      0.000000       0.000000      201.8828       7.457978  ?        ?        1017.688 18.87029 0.000000       18.87029 
1 1 1 5   8  12 o 604.8239 15.86643 71.22252       3.726800      68.25491       5.740658      73.38432       4.899668  590.9181 25.01534 613.3771 20.56890 -22.45898      32.38591 
1 1 1 5   8  13 o 657.1406 14.42214 84.02468       3.680577      79.30013       5.041480      89.41663       5.385808  637.7495 20.35541 677.1913 20.47913 -39.44189      28.87451 
1 1 1 5   8  14 o 312.7456 24.36358 19.20469       2.935756      19.41440       4.076359      18.97869       4.231561  312.8185 34.10733 308.8806 35.94865 3.937958       49.55417 
1 1 1 5   8  15 f 937.9422 14.48945 171.0951       5.277835      169.4664       7.369032      172.8104       7.562708  932.7515 20.34307 941.8609 20.67581 -9.109436      29.00569 
1 1 1 5   8  16 o 667.5884 19.07373 86.74528       4.945069      83.72286       5.822075      94.57227       9.369116  655.5154 22.87004 695.1562 34.70469 -39.64081      41.56266 
1 1 1 5   8  17 o 1680.266 16.46376 549.0734       10.74324      545.2568       14.99685      553.0966       15.39754  1673.159 23.07994 1685.044 23.52946 -11.88452      32.95936 
1 1 1 5   8  18 f 205.2847 44.33719 8.578882       3.431333      11.30633       4.642608      5.295253       5.094022  235.1628 52.19746 173.6540 60.99158 61.50880       80.27794 
1 1 1 5   8  19 o 473.5900 22.28255 43.65912       4.098221      46.66536       5.704809      40.45322       5.891206  488.1938 30.23874 453.9282 33.65842 34.26556       45.24678 
1 1 1 5   8  20 o 817.4827 20.64596 130.0561       6.554531      110.6389       11.05103      140.5938       8.141085  751.0403 38.01262 849.5474 24.67554 -98.50708      45.31933 
1 1 1 5   8  21 o 796.1287 21.40430 123.4132       6.617779      130.7837       11.72814      119.9702       8.015780  817.3334 36.94894 784.3932 26.31383 32.94019       45.36123 
1 1 1 5   8  22 o 1249.948 16.76538 303.9488       8.138291      295.4035       11.11014      313.8429       11.95479  1231.184 23.23638 1268.822 24.26126 -37.63757      33.59372 
1 1 1 5   8  23 o 598.5665 22.88755 69.83207       5.320344      67.04369       7.291195      73.00757       7.780859  584.5469 32.24290 609.9266 32.97145 -25.37970      46.11639 
1 1 1 5   8  24 o 105.7142 49.58369 -5.153015      5.143661      -0.5076672     6.197415      -15.43718      9.221168  141.7923 61.32279 124.2002 60.36652 17.59207       86.05000 
1 1 1 5   8  25 o 395.2035 40.27217 31.08011       6.094563      36.17818       7.104849      16.87999       11.85763  425.8609 43.57314 285.6824 93.10022 140.1786       102.7924 
1 1 1 5   8  26 o 305.1263 51.81291 19.09088       5.920094      15.50433       6.819262      30.06439       11.92812  270.9604 65.52318 372.3686 84.42979 -101.4081      106.8722 
1 1 1 5   8  27 o 367.6459 61.73121 28.24543       8.501393      0.000000       0.000000      28.24543       8.501393  ?        ?        367.6459 61.73121 0.000000       61.73121 
1 1 1 5   8  28 o 409.6407 49.48933 34.33741       7.713461      34.33741       7.713461      0.000000       0.000000  409.6407 49.48933 ?        ?        0.000000       49.48933 
1 1 1 5   8  29 o 204.6183 67.16290 8.758039       6.166893      12.64690       9.497333      5.923096       8.108917  242.1267 83.37852 192.0410 75.05305 50.08569       112.1826 
1 1 1 5   8  30 o 329.5414 54.98594 23.14056       6.789069      35.34354       11.06026      15.76297       8.599833  395.6819 74.71526 261.4848 78.44400 134.1971       108.3320 
1 1 1 5   8  31 o 646.2131 27.03250 82.83058       6.784063      90.94309       10.06029      76.06496       9.187266  668.6424 38.91080 611.3457 38.89874 57.29669       55.01965 
1 1 1 5   9  0  o 987.8398 13.17548 189.6843       5.054532      196.0137       7.292208      183.8315       7.012376  1003.645 18.70901 971.9714 18.57735 31.67389       26.36560 
1 1 1 5   9  1  o 154.9889 32.97884 4.872599       1.924040      4.305472       2.686171      5.470127       2.757227  147.1003 43.77603 163.9304 42.83554 -16.83012      61.24724 
1 1 1 5   9  2  o 1104.959 14.59168 237.3942       6.261519      235.8333       7.860783      240.1038       10.35697  1100.890 18.38629 1109.982 24.02640 -9.092529      30.25432 
1 1 1 5   9  3  o 394.1414 15.33288 30.21078       2.346951      30.29368       3.125849      30.10366       3.553257  393.9163 20.50403 392.3523 23.42662 1.564026       31.13233 
1 1 1 5   9  4  o 1217.814 29.45394 289.6721       13.93004      289.6721       13.93004      0.000000       0.000000  1217.814 29.45394 ?        ?        0.000000       29.45394 
1 1 1 5   9  5  o 1283.167 16.05432 320.3154       8.000239      317.9990       9.377077      326.5121       15.33691  1278.058 18.89247 1292.351 30.55831 -14.29211      35.92682 
1 1 1 5   9  6  o 161.3707 53.87379 4.909757       3.961898      7.808890       5.604704      2.014210       5.601237  199.1553 63.92931 150.7919 61.22159 48.36343       88.51575 
1 1 1 5   9  7  o 730.4243 21.81219 104.0330       6.187316      105.5714       8.794937      102.5256       8.706112  734.2696 30.84247 723.5728 30.98233 10.69684       43.71685 
1 1 1 5   9  8  o 1508.666 31.67023 446.2615       18.55548      0.000000       0.000000      446.2615       18.55548  ?        ?        1508.666 31.67023 0.000000       31.67023 
1 1 1 5   9  9  o 1212.865 21.20437 286.9902       9.987705      273.5780       13.73856      302.0240       14.54545  1181.430 29.94370 1241.243 30.17466 -59.81311      42.51041 
1 1 1 5   9  10 o 479.2270 15.48113 44.71094       2.881189      45.05866       4.379898      44.44569       3.825396  480.2734 23.48267 477.3203 20.63662 2.953033       31.26189 
1 1 1 5   9  11 o 1036.644 14.81482 209.1631       5.964225      206.2998       9.501508      211.0248       7.661721  1027.604 23.80886 1040.463 18.96145 -12.85889      30.43679 
1 1 1 5   9  12 o 607.6031 14.33674 71.83687       3.382971      75.36314       4.710306      68.08015       4.861775  621.7840 19.50660 590.7710 21.19082 31.01300       28.80206 
1 1 1 5   9  13 o 1371.569 14.74401 366.0156       7.853464      375.0676       11.33266      357.6518       10.89331  1386.995 21.03919 1354.496 20.70878 32.49890       29.52120 
1 1 1 5   9  14 o 191.2897 37.52221 7.428223       2.687871      9.936162       3.620932      4.350168       4.011438  220.7885 43.77598 155.6770 54.15496 65.11151       69.63545 
1 1 1 5   9  15 f 444.4533 23.00469 38.60005       3.957132      35.57718       4.586333      47.40564       7.827707  426.0007 27.87589 489.4816 41.57177 -63.48087      50.05274 
1 1 1 5   9  16 o 119.9004 45.68975 1.974779       2.951130      5.786981       4.101780      -2.116331      4.249178  172.3303 54.62422 107.2907 48.34496 65.03958       72.94546 
1 1 1 5   9  17 o 691.3788 16.45930 92.95346       4.419318      91.19327       6.147403      94.83609       6.357616  684.3138 23.13174 697.8192 23.45975 -13.50531      32.94598 
1 1 1 5   9  18 o 1047.194 15.42179 213.1914       6.271765      215.8537       8.797309      210.4397       8.943734  1053.119 21.51019 1039.756 22.14928 13.36340       30.87522 
1 1 1 5   9  19 o 1036.416 15.87419 208.8439       6.389307      215.3483       9.050582      202.3818       9.021180  1051.795 22.15732 1019.566 22.78349 32.22949       31.78103 
1 1 1 5   9  20 o 346.4405 30.35137 23.60254       4.042342      22.98195       5.546250      24.30576       5.903974  339.6500 43.01129 349.1253 44.56102 -9.475311      61.93267 
1 1 1 5   9  21 o 432.9870 32.21449 36.84252       5.378168      27.59489       9.383765      41.36616       6.563057  366.0768 68.52361 458.0685 37.21507 -91.99179      77.97722 
1 1 1 5   9  22 o 633.5676 21.29260 78.19022       5.239016      79.46571       7.148404      76.71010       7.700540  637.8752 28.85662 625.5414 31.80311 12.33380       42.94347 
1 1 1 5   9  23 o 882.0883 18.60643 151.4725       6.373869      154.0315       8.796596      148.6439       9.248390  888.5125 25.49313 872.5297 27.29342 15.98279       37.34742 
1 1 1 5   9  24 o 400.3221 33.55084 31.62171       5.167938      43.60630       6.904300      16.35203       7.793328  469.5697 38.19188 279.1256 71.55868 190.4441       81.11266 
1 1 1 5   9  25 o 850.7162 26.83366 141.5294       8.865285      141.5294       8.865285      0.000000       0.000000  850.7162 26.83366 ?        ?        0.000000       26.83366 
1 1 1 5   9  26 o 526.6976 27.60487 54.51004       5.626794      51.11062       7.427822      59.08770       8.619464  507.2729 37.98003 544.6323 41.05384 -37.35944      55.92764 
1 1 1 5   9  27 o 329.4108 43.34573 21.99138       5.410485      18.73292       7.070418      26.59551       8.404520  296.9825 63.24197 355.3120 63.22537 -58.32950      89.42591 
1 1 1 5   9  28 o 433.8053 34.20427 37.51780       5.715650      38.25963       7.705628      36.61042       8.522217  433.4326 46.50489 420.8699 53.33755 12.56271       70.76440 
1 1 1 5   9  29 o 155.4507 63.72451 2.539768       6.142183      -2.016469      9.573874      5.726899       8.007272  162.9467 73.06613 189.4500 74.42339 -26.50327      104.2953 
1 1 1 5   9  30 o 376.4545 41.51163 29.06813       5.967990      23.29981       8.425675      34.87589       8.454422  321.7213 69.46999 404.9885 55.19157 -83.26718      88.72536 
1 1 1 5   9  31 o 141.2948 59.61357 1.494272       5.601951      -8.716469      8.422588      9.594550       7.501824  127.4089 60.83240 209.4982 73.97475 -82.08930      95.77496 
1 1 1 5   10 0  o 282.8245 23.19147 15.69490       2.524850      17.26753       3.280360      13.40910       3.954831  295.9439 28.91125 258.2287 40.79086 37.71524       49.99754 
1 1 1 5   10 1  o 1236.755 15.36530 297.5077       7.379936      298.1829       9.262818      296.3341       12.21157  1237.559 19.27299 1232.489 25.51295 5.070679       31.97435 
1 1 1 5   10 2  o 759.3181 14.16266 112.1200       4.176346      106.7397       5.236503      121.5240       6.922968  740.5205 18.20859 789.6282 22.57572 -49.10773      29.00372 
1 1 1 5   10 3  o 486.9621 14.62837 46.12072       2.766426      47.18636       3.691122      44.75493       4.178728  492.2584 19.30800 479.1687 22.45575 13.08963       29.61519 
1 1 1 5   10 4  o 571.8146 15.58066 63.61479       3.459944      68.53342       7.531148      62.29890       3.895367  590.6093 32.96623 565.7065 17.73083 24.90271       37.43200 
1 1 1 5   10 5  o 1041.922 20.77563 211.5941       8.406539      217.6709       12.20203      206.1037       11.59822  1054.686 29.79071 1026.463 29.09513 28.22351       41.64148 
1 1 1 5   10 6  o 1150.715 20.91333 258.1738       9.345851      247.2435       12.76933      270.7836       13.71539  1123.897 29.25590 1175.932 30.03295 -52.03467      41.92715 
1 1 1 5   10 7  o 938.7509 21.12185 171.8914       7.700346      174.0938       11.07796      169.8325       10.71117  942.5184 30.26509 931.0915 29.62216 11.42688       42.34911 
1 1 1 5   10 8  o 1538.562 32.11132 464.7263       19.18674      0.000000       0.000000      464.7263       19.18674  ?        ?        1538.562 32.11132 0.000000       32.11132 
1 1 1 5   10 9  o 1340.445 19.55886 350.3678       10.18170      356.0558       13.36782      342.5091       15.71301  1349.296 25.51087 1321.306 30.62160 27.99023       39.85582 
1 1 1 5   10 10 o 794.2465 12.71964 122.7083       3.923360      133.0491       5.780833      113.8778       5.342045  826.3040 18.01451 764.4609 17.99386 61.84308       25.46177 
1 1 1 5   10 11 o 254.4309 22.33087 12.73042       2.184183      13.07279       2.922152      12.29700       3.287896  256.6004 29.88334 247.7040 35.16622 8.896469       46.14842 
1 1 1 5   10 12 o 475.7909 15.84106 44.06176       2.927039      48.83371       4.130483      39.24812       4.148491  500.4182 21.25395 447.7390 23.94494 52.67920       32.01704 
1 1 1 5   10 13 o 1039.804 16.47725 210.4198       6.653713      220.7798       8.074810      188.5067       11.74370  1064.605 19.53061 981.3994 30.81280 83.20569       36.48114 
1 1 1 5   10 14 o 707.9177 14.79996 97.46545       4.068847      100.1034       5.648378      94.62007       5.866240  716.9360 20.28688 696.8774 21.67581 20.05853       29.68836 
1 1 1 5   10 15 o 570.4963 16.72588 63.31050       3.705696      64.82485       5.133732      61.66309       5.354529  576.8298 22.91699 562.4518 24.51365 14.37793       33.55752 
1 1 1 5   10 16 o 416.8770 21.11827 33.91659       3.407803      32.46242       4.705458      35.52061       4.941959  406.7528 29.99987 425.5664 30.09634 -18.81357      42.49450 
1 1 1 5   10 17 o 271.0589 31.69536 14.53272       3.273470      11.57592       4.397300      18.20809       4.902581  238.4341 49.12322 301.8433 43.04212 -63.40915      65.31244 
1 1 1 5   10 18 o 1522.803 16.12657 450.8698       9.537043      446.8123       13.24173      455.2431       13.74730  1515.000 22.50630 1529.115 23.14991 -14.11414      32.28703 
1 1 1 5   10 19 o 850.6408 16.37408 140.7048       5.409178      138.9500       7.461576      142.6485       7.852881  844.7612 22.74409 855.8372 23.62707 -11.07599      32.79531 
1 1 1 5   10 20 o 983.5396 16.36452 188.1407       6.250618      194.3412       8.787538      181.7907       8.892819  998.8774 22.65307 965.9439 23.70607 32.93353       32.78932 
1 1 1 5   10 21 o 882.4041 20.79149 151.6315       7.124938      147.3626       12.42773      153.7216       8.695962  867.2051 36.90133 887.8606 25.21999 -20.65546      44.69626 
1 1 1 5   10 22 f 283.3776 50.78168 16.33669       5.383296      19.87915       9.275831      14.53757       6.610446  307.5643 77.64744 264.5498 64.84485 43.01447       101.1631 
1 1 1 5   10 23 o 859.8597 18.66770 143.9535       6.233706      148.9855       8.579862      138.3273       9.072320  873.7797 25.28427 841.5199 27.76042 32.25977       37.54910 
1 1 1 5   10 24 o 653.0263 25.29782 83.27541       6.415666      85.18571       7.700539      78.94025       11.60042  659.7083 30.05670 629.5522 47.80459 30.15607       56.46843 
1 1 1 5   10 25 o 451.4206 34.52901 40.30273       6.007411      45.30361       7.134357      28.11666       11.13688  477.6626 38.79487 361.5340 81.29417 116.1286       90.07655 
1 1 1 5   10 26 o 333.8010 45.85166 22.60932       5.786897      20.72174       6.835063      27.38725       10.87451  315.4119 57.93525 354.5212 80.78471 -39.10925      99.41158 
1 1 1 5   10 27 o 498.5603 29.68118 49.10537       5.720810      55.41224       7.618275      40.95029       8.662919  527.1222 37.45881 447.6780 50.72279 79.44418       63.05524 
1 1 1 5   10 28 f 440.8082 38.56857 39.07591       6.536096      41.11438       9.940501      37.52341       8.675057  442.3148 59.36799 425.1815 53.73748 17.13327       80.07668 
1 1 1 5   10 29 o 111.0488 51.92484 -4.654579      5.566634      -6.703801      7.700758      -2.411890      8.056076  128.0651 60.25872 147.3379 66.46218 -19.27280      89.71252 
1 1 1 5   10 30 o 306.4769 51.45880 20.00087       5.907632      25.07835       8.572134      15.40786       8.152927  333.6954 68.44350 257.1562 76.20536 76.53928       102.4293 
1 1 1 5   11 0  o 1103.736 15.36772 237.0330       6.587226      242.7702       8.454977      228.1722       10.50751  1116.323 19.50269 1081.102 25.02680 35.22156       31.72846 
1 1 1 5   11 1  o 530.9745 16.07788 54.86807       3.315357      54.18824       4.292169      55.87362       5.220114  527.2615 20.96152 534.9539 25.12671 -7.692444      32.72212 
1 1 1 5   11 2  o 471.1996 15.14659 43.20116       2.771711      47.93095       3.968289      38.69572       3.873029  495.8936 20.60567 444.8443 22.49195 51.04929       30.50380 
1 1 1 5   11 3  o 232.3183 22.32485 10.62407       1.989385      7.276927       2.819894      13.94062       2.806980  188.7743 39.72239 265.6054 27.61668 -76.83109      48.37922 
1 1 1 5   11 4  o 194.0367 22.41083 7.442672       1.657704      4.196142       2.411710      10.35022       2.282331  144.0481 41.09425 228.6573 26.17338 -84.60919      48.72149 
1 1 1 5   11 5  o 426.1710 29.83773 35.75492       4.907147      34.77348       7.011276      36.69731       6.870378  416.9321 43.96442 429.0222 41.76518 -12.09015      60.63993 
1 1 1 5   11 6  o 280.6568 41.29427 15.88581       4.366292      14.83848       6.128605      16.96538       6.222198  266.2874 60.62268 285.7407 58.05189 -19.45322      83.93528 
1 1 1 5   11 7  o 627.6732 33.37134 77.65223       8.105356      0.000000       0.000000      77.65223       8.105356  ?        ?        627.6732 33.37134 0.000000       33.37134 
1 1 1 5   11 8  o 542.2620 37.00106 58.22802       7.745512      0.000000       0.000000      58.22802       7.745512  ?        ?        542.2620 37.00106 0.000000       37.00106 
1 1 1 5   11 9  o 480.0964 15.99901 44.88202       2.982974      45.45616       3.237781      41.65905       7.671304  483.0466 17.25959 456.4413 43.81533 26.60526       47.09221 
1 1 1 5   11 10 o 428.4839 17.59027 35.76538       2.927082      34.00415       3.187333      45.24821       7.395860  417.6343 19.65184 477.1008 40.29322 -59.46649      44.83011 
1 1 1 5   11 11 o 474.5247 15.00916 43.81799       2.765943      43.56398       3.754115      44.11961       4.090804  472.7113 20.44954 475.5518 22.15047 -2.840485      30.14675 
1 1 1 5   11 12 o 1243.728 16.61697 301.0715       8.026116      303.3307       9.568053      295.7069       14.74387  1247.783 19.74497 1229.061 30.88943 18.72192       36.66090 
1 1 1 5   11 13 o 740.2382 14.11037 106.5583       4.056373      112.1358       5.702039      100.8436       5.771750  758.8675 19.34801 719.5041 20.65600 39.36340       28.30222 
1 1 1 5   11 14 o 363.4806 21.05339 25.81435       2.959154      26.65955       3.989129      24.78018       4.412589  368.5275 28.08420 354.5681 32.40359 13.95944       42.88024 
1 1 1 5   11 15 o 390.7039 20.83856 29.80037       3.150447      25.18891       4.193505      35.77545       4.773427  357.9228 30.45853 427.2199 28.94145 -69.29718      42.01583 
1 1 1 5   11 16 o 692.7413 15.93291 93.30849       4.286414      92.00467       5.901553      94.76431       6.236080  687.4595 22.10504 697.6177 23.01792 -10.15826      31.91328 
1 1 1 5   11 17 o 231.9270 37.08963 10.77450       3.228092      14.89073       4.473760      6.303609       4.662511  272.2876 43.79185 180.9603 58.33186 91.32727       72.94061 
1 1 1 5   11 18 o 1239.068 15.48982 298.4878       7.453657      305.8941       10.68232      291.4606       10.40526  1253.564 21.94276 1223.639 21.89636 29.92542       30.99895 
1 1 1 5   11 19 o 287.1599 35.14677 16.36132       3.837742      18.94668       5.222162      13.32547       5.658880  307.4352 45.07795 254.5436 58.47531 52.89163       73.83349 
1 1 1 5   11 20 o 412.5059 26.98783 33.33657       4.299574      35.30845       5.796797      30.92510       6.410437  423.2350 35.59843 394.5808 42.50421 28.65417       55.44236 
1 1 1 5   11 21 o 171.8815 55.67402 5.702363       4.243422      4.149657       5.775143      7.524314       6.255849  168.6506 63.99920 199.9381 67.69224 -31.28749      93.15652 
1 1 1 5   11 22 o 440.9102 33.36102 38.27190       5.670103      42.13403       9.560194      36.17615       7.042448  457.6831 54.88103 426.6169 43.09763 31.06613       69.78061 
1 1 1 5   11 23 o 321.9142 44.99674 20.83187       5.471584      23.80972       6.418298      12.91170       10.46731  343.4016 49.56170 256.9584 87.55874 86.44318       100.6126 
1 1 1 5   11 24 o 117.4565 52.21857 -1.586753      4.780174      5.684751       6.271973      -11.66429      7.383620  183.6048 67.27447 112.9524 54.69204 70.65237       86.70106 
1 1 1 5   11 25 o 309.6874 58.15484 19.92874       6.737345      19.92874       6.737345      0.000000       0.000000  309.6874 58.15484 ?        ?        0.000000       58.15484 
1 1 1 5   11 26 o 455.9758 34.46021 41.28090       6.057166      40.40982       7.144485      43.50734       11.42215  448.9193 41.44828 455.2398 66.57465 -6.320526      78.42285 
1 1 1 5   11 27 o 394.1477 41.00719 31.34106       6.185025      33.02751       9.048298      29.86196       8.473828  396.3543 60.71790 376.9111 59.89496 19.44315       85.28815 
1 1 1 5   11 28 o 131.8970 57.23196 -0.1395254     5.433947      -9.056439      7.274289      11.11848       8.173613  116.7983 55.97268 228.1791 77.37478 -111.3808      95.49763 
1 1 1 5   11 29 o 425.7090 36.57964 36.62418       5.988820      40.87325       8.369828      32.16656       8.572758  442.9883 49.49769 387.0936 58.88271 55.89465       76.92330 
1 1 1 5   11 30 o 104.5327 49.54990 -5.520862      5.387635      -5.299247      7.934752      -5.710430      7.338647  133.5098 62.28232 126.1621 59.19087 7.347618       85.92233 
1 1 1 5   12 0  o 666.1282 14.68571 86.35519       3.799100      85.81218       5.325584      86.91786       5.421169  663.3010 20.67420 667.5263 20.91205 -4.225342      29.40640 
1 1 1 5   12 1  o 115.9543 40.50059 2.373650       2.244693      3.695922       3.198839      1.090908       3.150660  141.6548 48.40301 113.1428 45.92295 28.51197       66.72157 
1 1 1 5   12 2  o 633.5594 13.90342 78.10168       3.420874      80.21786       4.869362      76.03941       4.806935  641.4460 19.54717 624.4811 19.82079 16.96490       27.83803 
1 1 1 5   12 3  o 243.0149 22.99681 11.63430       2.144534      12.78308       3.109240      10.59190       2.961789  253.1591 32.36605 229.6814 34.25206 23.47772       47.12500 
1 1 1 5   12 4  o 597.2981 16.50274 69.48456       3.828029      94.78101       8.884795      63.71828       4.241947  694.4919 32.94217 571.6850 19.10647 122.8069       38.08207 
1 1 1 5   12 5  o 405.8268 20.08270 32.12565       3.165124      0.000000       0.000000      32.12565       3.165124  ?        ?        405.8268 20.08270 0.000000       20.08270 
1 1 1 5   12 6  o 648.4635 34.51719 82.98526       8.661290      0.000000       0.000000      82.98526       8.661290  ?        ?        648.4635 34.51719 0.000000       34.51719 
1 1 1 5   12 7  o 794.9092 32.04089 124.1195       9.891224      0.000000       0.000000      124.1195       9.891224  ?        ?        794.9092 32.04089 0.000000       32.04089 
1 1 1 5   12 8  o 265.7156 46.24722 14.40731       4.598978      14.57547       6.350229      14.22181       6.669375  263.3131 62.95249 259.6293 66.00204 3.683838       91.21011 
1 1 1 5   12 9  o 528.5604 27.22635 54.80468       5.569729      51.93704       7.771888      57.83253       7.986052  511.6487 39.41708 540.3724 38.30312 -28.72372      54.96212 
1 1 1 5   12 10 o 518.3588 16.40841 52.30806       3.303125      53.80309       3.675711      46.03488       7.529417  525.5771 18.00848 481.5074 40.64512 44.06970       44.45595 
1 1 1 5   12 11 o 205.9251 33.63795 8.523278       2.597194      8.523278       2.597194      0.000000       0.000000  205.9251 33.63795 ?        ?        0.000000       33.63795 
1 1 1 5   12 12 o 958.1624 13.45704 178.5127       5.007452      185.2327       7.181577      172.1544       6.985698  975.3749 18.95921 940.2888 19.13025 35.08618       26.93358 
1 1 1 5   12 13 o 735.7662 14.18142 105.2591       4.052169      100.6726       5.500092      110.7041       5.992826  719.1108 19.69455 754.0106 20.46568 -34.89978      28.40281 
1 1 1 5   12 14 o 541.2326 16.53006 56.97389       3.474452      59.13503       4.762489      54.51487       5.080109  551.0365 22.25490 528.8890 24.73321 22.14746       33.27179 
1 1 1 5   12 15 o 300.3839 26.10289 17.71646       3.014768      15.28088       3.915699      21.26178       4.724285  277.0455 37.34560 327.5122 37.83988 -50.46671      53.16531 
1 1 1 5   12 16 o 1229.187 14.93893 293.7145       7.131244      295.9407       9.973774      291.3861       10.20024  1233.178 20.82599 1223.568 21.46617 9.609985       29.90850 
1 1 1 5   12 17 o 222.5047 39.74044 9.977321       3.307995      5.949852       4.396572      15.23210       5.021984  175.8444 56.63981 274.4285 48.91491 -98.58415      74.83807 
1 1 1 5   12 18 o 591.9851 18.93978 68.18401       4.354254      67.27877       5.936087      69.23840       6.406470  587.5253 26.01631 595.8728 27.68454 -8.347534      37.99055 
1 1 1 5   12 19 o 903.5253 16.21038 158.7782       5.688027      156.5897       7.731004      161.3609       8.398567  896.6340 22.20203 909.9878 23.76521 -13.35376      32.52254 
1 1 1 5   12 20 o 304.9243 35.45842 18.44865       4.120533      14.27209       5.419549      24.17079       6.343561  263.7574 54.70330 346.8621 48.41170 -83.10468      73.04891 
1 1 1 5   12 21 o 582.2852 21.99528 66.06803       4.973856      64.06831       6.544695      68.80220       7.652757  571.8484 29.57117 591.9376 33.42672 -20.08917      44.62959 
1 1 1 5   12 22 o 184.3475 70.41558 4.951395       7.019950      12.92458       9.751274      -3.626131      10.11408  255.1202 84.48996 168.1910 75.28078 86.92926       113.1625 
1 1 1 5   12 23 o 402.5754 47.45224 32.51846       7.276244      33.97786       9.968343      30.85412       10.64531  406.0565 65.43724 383.5622 74.14778 22.49426       98.89351 
1 1 1 5   12 24 o 1252.821 17.84747 305.8237       8.683479      304.4061       11.89778      307.4395       12.70224  1248.003 24.54835 1253.680 26.08950 -5.676636      35.82295 
1 1 1 5   12 25 f 386.7885 35.08473 29.74708       5.212764      33.54767       6.956844      24.88140       7.871525  408.1392 44.61782 345.2658 60.93283 62.87344       75.52191 
1 1 1 5   12 26 o 402.9367 45.03549 32.88869       6.926711      33.05039       8.999715      32.65370       10.84917  397.7579 60.13888 388.3414 74.64918 9.416473       95.86023 
1 1 1 5   12 27 o 431.6528 44.23156 37.85631       7.310013      45.50982       9.688922      27.74290       11.13766  468.7191 54.22876 349.8884 83.18587 118.8307       99.30079 
1 1 1 5   12 28 o 141.5972 58.97305 1.589581       5.374545      9.234887       7.392535      -6.982133      7.827621  210.6578 73.50320 128.6415 60.59767 82.01627       95.26173 
1 1 1 5   12 29 o 135.7417 58.17378 0.6707243      5.480433      -7.139654      7.599404      9.134699       7.910987  124.6790 59.02672 208.8816 75.70370 -84.20265      95.99586 
1 1 1 5   12 30 o 188.2649 62.20267 7.646343       5.286434      5.789017       7.949121      9.119169       7.078656  184.8173 73.65809 204.6895 71.89736 -19.87219      102.9308 
1 1 1 5   13 0  o 629.2463 15.14400 77.09437       3.700746      84.86447       5.321310      69.81600       5.150176  659.4037 20.77969 597.8762 22.18109 61.52759       30.39402 
1 1 1 5   13 1  o 802.7340 13.99856 125.4142       4.363982      131.6780       6.290568      119.6028       6.059139  821.6025 19.71515 782.9867 19.92639 38.61578       28.03120 
1 1 1 5   13 2  o 308.6017 21.73114 18.68603       2.587778      16.45960       3.716517      20.78125       3.605355  287.2796 33.96980 324.2950 28.93108 -37.01535      44.62011 
1 1 1 5   13 3  o 202.1520 36.68481 8.299363       2.773932      23.51182       7.417903      5.826221       2.990928  336.8379 58.84834 168.2948 44.92270 168.5431       74.03497 
1 1 1 5   13 4  o 170.5808 33.45594 5.916504       2.137125      5.394886       3.359973      6.270914       2.769571  163.3846 49.03638 174.5439 41.47137 -11.15935      64.22181 
1 1 1 5   13 5  o 241.0594 22.67322 11.44900       2.097644      16.64730       3.205297      7.554920       2.774212  290.0214 28.84092 192.3345 38.48465 97.68686       48.09227 
1 1 1 5   13 6  o 657.7485 24.75934 84.58541       6.324512      83.62865       8.912521      85.55590       8.976240  650.7803 35.39766 658.3091 35.23827 -7.528748      49.94727 
1 1 1 5   13 7  o 994.5425 15.52538 192.5609       5.996442      197.3956       7.023908      179.5662       11.51535  1006.509 17.96939 956.7172 30.99315 49.79163       35.82561 
1 1 1 5   13 8  o 306.1573 42.17540 18.85400       4.881445      21.89111       6.755906      15.53639       7.061010  326.6907 55.21784 271.5631 67.29491 55.12766       87.04949 
1 1 1 5   13 9  o 763.3668 23.78052 113.7441       7.049895      117.4558       10.04539      110.1416       9.896392  773.7609 33.42968 749.1462 34.01593 24.61469       47.69305 
1 1 1 5   13 10 o 1020.846 15.64774 202.7707       6.203539      200.0673       7.117058      211.3201       12.65667  1013.671 18.07904 1038.949 31.36874 -25.27802      36.20565 
1 1 1 5   13 11 o 865.6532 15.74555 145.7755       5.293341      142.4502       6.022664      157.0651       11.09717  855.4671 18.12831 895.9982 31.89165 -40.53107      36.68396 
1 1 1 5   13 12 o 967.7997 13.40128 182.0909       5.036858      179.0499       7.019704      185.3181       7.231397  959.1242 18.84586 975.7390 19.08361 -16.61481      26.82071 
1 1 1 5   13 13 o 259.3328 26.09767 13.24365       2.592673      12.82246       3.377743      13.84767       4.044995  253.6531 35.24144 262.6893 40.98866 -9.036194      54.05580 
1 1 1 5   13 14 o 1163.037 14.43042 262.9536       6.517788      269.3757       9.213428      256.5201       9.221666  1176.516 20.16487 1148.033 20.68365 28.48340       28.88659 
1 1 1 5   13 15 o 243.3246 32.38223 11.75875       2.984013      11.63365       3.859012      11.94479       4.705967  240.1068 42.96239 241.8935 51.66510 -1.786682      67.19411 
1 1 1 5   13 16 o 534.4954 18.67466 55.57247       3.876364      58.27935       5.171788      52.10234       5.855709  547.0175 24.34510 516.0407 29.34034 30.97675       38.12531 
1 1 1 5   13 17 o 1345.688 15.54895 352.0937       8.125938      366.6484       11.70920      338.5719       11.28610  1372.321 21.97069 1318.721 22.03753 53.60046       31.11855 
1 1 1 5   13 18 o 928.6797 15.91741 167.7263       5.740718      161.7785       7.753072      174.9449       8.541238  911.4362 21.90381 947.6295 23.20888 -36.19330      31.91283 
1 1 1 5   13 19 o 793.4514 17.40378 122.4958       5.362805      122.0433       7.239750      123.0458       7.982896  791.3168 23.55837 794.2552 25.88049 -2.938477      34.99709 
1 1 1 5   13 20 o 354.6757 31.55788 24.79100       4.301363      28.52047       5.715089      19.91817       6.532654  379.1717 39.38608 312.3714 55.90312 66.80023       68.38437 
1 1 1 5   13 21 o 1123.849 19.30950 245.9482       8.427663      239.2918       10.03913      261.8351       15.50944  1107.816 23.33461 1155.988 34.54737 -48.17126      41.68963 
1 1 1 5   13 22 o 701.1813 23.35502 95.90910       6.359729      92.83906       7.463461      104.0477       12.15186  689.1939 27.88502 725.0275 43.35669 -35.83356      51.54975 
1 1 1 5   13 23 o 531.0782 53.84576 56.88230       10.95196      56.88230       10.95196      0.000000       0.000000  531.0782 53.84576 ?        ?        0.000000       53.84576 
1 1 1 5   13 24 o 499.6265 27.56551 49.06324       5.327897      47.01768       7.006418      51.86790       8.204101  486.6116 37.36056 509.8546 41.80159 -23.24301      56.06411 
1 1 1 5   13 25 o 366.5749 41.31533 27.04964       5.779117      34.84423       8.578550      20.57282       7.819849  411.5013 55.06070 310.3620 66.85293 101.1393       86.60828 
1 1 1 5   13 26 o 245.2809 60.25393 12.87268       5.698093      12.54414       8.154087      13.18622       7.965850  241.5643 77.06465 246.5486 75.81985 -4.984344      108.1093 
1 1 1 5   13 27 o 246.2608 61.25619 13.15523       5.834152      8.377127       7.037867      23.65164       10.43118  203.8728 71.68547 320.8039 83.07052 -116.9310      109.7247 
1 1 1 5   13 28 o 102.7668 48.63281 -5.318720      5.148234      -2.468616      7.000393      -8.675878      7.597626  136.2339 61.65765 120.5043 57.60250 15.72966       84.37840 
1 1 1 5   13 29 o 117.6718 53.03217 -1.740328      5.115743      4.690793       7.281096      -8.010283      7.189284  174.9775 70.23371 117.2813 56.05390 57.69624       89.85997 
1 1 1 5   14 0  o 552.7346 16.56425 59.52507       3.555628      58.81143       4.960377      60.27925       5.099338  548.5081 23.28647 555.2531 23.64802 -6.744934      33.18868 
1 1 1 5   14 1  o 742.7921 17.96350 107.5555       5.181867      93.38383       10.18430      112.5060       6.019273  686.3580 38.36136 759.2620 20.41382 -72.90405      43.45478 
1 1 1 5   14 2  f 527.7467 17.44561 54.27798       3.575523      51.89597       5.582077      55.93524       4.656066  513.8151 28.08074 535.1146 22.40497 -21.29944      35.92368 
1 1 1 5   14 3  o 607.8373 15.77510 71.95013       3.723810      71.79208       5.774648      72.06263       4.872153  605.9255 24.54021 607.6859 20.64495 -1.760376      32.06923 
1 1 1 5   14 4  f 431.9044 17.57399 36.34890       2.947718      30.99633       4.439413      40.56955       3.942155  396.6154 29.02382 455.8097 22.27010 -59.19427      36.58332 
1 1 1 5   14 5  o 506.2953 14.78809 49.89280       2.907663      46.68205       3.996534      53.50362       4.238212  489.1395 21.03889 523.6836 20.83942 -34.54413      29.61278 
1 1 1 5   14 6  o 409.7354 15.79377 32.68293       2.513144      35.12506       3.356178      29.56570       3.791803  424.4072 20.36265 388.1197 25.29485 36.28745       32.47256 
1 1 1 5   14 7  o 314.0317 21.05239 19.31583       2.552596      20.73306       2.726500      9.257236       7.263614  325.3125 21.70587 217.6790 72.94477 107.6335       76.10574 
1 1 1 5   14 8  o 394.6354 19.40448 30.34143       2.973898      31.38648       3.238484      24.71848       7.511990  400.7309 20.88174 347.4852 57.68928 53.24567       61.35226 
1 1 1 5   14 9  o 911.8781 15.50503 161.7730       5.490821      157.8124       6.192429      176.3400       11.87598  900.3834 17.70947 949.0309 32.22263 -48.64752      36.76851 
1 1 1 5   14 10 o 621.5377 16.02826 75.15182       3.868850      75.49062       4.310803      73.74908       8.771716  622.8005 17.82302 612.1556 37.07211 10.64484       41.13395 
1 1 1 5   14 11 o 333.7287 21.94450 21.78773       2.828256      22.47893       3.059959      17.73524       7.409285  338.8351 23.39744 292.4143 66.71918 46.42078       70.70282 
1 1 1 5   14 12 o 804.8309 13.37165 125.9133       4.179434      129.7043       5.999229      122.3383       5.825810  816.4197 18.92143 792.8987 18.91954 23.52106       26.75761 
1 1 1 5   14 13 o 533.5117 15.71602 55.34418       3.256226      54.16008       4.391917      56.78962       4.852443  527.4674 21.44028 540.0089 23.13831 -12.54144      31.54468 
1 1 1 5   14 14 o 633.9840 15.62146 78.14491       3.846164      77.52385       5.125547      78.94532       5.818756  631.1458 20.91138 636.7150 23.53191 -5.569214      31.48073 
1 1 1 5   14 15 o 577.9355 17.05373 64.95399       3.827602      58.87883       4.977746      73.74244       5.987011  549.8885 23.30935 615.2615 25.05661 -65.37292      34.22221 
1 1 1 5   14 16 o 362.8015 24.86850 25.76365       3.482713      25.52277       4.508897      26.11992       5.483504  360.0613 32.59875 363.1375 39.52105 -3.076233      51.23077 
1 1 1 5   14 17 o 568.3088 18.90592 62.84974       4.172632      61.19662       5.438346      65.21577       6.506169  560.3340 24.99147 577.3325 29.11200 -16.99847      38.36772 
1 1 1 5   14 18 o 376.6162 27.27998 27.82089       3.962949      32.09362       5.214795      21.98031       6.096944  403.6765 33.56854 330.4195 48.99837 73.25696       59.39434 
1 1 1 5   14 19 o 890.7506 22.86869 154.6404       7.910891      154.6404       7.910891      0.000000       0.000000  890.7506 22.86869 ?        ?        0.000000       22.86869 
1 1 1 5   14 20 o 561.2801 24.85730 61.45550       5.418282      54.79585       6.334157      79.61948       10.46088  528.4331 31.00104 634.6505 42.69122 -106.2173      52.75988 
1 1 1 5   14 21 o 747.9694 21.95131 109.0628       6.376352      105.9715       7.549420      116.7567       11.91008  736.6483 26.38915 769.4030 39.99751 -32.75464      47.91855 
1 1 1 5   14 22 o 713.2078 20.68946 99.17098       5.730511      101.0464       7.741030      96.89712       8.523722  718.7667 27.73211 703.1775 31.21306 15.58917       41.75314 
1 1 1 5   14 23 o 402.9798 40.37970 32.41851       6.234352      28.57864       10.59285      34.45345       7.711339  365.5684 77.04283 412.9673 49.04100 -47.39886      91.32698 
1 1 1 5   14 24 o 517.0057 41.73741 53.44860       8.308655      0.000000       0.000000      53.44860       8.308655  ?        ?        517.0057 41.73741 0.000000       41.73741 
1 1 1 5   14 25 o 770.1740 23.76614 116.2301       7.108460      118.9980       10.88980      114.1751       9.383339  774.6844 36.19653 760.6364 31.76525 14.04797       48.15828 
1 1 1 5   14 26 o 531.6537 27.32399 55.81323       5.622515      54.67798       7.402439      57.36125       8.644038  522.7364 36.69653 533.0122 42.10188 -10.27582      55.84983 
1 1 1 5   14 27 f 233.0792 62.26971 11.90038       5.743611      17.65394       7.017534      0.2248983      9.996622  283.0262 65.18964 174.4910 76.62856 108.5352       100.6063 
1 1 1 5   14 28 o 508.5236 31.99975 51.81398       6.287314      56.93251       7.942239      43.22177       10.29019  529.3066 38.91015 446.7132 60.90246 82.59335       72.27109 
1 1 1 5   14 29 o 254.1059 52.03666 13.98316       4.962351      13.02545       7.219711      14.84076       6.831979  237.0662 72.04522 254.1605 67.91895 -17.09431      99.01260 
1 1 1 5   15 0  o 381.9258 30.59968 28.80943       4.500506      0.000000       0.000000      28.80943       4.500506  ?        ?        381.9258 30.59968 0.000000       30.59968 
1 1 1 5   15 1  o 468.4098 19.79959 42.79355       3.601721      42.66067       5.461093      42.89584       4.791538  465.3276 30.38672 467.4175 26.50532 -2.089905      40.32226 
1 1 1 5   15 2  o 498.1198 18.27304 48.35779       3.534863      53.52658       5.524771      44.77525       4.599548  522.1802 27.33875 477.9315 24.86703 44.24869       36.95641 
1 1 1 5   15 3  o 737.1017 14.27685 105.7293       4.086841      111.1921       5.841223      100.4909       5.720014  755.1297 19.91839 717.7810 20.51999 37.34869       28.59742 
1 1 1 5   15 4  f 760.4179 19.61171 112.7198       5.791563      112.7198       5.791563      0.000000       0.000000  760.4179 19.61171 ?        ?        0.000000       19.61171 
1 1 1 5   15 5  o 524.9166 18.66452 53.68113       3.804829      53.87055       4.290510      52.98370       8.232865  525.6081 21.01933 516.5770 41.38567 9.031067       46.41751 
1 1 1 5   15 6  o 449.1399 17.13534 39.27408       2.988837      41.61749       3.912534      35.99020       4.631568  461.9687 21.80809 428.1157 28.01174 33.85300       35.50000 
1 1 1 5   15 7  o 262.8709 19.38483 13.53206       1.964977      12.97122       2.039928      20.74619       7.316216  257.1920 20.59626 316.9207 61.66328 -59.72864      65.01205 
1 1 1 5   15 8  o 433.5289 19.19465 36.59690       3.231665      37.96773       3.537423      29.67975       7.946202  441.4783 20.63239 382.9689 55.00692 58.50940       58.74910 
1 1 1 5   15 9  o 654.2897 16.93238 83.29188       4.302454      82.02419       4.825958      88.20245       9.498214  649.1119 19.14414 669.8783 36.64946 -20.76636      41.34829 
1 1 1 5   15 10 o 551.0264 17.49670 59.07331       3.744179      57.10846       4.119751      68.39966       8.975554  541.6512 19.58499 589.3057 39.44642 -47.65448      44.04079 
1 1 1 5   15 11 o 420.3828 20.31790 34.39827       3.317047      33.62420       3.630543      38.30864       8.160007  414.8951 22.61765 438.5441 48.73690 -23.64908      53.72936 
1 1 1 5   15 12 o 419.2469 15.94165 34.17710       2.595560      35.99995       3.824175      32.62012       3.534292  429.3506 23.01880 408.7091 22.35162 20.64151       32.08519 
1 1 1 5   15 13 o 826.3466 13.74162 132.7235       4.409894      143.2546       6.441252      123.4324       6.050166  858.0936 19.32892 796.4984 19.55935 61.59515       27.49864 
1 1 1 5   15 14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 5   15 15 o 796.8507 15.22128 123.4534       4.710382      118.8934       6.248934      129.4538       7.168269  781.5848 20.58741 815.3600 22.63794 -33.77515      30.59931 
1 1 1 5   15 16 o 820.4838 15.73562 130.9149       5.013972      128.2881       6.713714      134.2276       7.539580  811.7053 21.29788 830.0485 23.38922 -18.34326      31.63313 
1 1 1 5   15 17 o 725.7820 17.18082 102.4848       4.842595      105.3517       6.429333      98.72599       7.361942  735.3485 22.51359 711.3719 26.64819 23.97662       34.88535 
1 1 1 5   15 18 o 538.4607 20.97483 56.47548       4.386120      51.54516       5.675730      63.78518       6.910893  512.9501 28.60561 570.3146 31.32265 -57.36450      42.41921 
1 1 1 5   15 19 o 569.8279 23.97224 63.31944       5.304938      64.10528       6.200250      61.17248       10.24839  572.9250 27.86656 554.5643 48.06081 18.36066       55.55526 
1 1 1 5   15 20 o 317.0890 40.60294 20.09085       4.885122      19.62924       5.644953      21.46768       9.749030  311.6062 48.20343 318.5438 79.15525 -6.937592      92.67753 
1 1 1 5   15 21 o 136.2498 54.24273 2.012041       4.306525      1.976596       5.557043      2.065336       6.814103  149.7455 60.91004 162.9689 66.99929 -13.22343      90.54798 
1 1 1 5   15 22 o 397.7848 31.91732 31.25659       4.889110      40.95636       6.487632      18.50735       7.437854  454.4490 37.08305 296.3834 66.28126 158.0656       75.94971 
1 1 1 5   15 23 o 211.3008 57.19939 9.339431       4.808653      13.30435       6.348851      4.004391       7.364561  250.4273 64.78881 178.3987 70.96160 72.02867       96.08923 
1 1 1 5   15 24 o 220.3906 73.31931 9.948334       7.340207      0.000000       0.000000      9.948334       7.340207  ?        ?        220.3906 73.31931 0.000000       73.31931 
1 1 1 5   15 25 o 904.7322 19.84389 160.0712       6.972281      159.3487       9.408240      160.9513       10.38447  900.0252 26.91694 903.3199 29.60157 -3.294739      40.00968 
1 1 1 5   15 26 o 342.1982 62.13169 25.20874       7.952824      0.000000       0.000000      25.20874       7.952824  ?        ?        342.1982 62.13169 0.000000       62.13169 
1 1 1 5   15 27 o 475.1859 30.45269 45.06620       5.590176      41.31335       7.675090      49.30660       8.158436  447.9492 44.71667 490.5489 43.26819 -42.59967      62.22312 
1 1 1 5   15 28 o 377.5343 40.52142 29.30467       5.848207      33.46994       7.321934      21.96492       9.719519  399.3487 48.18489 302.2950 81.10709 97.05365       94.34058 
1 1 1 5   16 0  o 462.5523 21.75124 41.74387       3.907266      43.54586       5.911099      40.34559       5.207038  469.9498 32.58969 452.8479 29.77407 17.10190       44.14276 
1 1 1 5   16 1  o 379.5464 22.06800 28.20025       3.238746      35.77639       4.598711      20.74437       4.562066  426.7127 27.90429 322.6383 37.08401 104.0744       46.40984 
1 1 1 5   16 2  o 565.6428 16.51722 62.28926       3.628335      69.63573       5.206732      55.35393       5.058939  597.4128 22.44206 532.3983 24.46780 65.01459       33.20119 
1 1 1 5   16 3  o 225.0966 31.25357 10.11096       2.658380      6.673440       3.649739      13.99557       3.879837  180.6126 50.21636 263.9154 39.03221 -83.30286      63.60186 
1 1 1 5   16 4  o 874.8942 16.94641 149.0004       5.757860      148.0573       6.662352      151.7833       11.44516  871.7447 19.67933 879.8616 33.49496 -8.116943      38.84827 
1 1 1 5   16 5  o 820.4449 14.08136 130.9177       4.486649      132.8479       6.257057      128.8748       6.436924  825.8588 19.50906 813.3008 20.37977 12.55804       28.21238 
1 1 1 5   16 6  o 624.8074 14.98040 75.93268       3.634943      70.21985       4.742209      84.07030       5.659837  600.4142 20.33770 656.7697 22.19028 -56.35547      30.10034 
1 1 1 5   16 7  o 374.3157 22.20482 27.39657       3.213425      25.29338       3.498419      38.75027       8.128330  359.2324 25.23673 440.5971 48.29568 -81.36465      54.49188 
1 1 1 5   16 8  o 1223.534 13.84524 291.0568       6.578770      290.4942       7.280749      293.5596       15.35622  1222.176 15.33961 1225.367 32.26934 -3.191162      35.72973 
1 1 1 5   16 9  o 1090.762 13.68586 231.2901       5.797360      231.3200       6.377174      231.1477       13.91516  1090.701 15.05547 1087.437 32.95004 3.264160       36.22668 
1 1 1 5   16 10 o 711.2059 13.78237 98.32356       3.806688      99.98238       4.109301      88.28901       10.10692  717.1235 14.75523 670.3022 38.99426 46.82135       41.69256 
1 1 1 5   16 11 o 633.3920 14.25385 77.98582       3.506169      77.57542       3.752789      80.80399       9.834139  631.6711 15.29802 641.1876 39.68839 -9.516418      42.53466 
1 1 1 5   16 12 o 1187.351 17.07470 274.1681       7.873359      272.4695       9.126517      279.1109       15.56823  1183.349 19.85931 1195.412 33.53464 -12.06238      38.97389 
1 1 1 5   16 13 o 1052.910 13.84867 215.4868       5.662746      223.4327       8.227924      208.3360       7.805434  1071.583 19.77136 1034.785 19.42311 36.79761       27.71577 
1 1 1 5   16 14 o 257.7557 27.31337 13.09824       2.692425      13.91195       3.770413      12.25156       3.846040  263.9890 37.86082 246.7048 41.62421 17.28419       56.26737 
1 1 1 5   16 15 o 162.6423 45.99661 5.340070       3.035061      0.3004364      4.025169      11.98105       4.620626  119.6563 50.51070 242.1005 50.76650 -122.4442      71.61402 
1 1 1 5   16 16 o 508.9494 19.95046 50.43156       3.943262      49.43887       5.133790      51.85994       6.158169  502.7330 26.38718 514.2286 30.98132 -11.49557      40.69553 
1 1 1 5   16 17 o 438.6153 23.86769 37.61797       4.050276      42.45735       5.182007      30.01984       6.493165  465.3500 28.81589 388.1763 43.84062 77.17374       52.46290 
1 1 1 5   16 18 o 477.4927 26.00936 44.62526       4.804897      42.39666       5.547627      51.31676       9.612864  464.6111 30.92270 507.2149 49.42960 -42.60385      58.30521 
1 1 1 5   16 19 o 834.4789 19.83599 135.6408       6.428318      143.6152       7.709618      117.4499       11.64426  858.1747 23.13285 772.1162 38.95873 86.05853       45.30906 
1 1 1 5   16 20 o 730.4670 19.30203 103.9541       5.475597      103.9375       7.231785      103.9766       8.382304  729.5029 25.52645 728.9117 29.61151 0.5912476      39.09528 
1 1 1 5   16 21 o 379.7938 31.59820 28.49097       4.618258      31.91481       6.014418      23.57180       7.209129  400.3805 39.18276 338.5824 56.84081 61.79813       69.03742 
1 1 1 5   16 22 o 935.5291 18.42938 170.6660       6.695699      174.0347       9.038360      166.5687       9.968056  943.1421 24.67655 921.7416 27.84667 21.40051       37.20712 
1 1 1 5   16 23 o 302.8980 47.11127 18.78267       5.361679      16.56558       7.852564      20.71905       7.338617  276.5905 72.29663 312.9809 62.56379 -36.39035      95.60873 
1 1 1 5   16 24 o 188.3119 66.45982 6.783110       6.054311      6.206426       10.83712      7.044758       7.299683  211.4260 85.39494 196.7396 72.50295 14.68639       112.0222 
1 1 1 5   16 25 o 281.9682 60.25312 17.10971       6.397736      15.54009       11.11915      17.88653       7.822281  263.5634 90.24178 283.9800 71.09150 -20.41666      114.8807 
1 1 1 5   16 26 f 667.2514 24.10291 87.68006       6.245784      101.3264       8.750572      73.50803       8.917540  713.7325 31.56988 603.4963 38.24666 110.2362       49.59299 
1 1 1 5   16 27 o 403.2646 33.93409 32.81715       5.265003      28.52425       7.071449      38.15704       7.886774  367.2549 50.95354 427.1121 48.40224 -59.85721      70.27831 
1 1 1 5   17 0  o 957.2499 15.16154 178.2774       5.636332      177.0248       7.843504      179.6148       8.104875  952.9956 21.19294 959.8457 21.74287 -6.850098      30.36270 
1 1 1 5   17 1  o 480.2007 28.14568 45.22066       5.225904      0.000000       0.000000      45.22066       5.225904  ?        ?        480.2007 28.14568 0.000000       28.14568 
1 1 1 5   17 2  o 627.0892 19.67609 76.59450       4.791771      74.72431       5.411417      83.38648       10.31258  619.0919 22.50754 649.7023 41.08346 -30.61047      46.84485 
1 1 1 5   17 3  o 654.6085 15.58618 83.36249       3.962317      86.67928       5.537152      79.88165       5.672421  666.9570 21.37768 640.1149 22.81826 26.84216       31.26785 
1 1 1 5   17 4  o 617.4418 23.32656 74.32236       5.593387      0.000000       0.000000      74.32236       5.593387  ?        ?        617.4418 23.32656 0.000000       23.32656 
1 1 1 5   17 5  o 411.1441 19.26315 32.90829       3.075739      37.68657       4.183722      27.28834       4.537257  438.9391 24.64284 372.2603 31.68621 66.67889       40.14082 
1 1 1 5   17 6  f 1102.129 19.70812 236.4701       8.435394      236.4701       8.435394      0.000000       0.000000  1102.129 19.70812 ?        ?        0.000000       19.70812 
1 1 1 5   17 7  o 210.4245 38.13101 8.937332       3.001300      9.455423       3.233027      5.706917       8.073016  216.2573 39.96778 198.1213 75.55167 18.13599       85.47210 
1 1 1 5   17 8  o 531.8966 14.79690 55.00549       3.056511      55.04571       3.248385      54.69484       9.027062  532.0474 15.72132 525.8650 44.62345 6.182434       47.31186 
1 1 1 5   17 9  o 604.7996 14.52297 71.10895       3.411102      71.77949       3.651187      66.50738       9.564761  607.5968 15.47357 580.8156 42.70357 26.78125       45.42055 
1 1 1 5   17 10 o 715.8187 14.27909 99.60377       3.969460      97.88291       4.253200      111.2256       11.05303  709.5432 15.43508 753.0262 37.91726 -43.48303      40.93850 
1 1 1 5   17 11 o 423.1807 18.25960 34.83504       3.000856      34.37836       3.203644      38.10355       8.570678  420.3401 19.62526 437.0332 51.48563 -16.69308      55.09919 
1 1 1 5   17 12 f 454.9367 18.89944 40.26651       3.339088      37.77016       3.577415      57.15147       9.303948  440.5132 20.91136 537.7496 44.96377 -97.23639      49.58857 
1 1 1 5   17 13 f 761.4788 18.06170 112.8079       5.341267      107.1660       5.962741      135.7196       12.01607  741.9721 20.69333 832.6834 37.15820 -90.71130      42.53170 
1 1 1 5   17 14 o 678.2013 15.27190 89.44536       4.022347      90.43909       5.756370      88.49718       5.622895  681.4402 21.75168 674.1097 21.47837 7.330505       30.56888 
1 1 1 5   17 15 o 821.8713 15.12148 131.3660       4.826432      134.3339       6.862338      128.4608       6.789457  830.4698 21.27748 812.0833 21.52814 18.38654       30.26867 
1 1 1 5   17 16 f 250.5462 35.50050 12.53731       3.357581      19.93986       4.511530      3.347173       5.026830  316.7251 37.40030 155.3524 59.52804 161.3728       70.30199 
1 1 1 5   17 17 o 276.7919 39.10279 15.33363       4.086249      16.51111       4.870666      12.53530       7.508626  286.0526 45.35788 246.9106 73.12380 39.14192       86.04898 
1 1 1 5   17 18 o 1158.721 18.10190 261.3937       8.145750      268.8453       10.06004      247.2067       13.88105  1174.375 22.05793 1123.770 31.80658 50.60583       38.70672 
1 1 1 5   17 19 o 881.4026 17.41709 151.2572       5.961808      149.8535       7.852973      153.1669       9.159575  876.4141 23.07261 885.3560 26.63971 -8.941895      35.24229 
1 1 1 5   17 20 o 1074.333 17.03410 224.7920       7.106997      217.4176       9.349682      234.8842       10.93774  1055.309 22.81336 1096.090 25.69529 -40.78101      34.36128 
1 1 1 5   17 21 o 231.6448 51.01793 11.14388       4.465527      13.33393       5.694934      7.647729       7.195432  251.9405 59.20715 203.2804 72.37643 48.66013       93.50847 
1 1 1 5   17 22 o 381.2067 36.95857 29.02127       5.402734      30.53800       7.649715      27.51173       7.631556  385.9697 52.38829 364.8206 55.62475 21.14908       76.41103 
1 1 1 5   17 23 o 232.9719 52.43485 11.42130       4.629559      15.73960       6.167786      5.848725       7.006485  271.8912 60.01862 186.6413 70.57245 85.24994       92.64289 
1 1 1 5   17 24 o 103.3575 47.92458 -3.517506      4.587570      -7.564271      6.174996      1.467479       6.853536  108.7872 51.98174 156.0648 65.89633 -47.27763      83.93109 
1 1 1 5   17 25 o 392.1859 41.98270 31.39942       6.294937      50.92672       12.10104      24.15478       7.370726  485.0387 65.95208 335.6796 58.67642 149.3591       88.27570 
1 1 1 5   17 26 o 79.05381 39.40428 -11.89661      4.852856      -8.944923      6.542477      -15.50696      7.235715  107.6997 51.98687 99.65855 49.41242 8.041176       71.72323 
1 1 1 5   17 27 o 274.6683 48.43862 16.06525       4.978045      15.64864       6.753080      16.56104       7.366947  261.9819 66.31414 267.6113 70.06218 -5.629425      96.46903 
1 1 1 5   18 0  o 582.7352 22.39799 66.17838       5.068837      65.39519       5.728347      69.00428       10.88107  578.9687 25.47688 589.3845 47.95425 -10.41583      54.30177 
1 1 1 5   18 1  o 935.4647 21.51603 170.4817       7.816592      170.4817       7.816592      0.000000       0.000000  935.4647 21.51603 ?        ?        0.000000       21.51603 
1 1 1 5   18 2  o 594.0919 16.93820 68.66983       3.907949      71.59189       5.462291      65.60583       5.593390  606.0740 23.20712 580.0271 24.83126 26.04688       33.98767 
1 1 1 5   18 3  o 594.7260 17.05548 68.81305       3.939206      65.66479       5.470325      72.20391       5.677189  580.3883 24.26982 608.6255 24.01902 -28.23718      34.14582 
1 1 1 5   18 4  o 1198.436 14.80295 279.2758       6.889555      273.7367       9.447955      285.5662       10.06820  1185.731 20.51746 1210.937 21.40929 -25.20581      29.65340 
1 1 1 5   18 5  o 469.5907 18.90614 42.91227       3.447866      45.43838       4.644863      39.81224       5.145521  482.1955 24.88888 450.6518 29.56477 31.54370       38.64624 
1 1 1 5   18 6  o 1063.793 14.66819 220.0167       6.059847      217.1193       8.198823      223.5052       8.996441  1056.199 19.98838 1071.408 21.62161 -15.20850      29.44536 
1 1 1 5   18 7  o 1276.217 15.13197 316.6659       7.499771      316.4572       10.31076      316.9003       10.92876  1275.070 20.82230 1275.774 22.05815 -0.7041016     30.33365 
1 1 1 5   18 8  o 655.7172 14.54444 83.58541       3.703748      81.43354       3.961700      98.51415       10.43483  647.1567 15.76319 708.4938 38.06409 -61.33716      41.19895 
1 1 1 5   18 9  o 333.6970 20.37045 21.75101       2.627217      21.98843       2.758337      19.43043       8.623711  335.4299 21.28497 305.9865 73.49333 29.44336       76.51353 
1 1 1 5   18 10 o 572.4014 15.84776 63.70829       3.522871      65.39902       3.780954      52.57667       9.701597  579.8983 16.78887 514.7139 49.13100 65.18439       51.92034 
1 1 1 5   18 11 o 711.5889 15.11480 98.45180       4.176953      99.63037       4.525649      91.67570       10.85156  715.7607 16.28115 682.6143 41.12645 33.14636       44.23190 
1 1 1 5   18 12 o 393.7984 21.43068 30.28636       3.265127      31.35053       3.513521      23.54847       8.840971  400.5429 22.68049 337.4088 69.77439 63.13412       73.36804 
1 1 1 5   18 13 o 456.0711 20.18227 40.49791       3.574625      40.70367       3.844111      39.18283       9.718377  457.1353 21.65325 440.7436 58.20163 16.39169       62.09906 
1 1 1 5   18 14 o 816.4391 18.87023 129.7570       5.983138      128.6016       6.785722      133.7926       12.68246  812.4934 21.50543 825.5491 39.55785 -13.05573      45.02563 
1 1 1 5   18 15 o 290.9296 28.66059 16.69144       3.196126      21.96096       4.711685      12.19996       4.349962  332.6215 37.10770 244.6302 47.50004 87.99124       60.27633 
1 1 1 5   18 16 f 507.4782 21.40948 50.18203       4.219409      55.74520       5.563011      42.64660       6.474451  533.6598 26.92907 464.9727 36.13873 68.68707       45.06865 
1 1 1 5   18 17 o 413.7140 26.53757 33.56068       4.241238      31.15684       5.288977      37.89117       7.098825  397.1693 34.63670 436.5952 42.40256 -39.42590      54.75106 
1 1 1 5   18 18 o 1153.095 16.02907 258.7804       7.177963      281.2221       10.42990      238.5869       9.893664  1200.743 22.36670 1105.832 23.03774 94.91052       32.10930 
1 1 1 5   18 19 o 209.5115 52.40987 9.101928       4.253589      4.683190       5.457993      15.93706       6.788243  169.2798 62.63412 275.3600 64.59406 -106.0802      89.97459 
1 1 1 5   18 20 o 697.0873 20.18681 94.82405       5.464907      102.9054       7.264166      84.28606       8.295133  725.0538 25.79809 654.6157 32.62939 70.43817       41.59589 
1 1 1 5   18 21 o 411.2258 33.56988 33.57080       5.314384      30.36461       7.642093      36.57327       7.395327  384.8902 52.49585 425.6141 45.44438 -40.72394      69.43346 
1 1 1 5   18 22 o 257.8989 48.15463 13.79221       4.645607      14.81144       5.956846      12.20998       7.421893  263.8700 59.54420 238.6239 73.15258 25.24615       94.32291 
1 1 1 5   18 23 o 505.5800 26.44276 50.42933       5.173840      54.59951       6.960989      45.28196       7.733690  523.3042 34.44476 473.0705 42.55047 50.23373       54.74472 
1 1 1 5   18 24 f 521.7194 25.72663 53.64249       5.212521      56.44519       7.290583      50.71161       7.455417  530.5362 35.59122 501.3534 38.58775 29.18280       52.49523 
1 1 1 5   18 25 o 144.4354 60.22933 1.799972       5.615805      4.754683       10.73968      0.6880438      6.588284  197.1063 82.81767 147.0510 63.41246 50.05530       104.3068 
1 1 1 5   18 26 o 179.2344 64.50855 6.458384       5.730740      6.815946       10.50354      6.306831       6.838222  203.3830 83.34812 183.1090 69.60384 20.27397       108.5891 
1 1 1 5   19 0  o 901.2188 15.90725 157.9626       5.567411      146.9637       7.479775      171.6262       8.336777  868.6218 22.17327 938.5867 22.87156 -69.96497      31.85534 
1 1 1 5   19 1  o 748.1374 16.40666 108.8646       4.766829      107.0434       6.548039      110.9179       6.952781  741.2827 22.74570 754.4724 23.72942 -13.18970      32.87024 
1 1 1 5   19 2  o 445.4078 21.25739 38.62769       3.677017      35.04297       5.064208      42.62473       5.347527  422.4600 31.08562 466.3538 29.68070 -43.89380      42.97976 
1 1 1 5   19 3  o 992.3781 15.15574 191.4868       5.840934      193.2208       8.136059      189.6426       8.390471  996.2394 21.02918 986.8645 21.89278 9.374939       30.35655 
1 1 1 5   19 4  o 1679.499 16.51336 548.5760       10.77068      544.8046       14.95643      552.6388       15.52346  1672.481 23.02707 1684.305 23.73231 -11.82312      33.06763 
1 1 1 5   19 5  f 513.7338 18.55106 51.34692       3.701133      56.61619       5.015681      45.04771       5.484002  539.1024 23.95691 479.5765 29.58954 59.52588       38.07196 
1 1 1 5   19 6  o 529.2672 18.18199 54.49340       3.737183      49.03326       4.846534      62.50186       5.869531  501.6513 24.87719 566.2271 26.69222 -64.57581      36.48766 
1 1 1 5   19 7  f 645.8099 16.78295 81.11187       4.209213      82.35266       5.526638      79.39790       6.495492  650.3763 21.88106 638.2356 26.20613 12.14069       34.14004 
1 1 1 5   19 8  o 1243.069 14.67295 300.4095       7.083380      304.0779       7.914742      285.6477       15.87683  1250.459 16.29818 1208.997 33.81508 41.46191       37.53786 
1 1 1 5   19 9  o 918.2397 14.20631 163.9156       5.066001      162.0705       5.479822      174.7662       13.28879  912.9587 15.45565 945.1011 36.20588 -32.14240      39.36678 
1 1 1 5   19 10 o 955.6861 14.36596 177.5752       5.331849      176.6982       5.791102      182.4563       13.66164  953.2101 15.64388 965.3943 36.43932 -12.18420      39.65545 
1 1 1 5   19 11 o 231.7051 34.17999 10.72538       2.983275      11.47485       3.176517      5.121701       8.685831  239.6387 35.17965 198.6646 77.66724 40.97409       85.26318 
1 1 1 5   19 12 o 704.1564 16.11345 96.45366       4.406419      95.93650       4.782917      99.35603       11.33066  702.1492 17.54024 709.9695 41.27296 -7.820313      44.84548 
1 1 1 5   19 13 o 97.45837 43.04592 -0.9579923     3.197144      -2.098518      3.425171      6.762305       8.911416  93.94545 42.75742 210.0007 79.54556 -116.0553      90.30888 
1 1 1 5   19 14 o 261.8196 36.18907 13.68829       3.581283      12.88713       3.893271      18.09457       9.130429  252.9084 41.04623 293.3879 78.56580 -40.47951      88.64185 
1 1 1 5   19 15 o 453.1688 31.55468 40.37679       5.518659      40.37679       5.518659      0.000000       0.000000  453.1688 31.55468 ?        ?        0.000000       31.55468 
1 1 1 5   19 16 o 860.8459 17.22180 144.2530       5.757473      146.1359       7.542227      141.6235       8.912947  865.6996 22.43388 851.4379 26.95506 14.26178       35.06928 
1 1 1 5   19 17 o 296.1638 32.89730 17.40754       3.719798      22.69846       5.230736      11.99409       5.290957  336.9692 40.80256 240.2430 57.47963 96.72627       70.48940 
1 1 1 5   19 18 o 941.0302 16.49410 172.4483       6.027817      168.7661       8.306270      176.5449       8.761148  929.6629 23.00661 950.6768 23.73013 -21.01392      33.05182 
1 1 1 5   19 19 f 210.1590 67.08877 8.975591       6.178900      0.000000       0.000000      8.975591       6.178900  ?        ?        210.1590 67.08877 0.000000       67.08877 
1 1 1 5   19 20 o 687.6504 22.52108 92.48206       6.014298      102.3740       9.155523      84.97322       7.976794  720.6309 32.71465 656.9641 31.26502 63.66687       45.25208 
1 1 1 5   19 21 o 628.5443 33.21231 78.30399       8.078274      0.000000       0.000000      78.30399       8.078274  ?        ?        628.5443 33.21231 0.000000       33.21231 
1 1 1 5   19 22 o 483.2143 26.19943 46.05857       4.898166      52.88514       6.760105      38.51338       7.107012  515.2234 33.97617 436.1003 42.50385 79.12317       54.41468 
1 1 1 5   19 23 o 737.1177 27.88778 107.3251       7.983232      107.3251       7.983232      0.000000       0.000000  737.1177 27.88778 ?        ?        0.000000       27.88778 
1 1 1 5   19 24 o 110.4331 49.61066 -1.550264      4.435444      -0.9870569     6.306071      -2.101692      6.239784  135.6735 60.16307 129.6056 58.47511 6.067856       83.89835 
1 1 1 5   19 25 f 228.9948 61.93235 11.72664       5.640413      15.45206       10.50078      10.21590       6.686980  253.9308 87.65958 213.9538 69.92368 39.97702       112.1317 
1 1 1 5   20 0  o 915.7206 16.28085 163.0849       5.789860      158.4388       7.922207      168.4116       8.482693  901.9172 22.61786 929.7573 23.49287 -27.84003      32.61108 
1 1 1 5   20 1  o 461.3615 21.99088 41.44967       3.940142      39.21043       5.429258      43.94131       5.727067  446.9713 31.47862 473.3126 31.33430 -26.34128      44.41556 
1 1 1 5   20 2  o 1087.125 15.53049 229.8102       6.556813      229.9184       9.135394      229.6952       9.416458  1086.660 21.64739 1086.038 22.32619 0.6219482      31.09772 
1 1 1 5   20 3  f 484.1652 20.58390 45.63008       3.870341      43.57484       5.185661      48.21467       5.815262  471.7656 28.43705 496.0637 30.33161 -24.29803      41.57730 
1 1 1 5   20 4  o 157.5510 47.97387 4.906133       3.198970      1.086887       4.191355      10.23523       4.950996  127.9761 52.57199 223.2731 56.92556 -95.29699      77.48763 
1 1 1 5   20 5  o 1187.332 15.33375 274.1174       7.070471      262.6753       9.508790      288.2671       10.57416  1161.580 21.07890 1216.651 22.37958 -55.07031      30.74355 
1 1 1 5   20 6  o 1162.916 15.37210 262.9680       6.942400      256.2522       9.404405      271.0105       10.29153  1147.260 21.10773 1179.628 22.46502 -32.36829      30.82553 
1 1 1 5   20 7  o 918.4840 15.67489 164.0574       5.591187      163.1133       7.370538      165.3372       8.581059  915.3204 20.73471 921.1287 23.98792 -5.808289      31.70723 
1 1 1 5   20 8  o 1574.470 16.07319 482.1551       9.827981      487.2022       11.08751      463.6498       21.23050  1582.348 18.04280 1539.017 35.52130 43.33142       39.84100 
1 1 1 5   20 9  o 728.7609 18.84547 103.3724       5.333595      106.3310       6.022128      92.60829       11.48684  738.9045 20.98619 684.9467 43.40768 53.95782       48.21459 
1 1 1 5   20 10 o 826.3752 14.87686 132.8092       4.774375      131.7577       5.160442      139.0585       12.58034  822.9834 16.14611 841.8795 38.47816 -18.89612      41.72848 
1 1 1 5   20 11 o 595.1978 17.25128 68.93903       3.987590      70.93098       4.296564      56.56456       10.70894  603.6510 18.32768 531.9561 52.52317 71.69495       55.62901 
1 1 1 5   20 12 o 375.8054 27.79969 27.73170       4.028452      27.34224       4.474361      29.39869       9.256878  372.6024 31.20872 378.1483 65.40067 -5.545807      72.46538 
1 1 1 5   20 13 o 668.9531 19.16525 87.14117       4.978956      82.12030       5.474082      111.1901       11.98037  649.1343 21.71445 750.6954 41.25223 -101.5612      46.61828 
1 1 1 5   20 14 o 472.9986 25.07644 43.78500       4.589865      43.78500       4.589865      0.000000       0.000000  472.9986 25.07644 ?        ?        0.000000       25.07644 
1 1 1 5   20 15 o 170.6954 53.94255 5.739297       4.002377      5.739297       4.002377      0.000000       0.000000  170.6954 53.94255 ?        ?        0.000000       53.94255 
1 1 1 5   20 16 o 1145.675 15.73903 255.4826       7.002728      241.6078       9.516624      271.8665       10.34142  1112.857 22.01991 1180.352 22.56008 -67.49451      31.52512 
1 1 1 5   20 17 o 111.8655 47.18367 0.3455279      3.507794      -2.535156      5.108738      2.915066       4.824957  116.6614 52.74736 148.8366 57.96994 -32.17516      78.37601 
1 1 1 5   20 18 o 190.4150 62.04036 7.219184       5.265671      7.219184       5.265671      0.000000       0.000000  190.4150 62.04036 ?        ?        0.000000       62.04036 
1 1 1 5   20 19 o 908.4568 18.99158 161.0930       6.700286      150.7064       10.40057      168.4619       8.760401  875.0471 30.60539 927.4561 24.32219 -52.40906      39.09295 
1 1 1 5   20 20 o 366.2650 31.61465 26.66686       4.452817      22.81016       5.957240      31.54959       6.702988  333.6772 47.29562 394.3921 44.54410 -60.71487      64.96963 
1 1 1 5   20 21 o 258.1738 65.32585 14.50063       6.555022      0.000000       0.000000      14.50063       6.555022  ?        ?        258.1738 65.32585 0.000000       65.32585 
1 1 1 5   20 22 o 371.1253 44.86034 28.28021       6.334407      28.28021       6.334407      0.000000       0.000000  371.1253 44.86034 ?        ?        0.000000       44.86034 
1 1 1 5   20 23 o 208.7057 54.43238 9.429667       4.457741      5.999767       6.497158      12.48035       6.127469  180.8798 68.05673 236.8288 64.76035 -55.94901      93.94478 
1 1 1 5   20 24 o 147.7379 54.57967 3.925188       4.141347      3.989178       6.249622      3.875090       5.529728  163.5432 65.26974 157.5231 61.85798 6.020050       89.92525 
1 1 1 5   21 0  o 655.2293 19.14392 83.56152       4.871383      81.94338       6.675232      85.40511       7.125104  648.1548 26.51915 661.5646 27.73262 -13.40985      38.37140 
1 1 1 5   21 1  o 1058.984 16.20170 218.1243       6.663126      217.1346       9.313256      219.1622       9.536889  1055.726 22.71551 1060.575 23.15460 -4.849731      32.43655 
1 1 1 5   21 2  o 1179.248 15.87344 270.4620       7.269490      265.2533       10.00606      276.2843       10.57908  1166.961 22.07896 1190.844 22.87521 -23.88220      31.79239 
1 1 1 5   21 3  o 1147.228 15.81038 255.9750       7.044012      249.7164       9.563848      263.3954       10.41381  1132.303 21.74914 1162.682 23.06327 -30.37891      31.70078 
1 1 1 5   21 4  o 623.7268 18.47760 75.71111       4.475772      76.06734       5.997357      75.26331       6.724213  624.6404 24.72304 620.9929 27.88218 3.647522       37.26452 
1 1 1 5   21 5  o 616.8083 18.47281 74.04451       4.424978      69.39261       5.786932      80.59364       6.866332  596.5535 24.97877 642.6137 27.51356 -46.06018      37.16093 
1 1 1 5   21 6  o 595.6030 18.62372 69.04778       4.307757      64.59833       5.616982      75.40219       6.712550  575.5295 25.13087 621.4946 27.81136 -45.96503      37.48376 
1 1 1 5   21 7  f 532.6199 20.17952 55.24423       4.174037      55.46772       5.200462      54.83957       6.997783  533.2747 25.11094 528.1440 34.30357 5.130737       42.51228 
1 1 1 5   21 8  o 1143.245 18.14710 254.4021       8.057019      248.5649       9.224984      273.1747       16.54352  1129.588 21.02895 1180.495 36.08577 -50.90662      41.76601 
1 1 1 5   21 9  o 276.1268 28.65987 15.05384       3.028574      14.64648       3.180261      19.02112       9.924789  272.0002 30.64056 300.4420 82.52880 -28.44183      88.03321 
1 1 1 5   21 10 o 655.7909 16.39743 83.68066       4.176084      84.99015       4.501901      75.60372       11.18069  660.8035 17.54267 617.0647 47.00995 43.73883       50.17649 
1 1 1 5   21 11 o 294.5057 29.43393 17.12142       3.321346      17.04173       3.517438      17.77690       10.08838  293.4923 31.34524 290.9209 84.36862 2.571411       90.00327 
1 1 1 5   21 12 o 211.1119 43.04713 9.092834       3.409622      10.72588       3.639883      -2.603006      9.741018  229.8725 42.33280 168.5695 74.76128 61.30292       85.91458 
1 1 1 5   21 13 o 507.6360 23.30287 50.27105       4.593988      50.27105       4.593988      0.000000       0.000000  507.6360 23.30287 ?        ?        0.000000       23.30287 
1 1 1 5   21 14 f 361.6888 34.55927 25.90891       4.795230      25.90891       4.795230      0.000000       0.000000  361.6888 34.55927 ?        ?        0.000000       34.55927 
1 1 1 5   21 15 o 856.4692 16.85441 142.8554       5.606003      138.5796       6.130337      164.6920       13.85375  843.2657 18.71940 913.7727 39.03923 -70.50696      43.29523 
1 1 1 5   21 16 o 870.3031 20.30497 147.7853       6.862792      148.2778       7.901319      146.2724       13.84802  871.0759 23.35692 859.3032 41.49669 11.77277       47.61849 
1 1 1 5   21 17 o 599.0982 19.70414 70.05281       4.584411      69.08300       6.823946      70.85056       6.189117  593.0231 29.63029 601.2537 26.50593 -8.230530      39.75574 
1 1 1 5   21 18 o 179.1046 54.71780 6.567581       4.156617      6.084910       6.850113      6.848872       5.229382  188.1557 70.05933 185.8863 61.88772 2.269379       93.47941 
1 1 1 5   21 19 o 344.9673 31.54304 23.68450       4.179037      23.01585       5.762816      24.42614       6.069178  335.7379 45.35963 345.6608 46.38185 -9.922974      64.87505 
1 1 1 5   21 20 o 603.0320 21.10010 71.22388       4.941432      76.37501       6.978462      66.04380       6.998058  622.1271 28.88368 576.9020 31.35317 45.22510       42.62967 
1 1 1 5   21 21 o 125.7749 51.97748 1.277058       4.128799      3.529831       5.762769      -1.098993      5.918346  158.8418 62.90137 131.7654 58.36420 27.07631       85.80771 
1 1 1 5   21 22 o 263.7232 44.67778 14.53075       4.412438      14.44864       6.194535      14.61532       6.286747  255.3615 62.88081 256.6168 63.44233 -1.255341      89.32484 
1 1 1 5   21 23 o 343.3729 34.18644 23.88335       4.498164      27.62944       6.325494      20.05106       6.397851  363.9215 45.76919 303.9065 56.28106 60.01501       72.54224 
1 1 1 5   21 24 o 259.9607 62.40104 15.23330       6.219885      0.000000       0.000000      15.23330       6.219885  ?        ?        259.9607 62.40104 0.000000       62.40104 
1 1 1 5   22 0  o 1111.328 20.14605 240.5508       8.694811      239.1022       10.09118      244.7259       17.13107  1107.375 23.46493 1116.100 39.52331 -8.724609      45.96407 
1 1 1 5   22 1  o 798.9986 17.77688 124.2554       5.516068      130.5595       7.715412      117.6640       7.889290  818.1816 24.28183 776.4507 26.16352 41.73096       35.69505 
1 1 1 5   22 2  o 360.1149 28.65018 25.49316       3.973655      27.20197       5.443277      23.54350       5.814240  370.3248 38.40709 342.8894 44.72806 27.43539       58.95510 
1 1 1 5   22 3  o 621.8851 19.31247 75.30644       4.664188      72.38079       6.221765      79.06013       7.047445  608.9586 26.30861 636.1474 28.52633 -27.18884      38.80585 
1 1 1 5   22 4  o 1032.469 16.22807 207.4038       6.506864      214.5875       8.968575      199.4199       9.454861  1049.322 22.00831 1011.195 24.07645 38.12708       32.61964 
1 1 1 5   22 5  o 98.10626 44.12525 -1.676639      3.520821      -3.751619      4.427333      1.893312       5.807193  101.3587 47.02688 152.2290 62.13202 -50.87030      77.92250 
1 1 1 5   22 6  o 616.5378 19.56520 74.02951       4.684594      74.79658       6.124238      72.94772       7.272891  619.0873 25.47254 609.9221 30.80438 9.165161       39.97199 
1 1 1 5   22 7  o 362.7270 27.51159 25.84490       3.846601      27.49671       4.664903      22.33580       6.799232  373.3820 32.49474 331.2025 54.77605 42.17960       63.68928 
1 1 1 5   22 8  o 959.0551 18.86135 179.1060       7.024965      175.5446       7.916996      192.2922       15.23390  949.0753 21.47988 988.9770 39.66403 -39.90173      45.10677 
1 1 1 5   22 9  o 468.7940 20.33489 42.81620       3.702132      40.49611       3.935870      60.62764       10.90529  455.7675 22.23665 550.6359 51.59874 -94.86838      56.18629 
1 1 1 5   22 10 o 463.1961 20.72237 41.80918       3.727625      43.80499       3.991690      28.20434       10.42184  474.0431 21.68258 366.4468 75.73641 107.5963       78.77905 
1 1 1 5   22 11 o 886.4929 17.15755 152.9877       5.906884      152.9877       5.906884      0.000000       0.000000  886.4929 17.15755 ?        ?        0.000000       17.15755 
1 1 1 5   22 12 o 234.5341 43.04448 11.18929       3.776110      11.18929       3.776110      0.000000       0.000000  234.5341 43.04448 ?        ?        0.000000       43.04448 
1 1 1 5   22 13 o 210.6914 46.13148 9.133588       3.669998      9.256022       3.942729      8.339335       10.04212  211.7042 48.93546 224.3838 84.57381 -12.67952      97.71085 
1 1 1 5   22 14 o 1063.867 19.81479 220.7429       8.186626      230.0559       9.838662      199.7827       14.76013  1085.151 23.34628 1006.290 37.76932 78.86163       44.40237 
1 1 1 5   22 15 o 746.9907 17.83263 108.7843       5.173191      103.6740       5.617162      137.3327       13.27640  728.8870 19.84398 832.1763 41.08062 -103.2894      45.62237 
1 1 1 5   22 16 o 335.1130 33.34063 22.35546       4.281429      21.76904       4.708419      25.15586       10.28913  329.5911 37.44999 339.1089 79.50919 -9.517822      87.88750 
1 1 1 5   22 17 o 466.6664 34.48757 43.30295       6.205969      45.22768       7.718545      39.78336       10.43750  474.2149 42.35722 435.2536 63.62762 38.96136       76.43695 
1 1 1 5   22 18 o 319.7425 32.46447 20.41869       3.975316      15.86755       5.911455      24.17597       5.371191  273.4241 57.49478 345.5957 40.80700 -72.17163      70.50433 
1 1 1 5   22 19 o 519.9585 22.54446 53.03601       4.552358      59.45636       6.670787      47.43967       6.228010  547.0283 31.53435 487.8735 33.06634 59.15479       45.69243 
1 1 1 5   22 20 o 186.3335 53.30170 7.384258       4.051724      14.38399       5.723059      0.3504510      5.736974  257.6722 58.52503 137.5744 59.25027 120.0978       83.28129 
1 1 1 5   22 21 o 257.1711 44.31305 13.82904       4.265935      21.85698       6.088387      6.087014       5.978988  321.8145 50.36748 178.6066 65.64781 143.2079       82.74369 
1 1 1 5   22 22 f 368.6430 31.60781 27.34637       4.481339      26.69003       6.280065      28.02730       6.396685  357.1844 46.36726 366.3477 45.97321 -9.163361      65.29517 
1 1 1 5   23 0  o 659.7353 20.76034 84.82406       5.319026      89.05997       7.321289      80.08894       7.740696  675.0145 27.92842 639.6013 31.16325 35.41327       41.84668 
1 1 1 5   23 1  o 492.1051 29.39951 47.52933       5.592882      41.88029       6.244078      70.45354       12.57848  460.7315 35.16287 592.4266 55.31189 -131.6951      65.54260 
1 1 1 5   23 2  o 464.2578 25.18304 42.19494       4.523428      41.83336       5.999603      42.67121       6.885743  460.7704 33.76327 464.3781 38.52934 -3.607605      51.22957 
1 1 1 5   23 3  o 167.9821 53.55054 5.518377       3.937805      3.869511       5.182479      7.770694       6.057029  160.8254 60.72296 200.5898 66.59688 -39.76437      90.12448 
1 1 1 5   23 4  f 715.4788 18.84383 99.69367       5.235932      98.96294       6.871322      100.7055       8.085385  712.0805 24.84753 717.6592 29.01045 -5.578735      38.19693 
1 1 1 5   23 5  o 532.0443 22.06565 55.18793       4.559241      47.98349       5.767233      67.19311       7.444781  494.3368 30.18581 584.7263 32.91863 -90.38956      44.66340 
1 1 1 5   23 6  o 702.5585 29.09449 96.52156       7.938183      0.000000       0.000000      96.52156       7.938183  ?        ?        702.5585 29.09449 0.000000       29.09449 
1 1 1 5   23 7  o 497.4432 22.56556 48.25662       4.359309      49.77583       5.474804      45.62483       7.205844  503.8503 28.09122 480.1258 38.98234 23.72446       48.04935 
1 1 1 5   23 8  o 578.0964 23.25730 65.19893       5.221407      61.43027       5.753410      82.79638       12.43246  560.7583 26.41932 644.1693 50.09079 -83.41101      56.63097 
1 1 1 5   23 9  o 531.7792 19.50191 55.10033       4.027509      54.50097       4.298970      59.40156       11.51638  528.7407 20.93600 543.0249 55.38480 -14.28418      59.20972 
1 1 1 5   23 10 f 778.6393 17.73565 118.0794       5.363043      118.0794       5.363043      0.000000       0.000000  778.6393 17.73565 ?        ?        0.000000       17.73565 
1 1 1 5   23 11 o 763.4410 18.09476 113.5562       5.364832      113.5562       5.364832      0.000000       0.000000  763.4410 18.09476 ?        ?        0.000000       18.09476 
1 1 1 5   23 12 o 296.5342 32.40885 17.47421       3.671448      16.52716       3.914781      24.38963       10.57868  287.5464 35.83435 335.7260 81.87202 -48.17950      89.37074 
1 1 1 5   23 13 o 477.0474 23.20757 44.48582       4.299511      44.44080       4.641147      44.75835       11.41769  475.8726 25.20328 464.2405 65.12117 11.63211       69.82816 
1 1 1 5   23 14 o 519.8237 22.38050 52.83060       4.518078      52.04852       4.952259      56.71327       11.03416  515.5723 24.73351 527.2496 54.68360 -11.67731      60.01702 
1 1 1 5   23 15 o 165.1642 56.20144 5.227749       4.312458      6.039574       4.842532      2.116618       9.479827  176.1924 59.55735 183.3862 77.47014 -7.193848      97.71745 
1 1 1 5   23 16 o 189.5235 56.37633 7.485203       4.455791      2.652031       5.036901      24.88058       9.555738  147.3613 58.66363 336.7522 74.99251 -189.3909      95.21186 
1 1 1 5   23 17 o 148.4481 53.96859 3.862020       4.025001      3.985436       4.458192      3.317936       9.360636  153.0331 56.61053 186.4015 77.74702 -33.36844      96.17355 
1 1 1 5   23 18 o 234.5001 55.51100 11.78848       4.976922      10.94101       5.778405      14.22367       9.795121  224.4045 63.46787 252.7312 84.70758 -28.32677      105.8468 
1 1 1 5   23 19 o 331.9231 31.70053 22.09591       4.036633      25.07922       6.080781      19.74544       5.397439  347.9955 46.13139 308.0126 46.57662 39.98288       65.55522 
1 1 1 5   23 20 o 462.7881 24.75189 42.39619       4.432429      36.73759       6.571576      47.11901       6.003654  423.9719 40.40083 484.8842 32.06329 -60.91226      51.57792 
1 1 1 5   23 21 o 122.2418 50.41249 1.370801       3.872766      4.981775       5.568979      -2.010893      5.389277  166.1551 62.89573 119.4707 54.08245 46.68443       82.95050 
1 1 1 5   24 0  o 488.2373 38.61932 47.19881       7.262803      0.000000       0.000000      47.19881       7.262803  ?        ?        488.2373 38.61932 0.000000       38.61932 
1 1 1 5   24 1  o 348.4151 40.48975 24.22838       5.376444      29.17948       6.027761      4.960495       11.89111  382.6020 41.21838 218.3640 88.99207 164.2380       98.07417 
1 1 1 5   24 2  o 1151.772 20.40249 258.5594       9.125942      266.5665       10.72944      237.6145       17.35328  1168.721 23.63950 1098.030 40.69486 70.69092       47.06270 
1 1 1 5   24 3  o 1077.409 17.01688 225.9930       7.120141      227.6428       9.733459      224.0941       10.44271  1080.123 23.20416 1071.230 25.10167 8.893555       34.18373 
1 1 1 5   24 4  o 241.3285 45.85358 11.88784       4.140322      8.268633       5.294827      17.58341       6.642227  202.1460 61.75671 291.0340 60.73159 -88.88802      86.61534 
1 1 1 5   24 5  o 687.8407 19.52308 92.19385       5.215119      89.65337       6.803952      95.81208       8.119906  677.3998 25.86355 699.5593 29.88811 -22.15942      39.52496 
1 1 1 5   24 6  o 1453.691 17.00397 411.4613       9.599537      406.1090       12.98505      417.9120       14.25528  1442.517 23.17900 1462.692 25.09545 -20.17505      34.16208 
1 1 1 5   24 7  o 581.3056 21.19427 65.90415       4.784659      67.31683       6.021832      63.48517       7.879926  586.7909 26.42514 567.1137 35.96478 19.67719       44.62907 
1 1 1 5   24 8  o 812.2369 20.52744 128.6598       6.475085      133.6742       7.333952      110.9334       13.78919  827.4921 22.82161 745.6727 47.87000 81.81940       53.03171 
1 1 1 5   24 9  f 389.1622 26.88326 29.77905       4.038033      29.77905       4.038033      0.000000       0.000000  389.1622 26.88326 ?        ?        0.000000       26.88326 
1 1 1 5   24 10 o 210.6967 46.15641 9.164261       3.672298      9.164261       3.672298      0.000000       0.000000  210.6967 46.15641 ?        ?        0.000000       46.15641 
1 1 1 5   24 11 o 857.5477 16.46502 143.2912       5.483381      147.2779       5.998682      123.0316       13.52271  869.1474 17.77192 784.9153 44.54573 84.23212       47.96001 
1 1 1 5   24 12 o 301.9964 32.89502 18.17759       3.795578      19.60297       4.058006      8.214193       10.72881  313.5066 33.86834 224.2094 86.68903 89.29724       93.07014 
1 1 1 5   24 13 o 379.9270 27.89898 28.50670       4.087602      26.56384       4.386255      41.33385       11.27038  365.9091 31.16378 442.1760 67.79440 -76.26688      74.61409 
1 1 1 5   24 14 o 448.2284 27.04493 39.62307       4.685699      38.45535       5.202073      44.64445       10.78748  440.6019 30.59158 461.8677 61.68286 -21.26578      68.85216 
1 1 1 5   24 15 o 374.3083 31.52507 27.88401       4.539952      26.79350       5.112556      31.95067       9.872840  365.3517 36.52220 385.0419 68.53679 -19.69022      77.66056 
1 1 1 5   24 16 o 479.8597 23.51247 45.21388       4.381679      43.73034       4.823442      52.21813       10.48065  470.5034 26.50568 501.1395 54.74237 -30.63617      60.82169 
1 1 1 5   24 17 o 160.9427 54.27164 5.142567       4.021030      3.857371       4.466076      10.64404       9.240191  150.9970 56.50095 226.1114 81.83689 -75.11440      99.44664 
1 1 1 5   24 18 o 118.9414 50.30607 0.6437118      4.005037      2.386131       4.418684      -7.377331      9.480519  137.2030 54.83983 142.4738 66.98207 -5.270737      86.56792 
1 1 1 5   24 19 o 417.1579 33.50763 35.07044       5.382599      40.49223       6.288579      20.21475       10.40945  446.9182 36.55222 288.0117 86.28133 158.9065       93.70450 
1 1 1 5   24 20 o 314.0522 32.77916 19.97828       3.938945      27.23466       5.838649      13.91704       5.336214  362.5962 42.25558 251.6291 56.04382 110.9671       70.18863 
1 1 1 5   25 0  o 689.1757 32.10419 93.22971       8.592502      0.000000       0.000000      93.22971       8.592502  ?        ?        689.1757 32.10419 0.000000       32.10419 
1 1 1 5   25 1  o 549.8672 26.72746 59.15012       5.707468      50.89169       8.256770      66.70706       7.898313  505.5099 42.45145 581.3435 35.14960 -75.83365      55.11461 
1 1 1 5   25 2  o 399.8939 35.81249 31.71176       5.502793      32.45963       6.157338      28.74455       12.26464  403.6486 39.79697 363.5908 87.84166 40.05780       96.43628 
1 1 1 5   25 3  o 556.7203 27.03754 60.65112       5.845643      64.69155       6.560365      45.07988       12.87880  573.7988 29.54041 463.7592 73.99507 110.0396       79.67375 
1 1 1 5   25 4  o 824.4626 18.58664 132.4846       5.951135      127.6078       7.892597      138.9107       9.060009  807.8918 25.15584 842.3031 27.69697 -34.41125      37.41575 
1 1 1 5   25 5  o 1254.141 17.18900 306.4233       8.371914      318.9655       11.65403      293.0489       12.03448  1277.729 23.48603 1224.113 25.31498 53.61523       34.53175 
1 1 1 5   25 6  o 449.8938 26.61666 39.76206       4.629725      42.92499       5.854720      34.48344       7.563474  466.2072 32.54105 413.3448 48.01169 52.86240       58.00036 
1 1 1 5   25 7  o 570.9595 23.92715 63.74358       5.305476      69.51060       6.144923      46.85528       10.51559  595.7480 26.55986 478.5463 57.74979 117.2018       63.56465 
1 1 1 5   25 8  f 792.9049 23.30320 122.9349       7.175706      122.9349       7.175706      0.000000       0.000000  792.9049 23.30320 ?        ?        0.000000       23.30320 
1 1 1 5   25 9  o 348.1573 29.17743 23.97265       3.908656      23.54000       4.095858      28.38364       13.07823  344.5923 30.93589 355.0561 93.54044 -10.46381      98.52332 
1 1 1 5   25 10 o 193.1507 47.75407 7.771805       3.561832      7.357702       3.787081      10.94552       10.48418  187.9372 50.71365 238.5755 87.04542 -50.63831      100.7411 
1 1 1 5   25 11 f 904.1468 16.46307 159.4137       5.780665      159.2641       6.299044      160.2118       14.55127  903.3590 17.95504 896.0869 41.81409 7.272095       45.50606 
1 1 1 5   25 12 o 715.4095 17.91404 99.92219       4.977098      98.70140       5.359955      107.5633       13.40976  710.6893 19.42019 729.0233 47.62608 -18.33392      51.43332 
1 1 1 5   25 13 o 371.6501 29.95230 27.42976       4.286373      24.89486       4.644105      42.00811       11.13719  352.6972 34.34122 443.6365 66.70755 -90.93924      75.02811 
1 1 1 5   25 14 o 265.5670 40.29273 14.42606       4.025086      13.82773       4.446673      17.14016       9.470645  257.9812 46.07376 274.9896 82.28020 -17.00836      94.30177 
1 1 1 5   25 15 o 252.1953 39.41880 13.04601       3.734351      13.47843       4.085972      10.85301       9.201546  255.3057 42.71978 227.7934 81.76718 27.51234       92.25428 
1 1 1 5   25 16 o 351.4387 28.96020 24.63419       3.917371      21.61138       4.247402      41.84897       10.13604  327.3976 33.89665 441.6021 60.70863 -114.2045      69.53072 
1 1 1 5   25 17 o 91.83960 42.66986 -2.865102      3.664547      -3.432559      4.023781      -0.1060257     8.872581  94.60475 44.20655 162.5539 71.75797 -67.94916      84.28182 
1 1 1 5   25 18 o 285.7054 38.35220 16.79712       4.147919      14.84962       4.586358      25.54705       9.721440  265.0521 46.23792 329.3216 77.33204 -64.26956      90.10100 
1 1 1 5   25 19 o 89.08241 42.29337 -4.337310      3.955759      -5.953744      4.342936      3.534946       9.584157  88.50245 42.62774 181.5427 77.34273 -93.04029      88.31207 
1 1 1 5   26 0  o 192.1880 66.04705 7.103581       5.957895      -3.145020      10.77429      11.61772       7.150625  173.0012 77.54751 235.1178 71.75466 -62.11661      105.6520 
1 1 1 5   26 1  o 124.1829 53.20305 0.4276179E-01  4.581238      0.7191584      5.855379      -1.024792      7.356126  143.6140 60.78873 150.1120 65.83262 -6.497955      89.60583 
1 1 1 5   26 2  f 314.5992 43.62180 20.04655       5.186117      14.15166       7.326327      25.96710       7.342252  257.2249 71.00969 354.9571 55.04552 -97.73218      89.84646 
1 1 1 5   26 3  f 211.7170 60.39438 9.378502       5.209223      6.782038       5.757894      21.08762       12.22741  188.2959 64.91646 308.2677 93.77569 -119.9719      114.0527 
1 1 1 5   26 4  o 234.4544 55.49027 11.54337       4.973917      6.551281       5.460577      35.86446       12.05282  184.6120 63.23975 407.1265 79.08120 -222.5145      101.2576 
1 1 1 5   26 5  o 515.1780 24.76425 51.98388       4.954621      54.30875       6.253008      48.06192       8.121582  524.4626 30.83625 489.3394 43.17967 35.12323       53.05995 
1 1 1 5   26 6  o 359.5848 35.98640 25.82226       4.957900      28.62052       5.703772      17.17270       10.02802  377.7272 39.46541 279.9532 84.87094 97.77405       93.59805 
1 1 1 5   26 7  o 204.2747 55.70798 8.766775       4.541348      10.45489       5.108286      2.402840       9.918286  222.2799 58.41264 188.0439 79.32890 34.23602       98.51452 
1 1 1 5   26 8  o 291.9148 38.82822 17.22003       4.292619      24.90059       5.140418      -0.4767358     7.802769  352.0809 38.20804 156.1476 68.15739 195.9332       78.13632 
1 1 1 5   26 9  o 504.8082 22.02382 49.88819       4.317647      50.57675       4.615991      45.07215       12.20787  508.0143 23.39704 458.7616 70.79981 49.25272       74.56564 
1 1 1 5   26 10 o 379.7150 26.80456 28.49412       3.927317      29.11877       4.187223      23.92587       11.32353  383.4902 28.31565 323.3209 87.88022 60.16931       92.32935 
1 1 1 5   26 11 o 506.2590 22.04906 50.23141       4.335018      50.75700       4.678651      47.04259       11.52427  508.5380 23.69023 470.3064 64.81864 38.23163       69.01220 
1 1 1 5   26 12 o 105.8808 46.90660 -0.9805865     3.824279      -0.2351928     4.158662      -5.064514      9.734189  115.5098 50.09447 153.8395 70.78719 -38.32974      86.71956 
1 1 1 5   26 13 o 234.5005 45.56941 11.51037       4.000453      10.43703       4.393899      16.71131       9.672149  221.1064 52.03658 269.4969 83.65770 -48.39043      98.52115 
1 1 1 5   26 14 o 136.6481 49.71252 3.305215       3.416033      4.553134       3.677427      -4.548551      9.225497  152.2495 51.89832 149.5509 68.85048 2.698669       86.21963 
1 1 1 5   26 15 o 392.4924 24.02178 30.48781       3.643924      30.27355       3.937089      31.76793       9.623301  390.4395 26.11592 377.6079 68.12954 12.83157       72.96352 
1 1 1 5   26 16 o 261.8233 36.48362 14.06194       3.608856      12.93158       3.967305      19.48298       8.688142  248.5444 42.63715 287.6035 76.46705 -39.05907      87.55077 
1 1 1 5   26 17 o 264.7388 36.82737 14.42115       3.683762      12.86063       4.035950      22.21005       9.016746  247.0073 43.67094 306.1405 76.15384 -59.13321      87.78700 
1 1 1 5   27 0  o 251.1797 63.42451 13.55205       6.188071      17.77126       11.73464      11.92682       7.283012  282.5293 92.64265 235.9357 72.48765 46.59361       117.6313 
1 1 1 5   27 1  o 198.7992 66.42617 7.977383       6.023243      10.24714       10.66946      6.915651       7.297260  233.3203 87.32517 196.0800 72.44801 37.24028       113.4654 
1 1 1 5   27 2  o 113.8295 50.60476 -1.323755      4.488992      -0.7209369     5.782777      -2.237819      7.120846  133.5792 58.48095 140.9063 63.11046 -7.327072      86.04041 
1 1 1 5   27 3  o 353.3507 35.35892 24.98542       4.787006      22.19934       6.105824      29.42964       7.711618  328.2301 49.43372 376.7914 54.26585 -48.56125      73.40623 
1 1 1 5   27 4  o 418.0540 46.21665 35.55539       7.377919      35.55539       7.377919      0.000000       0.000000  418.0540 46.21665 ?        ?        0.000000       46.21665 
1 1 1 5   27 5  o 232.4535 61.41880 11.58423       5.627747      11.58423       5.627747      0.000000       0.000000  232.4535 61.41880 ?        ?        0.000000       61.41880 
1 1 1 5   27 6  o 234.9864 54.01933 11.69823       4.826531      17.96223       5.451193      -11.03078      10.38379  294.2002 49.46659 143.0797 68.10099 151.1205       84.17059 
1 1 1 5   27 7  o 175.1590 55.51497 6.278353       4.236732      3.629443       5.142274      11.87675       7.475729  155.5275 60.04883 234.4185 73.67628 -78.89099      95.04765 
1 1 1 5   27 8  o 549.7402 23.38236 59.31536       4.991992      62.02109       6.239477      54.50298       8.321204  559.8997 28.79271 519.5236 41.59200 40.37610       50.58571 
1 1 1 5   27 9  f 217.6782 45.62407 9.922104       3.733534      11.22490       3.964052      -0.3121910     11.11040  231.8456 45.65111 181.8406 80.28407 50.00496       92.35560 
1 1 1 5   27 10 o 181.9462 49.90864 7.003977       3.632615      6.975247       3.856423      7.230161       10.82063  181.6391 52.01501 212.7771 85.54423 -31.13800      100.1168 
1 1 1 5   27 11 o 108.7570 47.63334 -0.5201827     3.839938      -2.075551      4.196143      7.491744       9.523622  104.4802 47.46454 206.8934 81.20033 -102.4132      94.05517 
1 1 1 5   27 12 o 399.5988 26.58237 31.69833       4.101671      35.67100       4.467288      10.36542       10.35207  423.7535 27.29095 225.3974 85.64901 198.3561       89.89188 
1 1 1 5   27 13 o 140.6539 51.01984 3.592960       3.594252      4.433405       3.892581      -1.268135      9.361598  151.5758 53.31167 161.5208 72.35142 -9.944946      89.87136 
1 1 1 5   27 14 o 451.0822 27.32803 40.52250       4.764729      38.11303       5.392294      49.10419       10.17652  435.3463 32.12099 478.9582 55.75422 -43.61188      64.34509 
1 1 1 5   27 15 o 154.7126 48.51937 5.015153       3.244093      4.172796       3.510741      9.937013       8.486240  145.7617 50.66505 213.4909 78.24950 -67.72926      93.21980 
1 1 1 5   27 16 o 445.8906 22.29348 39.23902       3.860416      40.55500       4.261217      33.21415       9.117637  451.9826 24.36640 385.9810 62.99953 66.00162       67.54748 
1 1 1 5   28 0  o 270.4313 52.48722 15.44555       5.313566      16.49860       6.342406      12.96627       9.731771  276.4289 60.73880 244.3877 84.38740 32.04118       103.9732 
1 1 1 5   28 1  o 242.2155 64.53682 12.80562       6.180127      11.12942       10.60652      13.66722       7.604374  234.8605 87.23111 248.3599 73.59669 -13.49939      114.1304 
1 1 1 5   28 2  o 675.7682 28.13153 90.12679       7.382765      62.24011       12.18838      106.2879       9.278602  544.7029 58.53642 731.8152 32.64774 -187.1124      67.02528 
1 1 1 5   28 3  o 142.6038 57.37767 2.368565       4.872293      2.800062       5.776386      1.304578       9.070586  154.2295 62.32703 173.3706 74.58485 -19.14108      97.19855 
1 1 1 5   28 4  f 369.1431 36.23421 27.43458       5.127520      27.32637       6.029613      27.71727       9.745290  365.6872 43.29794 353.1021 73.45898 12.58511       85.26977 
1 1 1 5   28 5  o 111.0850 49.82883 -1.594114      4.456849      -1.114081      5.440668      -2.573344      7.770685  126.3152 55.95424 144.5149 65.22365 -18.19975      85.93603 
1 1 1 5   28 6  o 242.0415 61.16405 12.77829       5.751713      12.86445       6.567552      12.49469       11.91533  241.2413 67.46494 244.6341 92.14087 -3.392715      114.1992 
1 1 1 5   28 7  o 128.4955 54.26265 0.8376663      4.648207      0.1166257      5.115749      4.250251       11.12938  129.2280 55.80210 199.1366 84.02193 -69.90855      100.8641 
1 1 1 5   28 8  o 373.9196 31.32609 27.98219       4.507045      29.82894       5.577991      24.50885       7.649748  383.5490 37.94579 336.4336 60.78617 47.11545       71.65781 
1 1 1 5   28 9  o 164.1584 53.31009 5.547906       3.889170      3.008048       4.194099      21.13403       10.38970  140.3159 54.21536 297.2636 85.44955 -156.9477      101.1975 
1 1 1 5   28 10 o 527.5192 23.38545 54.84655       4.790843      54.63558       5.240293      55.92054       11.82366  525.7081 25.66746 508.7223 61.06749 16.98581       66.24241 
1 1 1 5   28 11 o 628.3580 19.35341 77.50340       4.722724      79.71103       5.169457      66.36118       11.61362  636.6712 20.90748 559.2791 54.14806 77.39209       58.04425 
1 1 1 5   28 12 o 343.7995 29.58117 23.72711       3.911100      22.70161       4.264290      29.15985       9.814935  334.8094 33.23520 354.7152 73.65820 -19.90585      80.80909 
1 1 1 5   28 13 o 394.9919 26.19961 31.09185       3.996125      32.55854       4.383552      23.87751       9.722017  403.4487 28.15406 314.4919 79.54596 88.95682       84.38134 
1 1 1 5   28 14 o 271.7111 35.85857 15.17269       3.691359      21.29206       4.096744      -11.23802      8.510905  323.7787 33.04397 120.9467 58.60070 202.8321       67.27515 
1 1 1 5   29 0  o 585.7559 23.79923 67.60636       5.413867      69.43597       7.244141      65.29169       8.148051  589.5104 31.75942 568.6922 37.09657 20.81824       48.83458 
1 1 1 5   29 1  o 430.0747 32.81999 37.11246       5.440253      32.35593       6.692489      46.37828       9.340804  396.2063 44.25074 470.2653 52.01725 -74.05905      68.29292 
1 1 1 5   29 2  o 193.4608 69.56578 7.544249       6.663074      -2.831403      10.68871      14.13881       8.521393  166.7577 75.75574 248.0810 78.74292 -81.32324      109.2675 
1 1 1 5   29 3  o 289.6700 55.57452 18.07066       6.024429      14.56419       10.57916      19.75348       7.328832  251.1839 87.91348 298.1581 65.11728 -46.97418      109.4031 
1 1 1 5   29 4  o 262.0737 46.20460 14.43893       4.530736      9.315094       5.917380      21.69881       7.043635  206.5545 65.62360 315.6935 59.63738 -109.1390      88.67398 
1 1 1 5   29 5  o 599.5630 22.61740 70.78050       5.266299      66.13087       6.752169      78.00155       8.414608  575.6426 30.31066 622.5857 34.94346 -46.94312      46.25777 
1 1 1 5   29 6  o 160.7172 56.69369 5.058121       4.405200      12.72797       5.403867      -10.13578      7.605820  240.3364 58.45806 115.8958 55.96973 124.4407       80.93179 
1 1 1 5   29 7  o 331.7441 43.77038 22.88059       5.501423      25.47344       6.474075      16.14344       10.43583  347.3334 49.38677 258.7995 87.43070 88.53384       100.4150 
1 1 1 5   29 8  o 151.4442 59.57702 3.510176       5.138022      3.957247       6.014306      2.302481       9.884994  161.3001 64.13770 178.7205 77.37016 -17.42041      100.4977 
1 1 1 5   29 9  o 253.0443 55.80501 14.07841       5.336631      12.01896       6.285151      19.39906       10.10237  229.4652 66.60641 280.0592 85.24799 -50.59401      108.1833 
1 1 1 5   29 10 o 208.9467 47.41890 9.411263       3.759678      8.856563       4.061794      12.72941       9.934299  201.2527 51.69628 233.3650 84.79472 -32.11232      99.31087 
1 1 1 5   29 11 o 370.6642 27.61015 27.50094       3.945955      27.93765       4.282272      25.04374       10.15777  372.6838 29.83752 319.4322 81.59003 53.25162       86.87468 
1 1 1 5   30 0  o 284.8953 47.26140 17.25068       5.045750      12.47646       6.225628      26.39053       8.613941  233.3796 65.83338 340.2564 67.57077 -106.8768      94.33898 
1 1 1 5   30 1  o 306.6573 44.65009 19.75479       5.161355      25.98083       6.424690      8.423339       8.667401  350.1295 48.55639 203.5234 78.12352 146.6061       91.98373 
1 1 1 5   30 2  o 386.7060 31.80308 30.16825       4.733822      24.50144       6.261768      37.72675       7.231789  339.6866 48.87409 425.5477 44.41365 -85.86102      66.03976 
1 1 1 5   30 3  o 173.3957 63.46848 5.950232       5.580334      0.7031818      10.09200      8.261045       6.697335  172.2024 76.24770 196.2791 69.83251 -24.07668      103.3939 
1 1 1 5   30 4  o 430.5510 43.10493 38.49617       7.110589      43.19239       11.06395      35.19148       9.281129  437.3603 67.29658 398.3392 62.01344 39.02109       91.51228 
1 1 1 5   30 5  o 311.3008 37.88657 19.95950       4.485843      21.47991       5.749649      17.59433       7.171186  317.8558 48.08031 276.0336 67.46577 41.82214       82.84532 
1 1 1 5   30 6  o 375.9618 36.22723 28.88992       5.223939      31.08340       7.165869      26.40202       7.631639  382.2505 49.42953 345.7476 58.95133 36.50290       76.93203 
1 1 1 5   30 7  o 141.0580 55.88337 2.935783       4.550420      8.142753       5.987995      -4.180978      7.000516  192.8710 66.21758 127.0239 59.00338 65.84709       88.69141 
1 1 1 5   30 8  o 90.13981 43.49337 -6.319022      4.568629      -7.888359      5.121740      -0.2076920     10.10712  92.50635 44.96835 167.5550 75.10707 -75.04863      87.53985 
1 1 1 5   31 0  o 114.1804 50.67416 -0.6937699     4.482761      7.334596       6.175934      -9.633262      6.516967  184.9696 66.91152 103.8522 50.53945 81.11740       83.85337 
1 1 1 5   31 1  o 249.5249 49.30726 13.55122       4.608648      5.214458       6.167143      24.09486       6.935542  168.7000 65.58539 330.1011 56.10917 -161.4011      86.31155 
1 1 1 5   31 2  o 98.45765 46.01979 -3.437539      4.365457      -2.133276      5.815668      -5.120978      6.607175  122.3199 55.68819 118.8315 55.88332 3.488350       78.89309 
1 1 1 5   31 3  o 198.1624 55.05714 8.774605       4.388930      11.95911       5.811321      4.546659       6.696047  227.4573 63.40964 167.2228 67.27106 60.23450       92.44554 
1 1 1 6   0  0  o 421.8879 18.89196 34.79711       3.081165      34.79711       3.081165      34.79711       3.081165  421.8879 18.89196 421.8879 18.89196 0.000000       0.000000 
1 1 1 6   0  1  o 875.6948 16.74009 149.1616       5.688271      149.1616       5.688271      149.1616       5.688271  875.6948 16.74009 875.6948 16.74009 0.000000       0.000000 
1 1 1 6   0  2  o 763.3126 16.55043 113.3669       4.900930      113.3669       4.900930      113.3669       4.900930  763.3126 16.55043 763.3126 16.55043 0.000000       0.000000 
1 1 1 6   0  3  o 1539.726 20.57673 461.0430       12.29910      461.0430       12.29910      461.0430       12.29910  1539.726 20.57673 1539.726 20.57673 0.000000       0.000000 
1 1 1 6   0  4  o 452.8812 22.62585 40.17126       3.956737      40.17126       3.956737      40.17126       3.956737  452.8812 22.62585 452.8812 22.62585 0.000000       0.000000 
1 1 1 6   0  5  o 1217.603 19.23494 288.3611       9.090340      288.3611       9.090340      288.3611       9.090340  1217.603 19.23494 1217.603 19.23494 0.000000       0.000000 
1 1 1 6   0  6  o 597.2493 19.90775 69.56904       4.605864      69.56904       4.605864      69.56904       4.605864  597.2493 19.90775 597.2493 19.90775 0.000000       0.000000 
1 1 1 6   0  7  o 691.8817 19.20002 93.26933       5.149967      93.26933       5.149967      93.26933       5.149967  691.8817 19.20002 691.8817 19.20002 0.000000       0.000000 
1 1 1 6   0  8  o 538.2935 20.61720 56.59239       4.295640      56.59239       4.295640      56.59239       4.295640  538.2935 20.61720 538.2935 20.61720 0.000000       0.000000 
1 1 1 6   0  9  o 549.6577 20.71489 59.01362       4.407583      59.01362       4.407583      59.01362       4.407583  549.6577 20.71489 549.6577 20.71489 0.000000       0.000000 
1 1 1 6   0  10 o 326.6479 28.57887 21.26738       3.561537      21.26738       3.561537      21.26738       3.561537  326.6479 28.57887 326.6479 28.57887 0.000000       0.000000 
1 1 1 6   0  11 o 691.4482 20.16784 93.28311       5.405182      93.28311       5.405182      93.28311       5.405182  691.4482 20.16784 691.4482 20.16784 0.000000       0.000000 
1 1 1 6   0  12 o 500.9330 23.20538 49.20383       4.492293      49.20383       4.492293      49.20383       4.492293  500.9330 23.20538 500.9330 23.20538 0.000000       0.000000 
1 1 1 6   0  13 o 932.7594 28.12683 170.3001       10.16772      170.3001       10.16772      170.3001       10.16772  932.7594 28.12683 932.7594 28.12683 0.000000       0.000000 
1 1 1 6   0  14 f 742.2527 30.35509 108.1641       8.716805      108.1641       8.716805      108.1641       8.716805  742.2527 30.35509 742.2527 30.35509 0.000000       0.000000 
1 1 1 6   0  15 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 6   0  16 f 625.1691 23.93686 76.45686       5.792216      76.45686       5.792216      76.45686       5.792216  625.1691 23.93686 625.1691 23.93686 0.000000       0.000000 
1 1 1 6   0  17 o 198.3869 65.46213 9.897950       4.480219      9.897950       4.480219      9.897950       4.480219  198.3869 65.46213 198.3869 65.46213 0.000000       0.000000 
1 1 1 6   0  18 o 145.0914 79.61363 5.891783       6.451321      5.891783       6.451321      5.891783       6.451321  145.0914 79.61363 145.0914 79.61363 0.000000       0.000000 
1 1 1 6   0  19 o 602.6265 37.22733 71.68637       8.636221      71.68637       8.636221      71.68637       8.636221  602.6265 37.22733 602.6265 37.22733 0.000000       0.000000 
1 1 1 6   0  20 o 495.2985 31.65183 48.39260       6.031259      48.39260       6.031259      48.39260       6.031259  495.2985 31.65183 495.2985 31.65183 0.000000       0.000000 
1 1 1 6   0  21 o 353.9309 69.01252 27.29902       8.452335      27.29902       8.452335      27.29902       8.452335  353.9309 69.01252 353.9309 69.01252 0.000000       0.000000 
1 1 1 6   0  22 o 362.7094 47.30876 27.07348       6.350342      27.07348       6.350342      27.07348       6.350342  362.7094 47.30876 362.7094 47.30876 0.000000       0.000000 
1 1 1 6   0  23 o 148.1530 78.29874 6.401255       6.024608      6.401255       6.024608      6.401255       6.024608  148.1530 78.29874 148.1530 78.29874 0.000000       0.000000 
1 1 1 6   0  24 o 453.9489 40.46910 41.35083       7.004009      41.35083       7.004009      41.35083       7.004009  453.9489 40.46910 453.9489 40.46910 0.000000       0.000000 
1 1 1 6   0  25 o 736.7598 30.28214 106.6140       8.631168      106.6140       8.631168      106.6140       8.631168  736.7598 30.28214 736.7598 30.28214 0.000000       0.000000 
1 1 1 6   0  26 o 160.9703 91.83030 7.347243       9.003815      7.347243       9.003815      7.347243       9.003815  160.9703 91.83030 160.9703 91.83030 0.000000       0.000000 
1 1 1 6   0  27 o 560.6738 38.26361 62.86790       8.242434      62.86790       8.242434      62.86790       8.242434  560.6738 38.26361 560.6738 38.26361 0.000000       0.000000 
1 1 1 6   0  28 o 301.9323 72.03709 21.42855       7.329315      21.42855       7.329315      21.42855       7.329315  301.9323 72.03709 301.9323 72.03709 0.000000       0.000000 
1 1 1 6   0  29 o 253.3594 83.21098 17.13091       7.263038      17.13091       7.263038      17.13091       7.263038  253.3594 83.21098 253.3594 83.21098 0.000000       0.000000 
1 1 1 6   0  30 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 6   0  31 o 105.5196 74.31601 -8.627084      11.98864      -8.627084      11.98864      -8.627084      11.98864  105.5196 74.31601 105.5196 74.31601 0.000000       0.000000 
1 1 1 6   0  32 o 119.5996 80.88897 -0.8049112E-01 11.05489      -0.8049112E-01 11.05489      -0.8049112E-01 11.05489  119.5996 80.88897 119.5996 80.88897 0.000000       0.000000 
1 1 1 6   1  0  o 912.0403 11.96840 161.6318       4.239142      161.1542       5.984191      162.1129       6.005972  910.3767 16.92608 913.0796 16.93740 -2.702881      23.94510 
1 1 1 6   1  1  o 1506.456 14.11267 441.0826       8.256455      438.0760       11.59068      444.1797       11.76404  1500.616 19.88892 1511.012 20.04752 -10.39526      28.23955 
1 1 1 6   1  2  o 1158.846 12.83164 260.9647       5.774788      260.7245       6.723130      261.6407       11.27733  1158.154 14.94779 1159.100 25.05286 -0.9456787     29.17332 
1 1 1 6   1  3  o 555.6921 13.76840 60.01297       2.971295      58.54984       6.221636      60.44529       3.381886  547.2495 29.38209 557.6204 15.61681 -10.37091      33.27449 
1 1 1 6   1  4  o 1311.189 13.87391 334.1306       7.064674      333.7149       9.953141      334.5528       10.02921  1309.794 19.56722 1311.423 19.69228 -1.628540      27.76080 
1 1 1 6   1  5  o 776.9340 13.06219 117.3067       3.941196      123.0863       5.709897      112.0475       5.446793  795.5160 18.48210 759.0060 18.47854 36.50995       26.13512 
1 1 1 6   1  6  o 651.1257 13.60164 82.40195       3.439410      89.26337       5.053433      76.48064       4.694497  677.3748 19.21009 626.9966 19.27950 50.37817       27.21630 
1 1 1 6   1  7  o 274.2159 21.93728 14.73268       2.316606      16.55999       3.374502      13.10384       3.185972  289.7244 30.44684 256.9994 32.65891 32.72498       44.64991 
1 1 1 6   1  8  o 575.0914 14.24237 64.29957       3.180879      66.53792       4.541291      62.14375       4.456783  584.6650 20.00066 565.0082 20.31135 19.65686       28.50574 
1 1 1 6   1  9  o 807.8040 13.35936 126.8660       4.191020      130.7729       6.039002      123.2362       5.821002  819.6345 18.97217 795.6793 18.83787 23.95514       26.73590 
1 1 1 6   1  10 o 382.4867 17.89105 28.48093       2.657542      32.69821       3.748671      24.21988       3.768068  408.7497 23.71718 350.9861 27.87346 57.76358       36.59828 
1 1 1 6   1  11 o 449.8512 16.88632 39.39935       2.950067      39.68963       4.153600      39.10386       4.190698  450.2928 23.83696 446.8868 24.23751 3.406036       33.99496 
1 1 1 6   1  12 o 320.3342 25.38606 20.18060       3.132243      18.07377       3.805824      24.60355       5.514297  301.6597 33.02612 350.6054 41.29049 -48.94574      52.87371 
1 1 1 6   1  13 o 509.3870 19.42054 50.58566       3.841821      50.22180       4.713511      51.30579       6.631050  507.0275 23.93784 509.8947 33.67646 -2.867249      41.31736 
1 1 1 6   1  14 o 684.8213 17.65323 91.35232       4.694932      82.36964       7.985846      96.09695       5.803888  648.0128 31.73287 701.8787 21.29261 -53.86591      38.21453 
1 1 1 6   1  15 o 1207.575 17.02836 283.9016       7.985738      277.2142       13.69596      287.3462       9.829565  1190.105 29.63326 1214.085 20.84766 -23.97986      36.23196 
1 1 1 6   1  16 o 695.0193 15.89975 93.98049       4.291559      96.35738       6.086906      91.63110       6.051609  703.0930 22.29235 685.5812 22.72919 17.51172       31.83653 
1 1 1 6   1  17 o 400.3934 25.75054 31.39226       3.982829      27.96238       6.769631      33.20798       4.925493  373.8131 47.72068 411.0956 31.08130 -37.28247      56.95007 
1 1 1 6   1  18 o 359.1778 29.43575 25.34019       4.069870      26.45581       6.800436      24.71764       5.080074  363.3954 49.47280 353.4186 37.58985 9.976868       62.13336 
1 1 1 6   1  19 o 612.2950 21.56160 72.96777       5.127075      68.69721       6.264358      81.63297       8.923245  593.7012 27.16943 645.3501 35.74352 -51.64886      44.89741 
1 1 1 6   1  20 o 686.2887 22.00346 91.66925       5.864429      97.82981       10.03898      88.47792       7.225457  706.5745 36.71154 673.7863 27.61310 32.78827       45.93713 
1 1 1 6   1  21 o 616.3387 20.14906 73.91614       4.822833      72.70681       6.702248      75.21475       6.945273  610.6635 28.26120 621.0579 28.79581 -10.39441      40.34717 
1 1 1 6   1  22 o 378.1013 30.22177 28.08412       4.400594      32.55443       6.053259      23.07342       6.408700  405.8446 38.88213 338.7018 50.24536 67.14276       63.53279 
1 1 1 6   1  23 o 1117.528 19.85440 243.1270       8.616742      242.6028       10.40891      244.2686       15.35994  1115.657 24.02407 1117.021 35.40789 -1.364136      42.78873 
1 1 1 6   1  24 o 750.4677 19.88754 109.6628       5.796168      106.5462       8.071147      112.9816       8.328969  738.7096 28.13413 760.6827 28.19420 -21.97308      39.83017 
1 1 1 6   1  25 o 1387.321 20.32215 374.9171       10.94901      378.3717       13.52083      368.3365       18.66129  1392.562 25.00121 1370.794 35.05432 21.76794       43.05654 
1 1 1 6   1  26 o 538.9360 26.36720 56.75895       5.518605      62.54419       7.733622      50.75671       7.877335  563.2020 35.54054 505.9438 40.42886 57.25818       53.82957 
1 1 1 6   1  27 o 132.9505 55.83712 0.7380580      4.878471      7.357716       6.853705      -6.060326      6.945612  199.6449 70.68431 124.8108 58.23997 74.83401       91.58693 
1 1 1 6   1  28 o 543.6335 30.56368 58.31023       6.426495      47.63110       10.33082      65.05138       8.207932  481.9310 56.25653 572.1874 37.13830 -90.25641      67.40958 
1 1 1 6   1  29 o 568.0488 26.15825 63.38276       5.770617      73.73972       8.358459      53.95029       7.976691  608.8090 35.50633 518.7524 39.90049 90.05652       53.41113 
1 1 1 6   1  30 o 327.5088 44.90228 22.04777       5.560741      21.10440       7.599197      23.13517       8.158733  311.5481 64.91422 325.6333 66.75758 -14.08524      93.11515 
1 1 1 6   1  31 o 416.8751 43.14387 35.65619       6.883696      37.07587       8.153027      32.13163       12.84626  420.8982 50.91371 363.9779 91.09678 56.92035       104.3591 
1 1 1 6   1  32 o 535.1884 33.47658 57.63081       6.922885      47.00195       12.41062      62.43209       8.341205  455.1475 72.65561 553.6898 39.04140 -98.54236      82.48071 
1 1 1 6   2  0  o 728.7534 11.83223 103.1933       3.348691      103.4935       4.723717      102.8900       4.747902  729.5708 16.67203 727.4326 16.80665 2.138245       23.67319 
1 1 1 6   2  1  o 495.9670 17.67185 47.83482       3.403790      0.000000       0.000000      47.83482       3.403790  ?        ?        495.9670 17.67185 0.000000       17.67185 
1 1 1 6   2  2  o 1116.082 12.70367 242.0560       5.506216      243.1915       6.468822      239.0695       10.49097  1118.539 14.89176 1108.060 24.37949 10.47925       28.56788 
1 1 1 6   2  3  o 599.3201 12.84265 69.79876       2.989108      67.55221       4.161207      72.19379       4.296514  589.3702 18.18039 609.2832 18.15804 -19.91296      25.69515 
1 1 1 6   2  4  o 748.2081 12.87846 108.7882       3.742090      93.85826       7.427309      113.8674       4.332107  694.0043 27.55760 765.3915 14.57430 -71.38721      31.17421 
1 1 1 6   2  5  o 731.6961 13.20861 104.0474       3.753322      103.7200       5.364392      104.3614       5.253347  730.2156 18.91652 732.5000 18.46718 -2.284363      26.43618 
1 1 1 6   2  6  o 827.8268 13.04575 133.1870       4.194078      133.4461       5.955854      132.9321       5.907091  828.2596 18.51610 826.6722 18.39977 1.587402       26.10359 
1 1 1 6   2  7  o 645.9631 13.64824 81.10888       3.423833      82.10840       4.883852      80.14288       4.801266  649.5871 19.35963 641.7717 19.26403 7.815369       27.31114 
1 1 1 6   2  8  o 453.3086 15.72984 39.96268       2.769149      34.37453       3.942859      45.40202       3.890011  419.2759 24.31941 482.9003 20.74270 -63.62442      31.96394 
1 1 1 6   2  9  o 601.0432 14.24561 70.24809       3.325177      63.98382       4.625096      76.95004       4.783947  573.1544 20.77884 628.6579 19.59494 -55.50354      28.56084 
1 1 1 6   2  10 o 985.5488 13.38367 188.8879       5.122492      192.5168       7.337412      185.4376       7.154642  994.2159 19.00353 975.7840 18.88018 18.43188       26.78797 
1 1 1 6   2  11 o 501.2044 18.17963 48.93164       3.538571      48.53660       4.409615      49.64613       5.930270  498.7335 22.76691 502.5195 30.53206 -3.786041      38.08594 
1 1 1 6   2  12 o 487.1271 18.82174 46.24668       3.560656      45.39055       4.360688      47.95943       6.167822  482.1272 23.28978 493.2692 32.37706 -11.14200      39.88343 
1 1 1 6   2  13 o 326.1219 22.51624 20.85996       2.834234      22.47655       4.050739      19.30953       3.966997  337.0758 31.30152 311.8156 33.27325 25.26022       45.68254 
1 1 1 6   2  14 o 177.7685 40.59928 6.480190       2.741352      5.371375       3.860127      7.608438       3.893806  165.5365 53.04607 192.0758 51.25003 -26.53934      73.75941 
1 1 1 6   2  15 o 855.1398 17.19068 142.3684       5.708976      144.1378       10.10763      141.5396       6.918164  858.0605 30.33218 852.1114 20.90579 5.949097       36.83875 
1 1 1 6   2  16 o 868.6708 21.24238 147.0271       7.166158      0.000000       0.000000      147.0271       7.166158  ?        ?        868.6708 21.24238 0.000000       21.24238 
1 1 1 6   2  17 o 907.1218 17.66335 160.1057       6.222524      151.4905       10.22239      165.1769       7.842967  880.7244 29.88716 920.8730 21.93071 -40.14868      37.07018 
1 1 1 6   2  18 o 806.7302 18.94660 126.6281       5.935914      126.5326       10.53887      126.6724       7.183785  804.6713 33.72466 806.4935 22.93636 -1.822205      40.78516 
1 1 1 6   2  19 o 546.7370 20.07036 58.16006       4.261493      60.31292       6.070470      56.06824       5.983786  555.5120 28.23134 535.4718 28.88156 20.04022       40.38754 
1 1 1 6   2  20 o 367.1604 32.01242 26.50277       4.518930      23.63074       5.420339      33.04889       8.183217  345.0377 41.27024 406.4951 53.10646 -61.45749      67.25719 
1 1 1 6   2  21 o 735.4575 18.32112 105.2124       5.232842      103.1683       7.220648      107.4735       7.594188  727.6822 25.55091 742.6324 26.33173 -14.95026      36.69072 
1 1 1 6   2  22 o 395.4698 29.26298 30.68749       4.462370      27.41704       6.135480      34.36028       6.501942  371.2563 43.37215 416.6886 40.69902 -45.43228      59.47734 
1 1 1 6   2  23 o 607.3436 22.02083 71.85402       5.193930      70.45848       7.122748      73.43872       7.590166  599.7488 30.68363 612.0968 32.04172 -12.34802      44.36392 
1 1 1 6   2  24 o 1003.663 25.03876 196.4624       9.759521      196.4624       9.759521      0.000000       0.000000  1003.663 25.03876 ?        ?        0.000000       25.03876 
1 1 1 6   2  25 o 806.1950 27.90485 126.9717       8.736708      126.9717       8.736708      0.000000       0.000000  806.1950 27.90485 ?        ?        0.000000       27.90485 
1 1 1 6   2  26 o 398.9790 33.40095 31.44290       5.127701      27.07550       7.104700      36.19132       7.408142  365.6173 51.46106 425.3381 45.55710 -59.72079      68.72910 
1 1 1 6   2  27 o 192.9320 59.83857 7.542675       4.949708      2.522139       6.826012      13.10964       7.187889  165.0049 67.35611 249.1215 70.90120 -84.11655      97.79482 
1 1 1 6   2  28 o 263.6234 52.23461 14.45588       5.158679      10.60895       6.972400      19.10874       7.668066  225.6413 71.18568 298.8708 67.64252 -73.22951      98.19833 
1 1 1 6   2  29 o 191.1892 64.40581 7.304249       5.662876      14.48076       9.017366      2.630907       7.276741  257.4407 80.91802 167.4440 69.08414 89.99670       106.3971 
1 1 1 6   2  30 o 255.0702 92.32435 14.11638       11.76051      0.000000       0.000000      14.11638       11.76051  ?        ?        255.0702 92.32435 0.000000       92.32435 
1 1 1 6   2  31 o 308.8289 69.36681 21.43363       8.116217      0.000000       0.000000      21.43363       8.116217  ?        ?        308.8289 69.36681 0.000000       69.36681 
1 1 1 6   2  32 o 411.4731 35.63879 34.32050       5.638744      24.55124       7.984949      44.03824       7.963870  332.1040 64.23431 460.9345 45.06598 -128.8305      78.46648 
1 1 1 6   3  0  o 971.6835 12.21805 183.4675       4.610570      184.9386       6.531322      182.0061       6.509395  975.2246 17.24521 967.4555 17.32533 7.769104       24.44513 
1 1 1 6   3  1  o 1231.681 13.18345 294.8164       6.306020      290.5195       7.264863      307.9479       12.70004  1222.498 15.30211 1257.318 26.00949 -34.82080      30.17695 
1 1 1 6   3  2  f 975.8480 12.41558 185.0448       4.705191      188.0310       5.609832      177.9599       8.640800  983.5485 14.68676 956.1154 23.27103 27.43317       27.51803 
1 1 1 6   3  3  o 1213.878 13.27334 286.3578       6.257247      283.4915       8.741796      289.3691       8.960421  1207.300 18.64479 1219.722 18.91645 -12.42188      26.56050 
1 1 1 6   3  4  o 969.3064 12.91906 182.5876       4.863176      167.0463       9.640305      187.8927       5.632370  925.9003 26.81011 983.1663 14.75150 -57.26593      30.60047 
1 1 1 6   3  5  o 1063.038 13.19126 219.6238       5.445819      223.4745       7.794541      215.9515       7.611812  1071.837 18.72552 1053.653 18.60212 18.18311       26.39477 
1 1 1 6   3  6  o 289.9492 20.93629 16.44770       2.341636      16.95807       3.402475      15.98845       3.227589  293.2551 30.31342 284.7604 29.61916 8.494690       42.38158 
1 1 1 6   3  7  o 966.5005 13.07836 181.5668       4.908890      181.3171       6.942720      181.8165       6.941717  965.3508 18.51896 966.6822 18.49078 -1.331360      26.16984 
1 1 1 6   3  8  o 1322.181 13.98091 339.8830       7.178839      331.8555       9.940920      348.6319       10.37800  1305.676 19.60483 1338.210 19.96924 -32.53394      27.98428 
1 1 1 6   3  9  o 435.2123 16.27879 36.85160       2.751385      38.95884       3.912690      34.79034       3.869756  446.5045 22.63833 421.7396 23.72351 24.76489       32.79174 
1 1 1 6   3  10 o 389.7069 19.87873 29.66716       2.998531      28.14354       3.759970      32.32915       4.969927  378.7647 25.71385 405.0404 31.85236 -26.27576      40.93623 
1 1 1 6   3  11 o 890.1646 15.44771 154.2250       5.340261      150.5711       6.597399      161.1685       9.094614  878.9761 19.32714 908.0881 25.78863 -29.11200      32.22720 
1 1 1 6   3  12 o 607.4077 21.05107 71.97536       4.965724      0.000000       0.000000      71.97536       4.965724  ?        ?        607.4077 21.05107 0.000000       21.05107 
1 1 1 6   3  13 o 371.5573 28.81180 27.20000       4.124913      27.20000       4.124913      0.000000       0.000000  371.5573 28.81180 ?        ?        0.000000       28.81180 
1 1 1 6   3  14 f 347.0542 22.29899 23.59822       2.989547      19.82918       4.150566      27.66170       4.309637  315.9239 34.38486 374.6288 29.87008 -58.70490      45.54713 
1 1 1 6   3  15 f 594.8126 18.63635 68.90742       4.304958      77.84988       7.487658      64.49183       5.261530  630.6302 30.57336 574.9219 23.56542 55.70825       38.60129 
1 1 1 6   3  16 o 589.7613 24.28529 67.83241       5.562212      0.000000       0.000000      67.83241       5.562212  ?        ?        589.7613 24.28529 0.000000       24.28529 
1 1 1 6   3  17 o 799.3068 18.31678 124.3208       5.685787      135.4786       10.29543      119.4243       6.820190  832.6281 31.83944 782.9949 22.42898 49.63324       38.94623 
1 1 1 6   3  18 o 1013.424 15.54633 199.6909       6.118530      209.7971       8.824394      190.3338       8.491047  1038.074 21.88914 988.7233 22.11355 49.35071       31.11500 
1 1 1 6   3  19 o 1293.096 15.79108 325.0827       7.929953      331.9231       11.37211      318.6085       11.06355  1305.814 22.42497 1279.378 22.26730 26.43616       31.60241 
1 1 1 6   3  20 o 2177.987 19.18659 922.7484       16.22860      903.4343       22.26089      944.6569       23.70891  2153.299 26.62014 2201.556 27.73025 -48.25708      38.43954 
1 1 1 6   3  21 o 747.6588 20.90247 108.7934       6.069167      111.6383       7.432123      103.0989       10.51510  756.9690 25.28173 725.0416 37.47220 31.92743       45.20323 
1 1 1 6   3  22 o 273.8784 45.86840 15.13440       4.706131      14.24464       5.714373      17.01002       8.296706  263.3102 57.49372 285.9775 74.10160 -22.66733      93.79006 
1 1 1 6   3  23 f 502.3401 25.58098 49.33896       4.973973      52.50414       6.908833      45.93303       7.166775  516.8040 34.62337 482.4887 38.57042 34.31525       51.83102 
1 1 1 6   3  24 o 1123.508 17.46300 245.6333       7.619440      253.2439       10.73531      237.9077       10.81618  1139.640 24.25598 1104.408 25.21834 35.23206       34.99025 
1 1 1 6   3  25 o 1016.250 18.50350 201.0834       7.302686      193.2621       9.967698      210.1458       10.72944  995.0214 25.79494 1037.395 26.63205 -42.37384      37.07621 
1 1 1 6   3  26 o 603.9313 28.09970 71.35728       6.590484      75.93019       7.858898      60.52010       12.09828  621.3299 32.68442 546.8500 57.84567 74.47986       66.44090 
1 1 1 6   3  27 o 272.5484 49.46573 15.26022       5.042888      15.96593       6.693470      14.33378       7.669118  275.0676 63.88256 259.6581 73.00555 15.40948       97.00924 
1 1 1 6   3  28 o 178.4632 60.42974 6.172494       4.985520      6.255793       6.871563      6.079912       7.244382  189.8570 70.27237 190.8596 71.85361 -1.002579      100.5045 
1 1 1 6   3  29 o 338.6182 48.18129 23.56614       6.157321      24.29119       7.253054      21.69544       11.65037  340.3805 56.87607 307.8186 91.06761 32.56186       107.3694 
1 1 1 6   3  30 o 464.4511 32.28766 43.01748       5.787574      42.30720       8.122245      43.75008       8.248957  454.1836 46.71463 461.9812 46.61499 -7.797607      65.99405 
1 1 1 6   3  31 o 272.1160 57.89559 16.10772       5.930262      27.98952       10.18779      10.01853       7.293211  348.4654 77.30467 214.8869 73.08787 133.5784       106.3854 
1 1 1 6   3  32 o 469.8423 31.39088 44.28787       5.694779      53.85175       8.420853      36.22760       7.730613  511.5032 42.78450 415.3300 48.86272 96.17322       64.94675 
1 1 1 6   4  0  o 2185.882 17.77580 929.2176       15.08981      898.3537       20.26001      967.6699       22.61392  2147.847 24.28893 2228.670 26.12776 -80.82300      35.67369 
1 1 1 6   4  1  o 714.5617 12.45478 99.22048       3.456239      98.27718       4.049688      101.7502       6.631796  711.0545 14.66529 722.9141 23.62199 -11.85956      27.80412 
1 1 1 6   4  2  o 752.3763 17.49738 110.0798       5.112532      110.0798       5.112532      0.000000       0.000000  752.3763 17.49738 ?        ?        0.000000       17.49738 
1 1 1 6   4  3  o 666.8846 12.57819 86.42427       3.257592      83.75206       4.509818      89.33972       4.710600  656.2451 17.69559 677.7711 17.89638 -21.52600      25.16773 
1 1 1 6   4  4  o 276.1015 20.05865 14.91061       2.136102      18.45464       5.413059      14.25692       2.324771  303.0278 47.56347 269.6995 22.39853 33.32834       52.57354 
1 1 1 6   4  5  o 630.4366 13.13298 77.24648       3.215382      73.55138       7.166356      78.17783       3.597857  613.9836 30.05479 634.1569 14.60896 -20.17328      33.41724 
1 1 1 6   4  6  o 446.4109 15.68036 38.75000       2.718434      39.19718       3.983943      38.36038       3.718647  448.0391 22.97377 443.8857 21.57178 4.153412       31.51406 
1 1 1 6   4  7  o 625.5005 13.74489 76.06078       3.338850      75.04179       4.785383      77.02738       4.660776  620.9034 19.84562 629.1224 19.07634 -8.218994      27.52736 
1 1 1 6   4  8  o 277.8521 21.62312 15.12943       2.314868      16.49917       3.305657      13.81137       3.242686  289.0916 29.87470 263.8172 32.32637 25.27444       44.01695 
1 1 1 6   4  9  o 866.6932 14.86959 146.1139       5.004866      153.1033       6.432870      135.3948       7.966405  886.7307 18.68035 833.0242 24.62503 53.70648       30.90870 
1 1 1 6   4  10 o 635.2928 15.60695 78.54323       3.850525      76.31675       4.857845      82.30641       6.315553  625.7801 19.98913 649.2017 25.04977 -23.42163      32.04772 
1 1 1 6   4  11 o 326.4332 20.56472 20.86143       2.593697      22.18940       3.698677      19.57657       3.638155  335.4518 28.66679 314.6676 30.14028 20.78418       41.59593 
1 1 1 6   4  12 o 768.3204 14.05024 114.8674       4.192317      121.2779       6.079237      109.0543       5.789064  788.6431 19.84909 747.8308 19.93320 40.81232       28.13039 
1 1 1 6   4  13 o 729.2545 14.55987 103.4947       4.123486      103.8233       5.782050      103.1546       5.882220  729.6334 20.40559 727.2140 20.82817 2.419434       29.15820 
1 1 1 6   4  14 o 334.4066 25.73298 21.97952       3.316234      22.93431       5.485024      21.42944       4.163347  338.1799 42.71687 328.8793 33.04406 9.300568       54.00593 
1 1 1 6   4  15 o 629.3730 23.06127 77.25874       5.636627      0.000000       0.000000      77.25874       5.636627  ?        ?        629.3730 23.06127 0.000000       23.06127 
1 1 1 6   4  16 o 933.4451 14.95376 169.4609       5.420846      170.8718       7.723638      168.0912       7.610091  936.5632 21.23522 928.9310 21.09494 7.632141       29.93211 
1 1 1 6   4  17 o 683.3810 19.79099 90.90028       5.252409      81.97619       9.185426      95.23592       6.402415  646.0558 36.76212 699.1374 23.58052 -53.08154      43.67487 
1 1 1 6   4  18 f 509.7405 23.90164 50.60905       4.731565      50.24741       8.302104      50.78302       5.758280  504.4621 42.78027 509.4030 29.22972 -4.940857      51.81244 
1 1 1 6   4  19 o 90.04212 41.73046 -2.966584      3.472228      0.5260509E-02  4.818328      -6.177151      5.008113  128.5954 54.81365 100.1228 47.55030 28.47257       72.56422 
1 1 1 6   4  20 o 655.1654 18.78782 83.49297       4.780303      78.25149       6.634281      89.15276       6.893930  633.6887 26.95814 676.4526 26.24228 -42.76392      37.62178 
1 1 1 6   4  21 o 312.7762 39.01014 19.44194       4.635473      18.37611       5.707407      21.50763       7.945629  301.6372 50.50779 323.5533 65.48209 -21.91611      82.69789 
1 1 1 6   4  22 o 509.3754 26.91455 50.74619       5.305285      54.25617       6.497682      43.72661       9.188852  525.9931 31.96048 468.0741 51.39564 57.91898       60.52259 
1 1 1 6   4  23 o 825.0754 18.76293 132.4994       6.012044      128.5810       8.241115      136.9573       8.790036  811.8809 26.13760 837.7772 27.01682 -25.89630      37.59099 
1 1 1 6   4  24 o 334.3797 36.50942 22.17118       4.663986      23.87088       6.397881      20.24349       6.813461  344.3381 49.24613 314.4646 57.92583 29.87354       76.03014 
1 1 1 6   4  25 o 753.9117 20.83106 110.7553       6.099018      110.5602       8.355213      110.9779       8.923426  752.0800 28.60655 753.1584 30.50825 -1.078430      41.82210 
1 1 1 6   4  26 o 426.4347 31.68673 35.85039       5.210071      36.44792       7.038982      35.12636       7.748290  427.3334 42.99842 417.8516 48.65935 9.481842       64.93533 
1 1 1 6   4  27 o 414.8506 38.13735 34.27824       6.075469      35.12797       7.187180      32.15098       11.37175  417.9954 44.98328 386.9290 78.36434 31.06641       90.35744 
1 1 1 6   4  28 o 732.9432 25.70951 105.3298       7.317997      116.0044       8.914561      83.27197       12.81461  767.8837 29.89348 640.3755 51.97641 127.5082       59.95972 
1 1 1 6   4  29 o 326.1233 50.99244 22.05225       6.246758      18.58614       7.366114      30.92859       11.78783  292.9363 66.29583 370.4314 83.88876 -77.49512      106.9227 
1 1 1 6   4  30 o 117.2405 53.07303 -2.253620      5.190019      2.298359       7.155928      -7.305470      7.538605  162.5536 67.90378 124.7534 58.97989 37.80028       89.94193 
1 1 1 6   4  31 o 354.1467 40.81119 25.71609       5.510241      31.25290       8.097429      20.94092       7.519896  382.4456 56.19492 307.0491 65.08407 75.39655       85.98724 
1 1 1 6   5  0  o 623.9460 12.94602 75.65851       3.136977      77.99227       3.747247      70.19212       5.735019  633.3936 15.23389 600.3240 24.59921 33.06958       28.93427 
1 1 1 6   5  1  o 563.3869 13.08505 61.68560       2.862926      61.83441       3.405921      61.32728       5.285096  563.9664 15.55082 561.1632 24.25134 2.803223       28.80895 
1 1 1 6   5  2  o 792.4185 12.70349 122.0286       3.909359      118.4136       5.427965      125.9250       5.635194  780.2782 17.91264 804.6366 18.03355 -24.35840      25.41793 
1 1 1 6   5  3  o 1214.783 13.24045 286.8076       6.246395      292.4508       8.958931      281.4691       8.713648  1226.107 18.81481 1202.885 18.65296 23.22180       26.49396 
1 1 1 6   5  4  o 391.9510 21.80458 29.99879       3.305874      0.000000       0.000000      29.99879       3.305874  ?        ?        391.9510 21.80458 0.000000       21.80458 
1 1 1 6   5  5  o 316.2749 17.96785 19.52142       2.197825      18.35557       5.637269      19.73039       2.386688  301.5230 49.88590 317.8344 19.42932 -16.31131      53.53598 
1 1 1 6   5  6  o 676.2369 13.38132 88.89314       3.514194      91.47591       5.098237      86.55512       4.850645  685.6002 19.14790 666.9371 18.72779 18.66309       26.78380 
1 1 1 6   5  7  o 305.5142 21.93493 18.27512       2.585206      16.72805       3.464777      20.21815       3.882915  290.9442 31.14862 320.0836 31.65154 -29.13943      44.40784 
1 1 1 6   5  8  o 392.4111 28.11371 30.22932       4.255985      0.000000       0.000000      30.22932       4.255985  ?        ?        392.4111 28.11371 0.000000       28.11371 
1 1 1 6   5  9  o 711.9857 15.00500 98.62418       4.148921      96.92621       5.282500      101.3580       6.702862  705.3846 19.28348 720.7060 23.94827 -15.32135      30.74691 
1 1 1 6   5  10 o 719.1337 13.48301 100.5963       3.765517      107.4750       5.467165      94.38824       5.193831  742.6764 18.95547 695.9595 19.21657 46.71692       26.99234 
1 1 1 6   5  11 o 1103.573 13.67810 236.9478       5.862120      241.5530       8.425735      232.6273       8.161174  1113.120 19.49116 1092.417 19.23694 20.70313       27.38549 
1 1 1 6   5  12 f 1032.257 13.85123 207.3322       5.552700      211.6372       7.904486      203.1382       7.801927  1041.861 19.53601 1020.695 19.68238 21.16541       27.73179 
1 1 1 6   5  13 o 561.4532 17.77777 61.40883       3.876314      59.47242       6.359254      62.55371       4.889744  550.1216 29.87799 566.1463 22.23973 -16.02466      37.24647 
1 1 1 6   5  14 o 414.8791 27.53812 33.80290       4.411729      0.000000       0.000000      33.80290       4.411729  ?        ?        414.8791 27.53812 0.000000       27.53812 
1 1 1 6   5  15 o 428.1925 20.04293 35.71678       3.332946      35.43276       4.691171      36.00628       4.736145  424.8394 28.59983 428.2702 28.64113 -3.430725      40.47549 
1 1 1 6   5  16 o 672.0684 22.64275 88.01112       5.909772      88.01112       5.909772      0.000000       0.000000  672.0684 22.64275 ?        ?        0.000000       22.64275 
1 1 1 6   5  17 o 543.4084 18.59336 57.45654       3.923849      58.87151       5.494066      55.98336       5.605946  549.5442 25.74324 535.1091 27.06400 14.43506       37.35204 
1 1 1 6   5  18 o 319.5196 34.58087 20.17663       4.222566      16.33377       7.583534      21.90341       5.083498  281.0602 69.79586 332.0940 40.23741 -51.03378      80.56371 
1 1 1 6   5  19 o 690.8049 26.50005 92.97981       7.109354      102.4683       10.28977      84.31324       9.833999  723.1460 36.76069 655.4256 38.80764 67.72040       53.45448 
1 1 1 6   5  20 o 628.8820 19.16087 76.93604       4.679639      75.63280       6.450834      78.38371       6.798892  623.0008 26.66241 634.1487 27.60699 -11.14795      38.38007 
1 1 1 6   5  21 o 369.2643 29.44575 26.77266       4.187572      30.50331       5.759197      22.58783       6.099702  392.9277 38.22563 335.6048 48.18275 57.32291       61.50428 
1 1 1 6   5  22 o 496.2633 27.90012 48.20646       5.355261      43.04776       6.422615      59.97507       9.700737  467.6441 35.63275 550.2934 45.80852 -82.64932      58.03545 
1 1 1 6   5  23 o 596.2159 25.26093 69.32579       5.848990      71.80733       7.123342      64.19039       10.24734  606.2212 30.25691 568.8796 46.79845 37.34161       55.72769 
1 1 1 6   5  24 o 505.0400 26.01133 49.90371       5.084391      51.46266       6.881670      48.02982       7.544831  511.3793 34.85943 492.9505 39.74894 18.42886       52.86926 
1 1 1 6   5  25 o 514.6390 26.20345 51.85689       5.219757      55.64621       7.229944      47.73148       7.543756  531.4307 35.23142 490.9644 39.91030 40.46622       53.23613 
1 1 1 6   5  26 o 478.1330 28.96711 44.93381       5.353380      49.61906       7.368587      39.69641       7.790679  500.3680 38.20869 445.2002 45.70874 55.16782       59.57510 
1 1 1 6   5  27 o 302.8193 45.06208 18.62556       5.137866      9.664234       6.654504      31.85236       8.084569  217.4996 69.64306 394.5240 54.19788 -177.0244      88.24718 
1 1 1 6   5  28 o 457.8025 36.17915 41.75362       6.379859      41.75900       7.394104      41.73797       12.62106  455.7607 42.25602 439.4411 76.74785 16.31961       87.61166 
1 1 1 6   5  29 o 449.4500 37.86705 40.53330       6.547961      34.98086       7.629105      56.06524       12.75982  413.0424 48.48310 514.1312 65.38536 -101.0889      81.39936 
1 1 1 6   5  30 f 100.2928 47.80172 -6.079443      5.153270      -12.29723      7.151125      0.6375874      7.432676  106.4592 52.05297 155.6873 67.24459 -49.22803      85.03732 
1 1 1 6   5  31 o 483.9334 35.60994 47.26826       6.645431      65.65865       11.35206      37.68053       8.196660  558.6432 52.95796 423.4923 50.85533 135.1510       73.42214 
1 1 1 6   6  0  o 471.3818 14.72270 43.19662       2.695182      45.27345       3.221897      38.35608       4.918792  482.4781 17.19515 442.5364 28.77717 39.94168       33.52311 
1 1 1 6   6  1  o 1243.288 13.75240 300.4580       6.640156      302.8091       9.374631      298.0908       9.406649  1247.522 19.34987 1237.736 19.56947 9.786011       27.52056 
1 1 1 6   6  2  o 613.8931 13.28605 73.24872       3.167499      68.57740       4.328485      78.63410       4.647557  593.7122 18.77292 635.7533 18.82384 -42.04114      26.58495 
1 1 1 6   6  3  o 702.5552 12.65175 95.92825       3.451906      99.03954       4.829800      92.67944       4.935377  713.5718 17.42864 690.2119 18.41238 23.35986       25.35297 
1 1 1 6   6  4  o 524.4391 13.13778 53.45917       2.675748      55.68244       3.800982      51.27501       3.767400  534.9824 18.29482 513.3401 18.89768 21.64233       26.30253 
1 1 1 6   6  5  o 1248.934 15.25456 303.3183       7.398896      306.6862       14.28077      302.0826       8.650455  1253.431 29.33752 1246.054 17.87615 7.376221       34.35472 
1 1 1 6   6  6  o 673.6682 14.13951 88.23969       3.699205      90.29967       8.005788      87.68048       4.171196  679.8723 30.32137 671.4059 15.99733 8.466431       34.28264 
1 1 1 6   6  7  o 506.8979 15.98679 49.98667       3.147095      50.53976       4.258259      49.32095       4.671752  509.3062 21.52906 502.9275 23.91919 6.378754       32.18118 
1 1 1 6   6  8  o 1081.403 13.24062 227.4086       5.560628      234.6463       8.117311      221.0091       7.632860  1097.622 19.04283 1065.347 18.44881 32.27490       26.51392 
1 1 1 6   6  9  o 1058.833 13.34181 218.0595       5.486183      234.7590       8.250682      204.8241       7.345275  1097.622 19.35570 1025.420 18.44498 72.20215       26.73688 
1 1 1 6   6  10 o 431.6040 16.40996 36.27196       2.750559      40.69801       3.946686      32.09188       3.835455  456.6499 22.25467 404.5549 24.52831 52.09500       33.11961 
1 1 1 6   6  11 o 1119.877 19.30792 244.5007       8.397186      0.000000       0.000000      244.5007       8.397186  ?        ?        1119.877 19.30792 0.000000       19.30792 
1 1 1 6   6  12 o 803.5596 19.64370 125.8960       6.130127      0.000000       0.000000      125.8960       6.130127  ?        ?        803.5596 19.64370 0.000000       19.64370 
1 1 1 6   6  13 o 987.5957 15.81843 189.8586       6.066952      191.5236       10.08496      188.9143       7.594994  989.7791 26.23662 984.4352 19.86608 5.343872       32.90929 
1 1 1 6   6  14 o 331.8090 23.09495 21.58085       2.957450      25.44104       4.142044      17.56622       4.224094  359.3387 29.95423 296.6858 37.49876 62.65298       47.99388 
1 1 1 6   6  15 o 1002.301 14.45687 195.3789       5.627307      194.1348       7.915330      196.6503       8.001802  998.3258 20.41591 1004.759 20.50680 -6.433044      28.93680 
1 1 1 6   6  16 o 623.0795 16.69586 75.52137       4.039990      77.23273       5.724370      73.82305       5.702511  629.5504 23.41365 615.4550 23.85843 14.09540       33.42789 
1 1 1 6   6  17 o 694.4680 16.54641 93.79428       4.462558      92.83482       6.213665      94.81631       6.413079  690.3923 23.17522 697.6758 23.66928 -7.283447      33.12590 
1 1 1 6   6  18 o 1111.175 17.95527 240.1416       7.748223      233.4310       9.138068      257.3076       14.61525  1095.155 21.48576 1148.034 32.78109 -52.87866      39.19486 
1 1 1 6   6  19 o 1269.000 18.57556 313.2191       9.154434      295.9598       15.39016      322.6693       11.38815  1231.482 32.18007 1287.459 22.77675 -55.97717      39.42509 
1 1 1 6   6  20 o 981.8295 16.41038 187.4431       6.257238      180.5770       8.554467      195.3438       9.176372  963.0538 22.87254 1001.572 23.59179 -38.51782      32.85918 
1 1 1 6   6  21 o 305.6065 35.77456 18.51439       4.165510      24.09934       5.670053      11.96575       6.139789  347.8898 42.87521 241.1321 64.36274 106.7578       77.33593 
1 1 1 6   6  22 o 232.1733 48.61170 11.01293       4.242552      7.245328       5.793066      15.37105       6.230540  195.3196 65.14310 273.0193 60.36660 -77.69974      88.81300 
1 1 1 6   6  23 o 607.0352 24.97877 71.86242       5.888611      69.52950       7.051999      77.23580       10.70251  595.6920 30.58648 624.9138 44.38864 -29.22186      53.90625 
1 1 1 6   6  24 o 151.0395 56.56350 3.460288       4.477777      13.13758       6.232539      -6.863953      6.437500  251.5051 63.73162 116.5233 54.90900 134.9818       84.12323 
1 1 1 6   6  25 o 514.3781 26.34439 51.82302       5.244919      55.67200       7.299752      47.71543       7.541000  531.3461 35.58109 490.7299 39.91520 40.61627       53.47183 
1 1 1 6   6  26 o 485.6493 28.52473 46.35577       5.356260      43.31917       7.151846      50.23471       8.083157  466.7222 39.83928 502.2626 41.82034 -35.54044      57.75906 
1 1 1 6   6  27 o 581.4122 28.89861 66.36468       6.525127      69.22332       7.687458      58.99691       12.34157  591.7623 33.58931 535.5542 60.39336 56.20807       69.10572 
1 1 1 6   6  28 o 237.1621 57.08311 11.91725       5.194115      12.55643       6.971123      11.11955       7.787701  241.6797 70.14568 230.5069 75.46561 11.17287       103.0314 
1 1 1 6   6  29 o 598.4541 26.68777 70.50893       6.202561      70.34875       8.464511      70.69468       9.115063  593.0206 36.93733 593.0883 39.80499 -0.6762695E-01 54.30289 
1 1 1 6   6  30 o 565.4058 34.07547 64.00497       7.447255      65.69199       8.904476      60.07833       13.58501  569.3181 40.53887 524.9294 68.25414 44.38873       79.38531 
1 1 1 6   6  31 o 351.1862 49.03059 25.93588       6.504641      40.74072       11.15268      18.30358       8.007652  426.6306 69.72192 281.7569 72.69751 144.8737       100.7277 
1 1 1 6   7  0  o 512.1504 14.63350 50.99613       2.910541      52.14724       3.575708      48.73596       5.010416  517.7438 17.78358 499.3389 25.92671 18.40491       31.43962 
1 1 1 6   7  1  o 775.4955 13.28380 116.8975       4.000640      121.7742       5.809188      112.4981       5.517586  791.0872 18.90876 760.3786 18.68492 30.70862       26.58322 
1 1 1 6   7  2  o 754.0047 12.98054 110.5045       3.800974      113.8581       5.397099      107.2042       5.353938  764.9948 18.16661 742.2723 18.57300 22.72247       25.98042 
1 1 1 6   7  3  o 1003.655 14.27118 195.8430       5.562526      192.2218       6.899976      202.5652       9.401091  993.9800 17.87483 1019.612 23.74190 -25.63153      29.71847 
1 1 1 6   7  4  o 951.3804 14.00940 175.9758       5.176090      181.6231       6.660645      167.3657       8.224394  966.1573 17.75172 926.8466 22.84904 39.31067       28.93445 
1 1 1 6   7  5  o 283.2988 20.49617 15.70996       2.239768      16.24465       6.024516      15.62420       2.412704  281.2991 57.09803 282.3241 22.18399 -1.025055      61.25614 
1 1 1 6   7  6  o 540.2676 34.94732 57.42576       7.293198      57.42576       7.293198      0.000000       0.000000  540.2676 34.94732 ?        ?        0.000000       34.94732 
1 1 1 6   7  7  o 184.3499 22.28930 6.721702       1.563352      4.910596       3.032604      7.377221       1.824468  156.5135 46.49875 192.8392 24.94680 -36.32570      52.76814 
1 1 1 6   7  8  o 538.1884 14.05867 56.34561       2.938371      55.37745       4.295459      57.19710       4.028358  532.9716 20.75284 541.8174 19.14463 -8.845886      28.23468 
1 1 1 6   7  9  o 555.4355 14.05150 60.02567       3.030988      55.33849       4.300892      64.65048       4.272182  532.6742 20.79069 575.9467 19.10027 -43.27252      28.23248 
1 1 1 6   7  10 o 384.8803 17.46978 28.85849       2.611205      28.91634       3.736749      28.80328       3.650370  383.7766 25.21217 383.1119 24.66595 0.6647644      35.27127 
1 1 1 6   7  11 o 418.5742 24.10796 34.34644       3.902298      0.000000       0.000000      34.34644       3.902298  ?        ?        418.5742 24.10796 0.000000       24.10796 
1 1 1 6   7  12 o 602.4813 16.29724 70.67703       3.813166      72.37696       6.045204      69.55374       4.914093  608.4629 25.58285 597.1089 21.19150 11.35400       33.21990 
1 1 1 6   7  13 o 302.8078 23.38532 18.00141       2.728728      18.71280       3.791432      17.23693       3.930322  307.2959 32.25101 294.2290 35.08865 13.06686       47.65858 
1 1 1 6   7  14 o 313.8233 23.98150 19.32484       2.900610      13.28430       3.898868      26.81232       4.340789  256.8514 40.42251 368.9370 30.57167 -112.0856      50.68142 
1 1 1 6   7  15 o 327.8446 24.43575 21.07296       3.088812      19.25422       4.231411      23.14757       4.519263  311.5343 35.61449 342.1484 34.48150 -30.61414      49.57183 
1 1 1 6   7  16 o 417.0813 24.61961 34.02065       3.970089      36.08836       4.690609      28.79800       7.454699  429.1353 28.30432 378.6186 52.07770 50.51672       59.27243 
1 1 1 6   7  17 o 921.8691 21.49980 165.4324       7.697180      165.4324       7.697180      0.000000       0.000000  921.8691 21.49980 ?        ?        0.000000       21.49980 
1 1 1 6   7  18 o 1271.234 15.52251 314.1696       7.663293      320.3140       10.90648      308.1782       10.76987  1282.853 21.89173 1258.296 22.03939 24.55652       31.06417 
1 1 1 6   7  19 o 1024.588 16.02196 204.1005       6.375185      191.5356       8.684215      218.7866       9.388682  991.9363 22.54337 1060.124 22.80446 -68.18793      32.06629 
1 1 1 6   7  20 o 305.6703 40.68882 18.61730       4.710116      16.61902       8.428218      19.52483       5.679846  283.2678 75.31464 311.5862 48.51780 -28.31836      89.58946 
1 1 1 6   7  21 o 592.4142 20.70886 68.32570       4.764415      68.09505       6.523338      68.58941       6.975131  590.7314 28.43491 591.8903 30.44786 -1.158875      41.66073 
1 1 1 6   7  22 o 441.4679 26.53964 38.15742       4.528975      28.49451       6.075846      50.23976       6.794038  378.5995 42.03315 505.4405 34.82476 -126.8409      54.58525 
1 1 1 6   7  23 o 193.6330 56.41726 7.595798       4.501716      1.712496       5.948795      15.47981       6.886397  152.6799 62.66542 272.9176 65.75144 -120.2377      90.83064 
1 1 1 6   7  24 o 327.3729 44.11214 21.49036       5.465493      24.07085       6.560182      15.63491       9.882005  345.2497 50.41397 274.9063 84.43265 70.34348       98.33839 
1 1 1 6   7  25 o 411.2171 32.57163 33.36125       5.159061      41.26971       7.104594      24.53909       7.503790  455.8118 40.55901 345.8755 57.91146 109.9363       70.70199 
1 1 1 6   7  26 o 240.4702 61.36538 12.14859       5.749760      8.050722       6.587891      25.24985       11.77942  203.9731 69.46347 339.4349 88.46188 -135.4619      112.4752 
1 1 1 6   7  27 o 377.7727 36.67401 28.47926       5.312633      30.21521       7.050076      26.19823       8.081490  385.6138 48.12514 353.9846 60.98814 31.62915       77.68902 
1 1 1 6   7  28 o 394.2048 36.36279 31.08694       5.504069      29.97200       7.378629      32.48560       8.264306  381.6937 51.05684 395.7836 55.27615 -14.08994      75.24794 
1 1 1 6   7  29 o 187.0561 62.97789 7.093985       5.414532      3.904942       7.317232      10.95342       8.049673  174.0865 70.22008 226.9030 76.78667 -52.81642      104.0531 
1 1 1 6   7  30 o 264.8655 63.13295 15.48797       6.402064      14.80882       9.963383      15.96557       8.355211  253.7193 85.43009 263.5695 76.87920 -9.850250      114.9292 
1 1 1 6   7  31 o 434.9733 43.52428 39.05251       7.253602      47.34721       8.925297      22.91628       12.44868  475.6642 49.01862 300.3620 95.15655 175.3022       107.0402 
1 1 1 6   8  0  o 485.9276 16.93307 45.93605       3.195472      50.22141       4.270369      40.48333       4.817012  507.7868 21.65489 454.6744 27.40843 53.11240       34.93074 
1 1 1 6   8  1  o 1588.886 17.17044 491.1603       10.59503      489.3863       13.17142      494.4124       17.83394  1585.169 21.39583 1591.337 28.85740 -6.167969      35.92397 
1 1 1 6   8  2  o 559.8276 15.15638 60.94986       3.295170      59.68464       4.254014      62.84776       5.210180  553.6880 19.78362 567.8551 23.62584 -14.16705      30.81512 
1 1 1 6   8  3  o 501.6169 15.23494 48.93680       2.967843      46.92938       3.831058      51.94954       4.693326  490.9314 20.09416 516.2671 23.40876 -25.33566      30.85037 
1 1 1 6   8  4  o 1002.983 14.08824 195.6194       5.487547      194.8376       6.878930      196.9876       9.100239  1000.558 17.70314 1005.224 23.31105 -4.665771      29.27126 
1 1 1 6   8  5  o 859.7153 12.58408 143.6961       4.201499      143.9532       5.896546      143.4310       5.988147  859.9689 17.65578 858.3710 17.96344 1.597961       25.18753 
1 1 1 6   8  6  o 963.1681 12.75427 180.3884       4.770741      164.3418       10.67065      184.3973       5.333482  916.4416 29.98184 973.6603 14.10507 -57.21875      33.13403 
1 1 1 6   8  7  o 879.0942 13.76251 150.3284       4.698520      140.7001       9.879941      153.1423       5.341155  847.6536 30.01290 887.0718 15.50416 -39.41821      33.78096 
1 1 1 6   8  8  o 518.1479 14.12473 52.23849       2.842247      48.27596       4.130458      55.80226       3.917112  497.4550 21.38043 535.1055 18.84945 -37.65051      28.50306 
1 1 1 6   8  9  o 753.6930 18.15749 110.6957       5.314693      0.000000       0.000000      110.6957       5.314693  ?        ?        753.6930 18.15749 0.000000       18.15749 
1 1 1 6   8  10 o 784.5067 14.62550 119.7874       4.455899      110.3273       6.898165      126.5610       5.837095  751.4725 23.63701 805.7903 18.65291 -54.31787      30.11045 
1 1 1 6   8  11 o 905.0038 14.89787 159.4124       5.236036      161.4400       8.448010      158.1477       6.672119  909.0525 23.92971 900.7296 19.07398 8.322937       30.60144 
1 1 1 6   8  12 o 285.0249 23.07106 15.95980       2.531845      16.19041       3.532841      15.71628       3.630286  285.4974 32.43947 280.9300 33.96443 4.567444       46.96703 
1 1 1 6   8  13 o 711.6587 14.44730 98.52138       3.992881      101.7646       5.577017      95.11064       5.719243  722.6926 19.87103 698.5158 21.08309 24.17682       28.97162 
1 1 1 6   8  14 o 1380.121 14.97426 370.4821       8.025845      367.4530       11.22180      373.6539       11.48323  1373.338 21.04056 1384.808 21.35238 -11.47058      29.97715 
1 1 1 6   8  15 o 315.7626 29.24279 19.63311       3.545268      18.51991       4.115403      22.83662       6.981344  305.5939 35.32807 335.3758 55.54585 -29.78195      65.82867 
1 1 1 6   8  16 o 288.6138 28.41023 16.40483       3.143066      15.43466       4.192498      17.64982       4.749331  277.8868 40.00145 297.0598 42.36858 -19.17297      58.26846 
1 1 1 6   8  17 o 631.5109 17.07130 77.55522       4.186735      78.47385       5.873505      76.60632       5.969538  634.7894 23.82537 627.1372 24.51039 7.652222       34.18197 
1 1 1 6   8  18 o 877.2910 15.90431 149.6314       5.418594      152.1494       7.678567      147.1336       7.647626  884.1078 22.36387 869.3854 22.65094 14.72241       31.83093 
1 1 1 6   8  19 o 197.1056 47.29112 7.931793       3.573667      -0.1204119     4.747807      18.45680       5.428089  126.8036 54.23931 303.0202 47.70328 -176.2166      72.23231 
1 1 1 6   8  20 o 723.3104 21.37342 101.8531       6.003805      100.9910       10.52049      102.2695       7.311244  717.2751 37.90239 724.3380 25.99094 -7.062927      45.95781 
1 1 1 6   8  21 o 1148.284 19.64714 256.6626       8.761458      270.5313       15.86534      250.5773       10.50930  1175.836 34.74358 1133.929 23.86493 41.90784       42.15034 
1 1 1 6   8  22 o 320.6248 50.01023 20.76029       6.023874      20.76029       6.023874      0.000000       0.000000  320.6248 50.01023 ?        ?        0.000000       50.01023 
1 1 1 6   8  23 o 547.5812 24.08965 58.47038       5.122796      54.99681       7.003903      62.46646       7.512232  528.8409 34.28738 563.7084 34.48098 -34.86755      48.62676 
1 1 1 6   8  24 o 534.4968 29.64167 56.04499       6.128731      52.55527       7.317186      64.24773       11.21833  516.1097 36.74684 566.8433 51.52357 -50.73364      63.28514 
1 1 1 6   8  25 o 821.3543 27.61437 131.9956       8.808331      131.9956       8.808331      0.000000       0.000000  821.3543 27.61437 ?        ?        0.000000       27.61437 
1 1 1 6   8  26 o 606.9438 28.32194 72.23256       6.675742      75.34089       7.800006      63.72086       12.90743  618.0639 32.61171 557.6530 60.57435 60.41089       68.79517 
1 1 1 6   8  27 o 664.0653 23.89746 86.34973       6.162976      98.77559       8.481433      72.44903       8.970657  708.2768 30.83459 603.1245 38.50005 105.1523       49.32572 
1 1 1 6   8  28 o 159.6604 60.49952 4.083119       5.156075      4.262323       6.860697      3.850539       7.815910  174.1328 68.73502 178.6477 72.39301 -4.514923      99.82611 
1 1 1 6   8  29 o 257.1752 63.05924 14.45252       6.249749      19.89827       9.745750      10.64875       8.145038  293.8763 82.18292 224.0015 77.21026 69.87482       112.7628 
1 1 1 6   8  30 o 337.9212 47.56348 23.85037       6.069167      17.98467       8.629519      29.59154       8.537419  278.2903 77.15988 368.8553 61.78459 -90.56500      98.84828 
1 1 1 6   8  31 o 115.4149 53.14844 -3.194596      5.502151      -0.8861000     8.025014      -5.242424      7.558369  151.3714 67.45422 130.0358 60.70377 21.33563       90.74700 
1 1 1 6   9  0  o 470.5627 17.78264 43.09830       3.249688      40.83833       4.180524      46.54905       5.165773  457.0418 23.63387 487.4903 27.39717 -30.44846      36.18238 
1 1 1 6   9  1  o 793.7408 23.47820 122.8444       7.237214      0.000000       0.000000      122.8444       7.237214  ?        ?        793.7408 23.47820 0.000000       23.47820 
1 1 1 6   9  2  o 780.5615 14.46415 118.4984       4.384579      118.3359       5.652407      118.7439       6.947513  779.6080 18.66935 780.4197 22.92309 -0.8117676     29.56370 
1 1 1 6   9  3  o 831.2141 12.87838 134.3390       4.157213      126.3826       5.750321      143.0508       6.017123  805.6684 18.37840 857.1897 18.07523 -51.52130      25.77750 
1 1 1 6   9  4  o 760.6122 12.55853 112.4885       3.709626      115.8005       5.324222      109.3637       5.171516  771.2090 17.77690 749.4697 17.76789 21.73932       25.13396 
1 1 1 6   9  5  o 701.7436 15.30837 95.82633       4.171914      112.9744       9.170791      91.35159       4.684723  759.4142 31.09568 684.9262 17.61214 74.48798       35.73694 
1 1 1 6   9  6  o 989.6749 21.36673 191.0385       8.212181      201.3336       11.91003      181.7075       11.33859  1013.727 30.25266 963.0330 30.31725 50.69446       42.82942 
1 1 1 6   9  7  o 222.1398 51.23965 10.22151       4.330255      11.47578       6.012599      8.869870       6.241629  234.2475 64.19022 210.2193 67.46232 24.02817       93.12115 
1 1 1 6   9  8  o 702.3944 17.15919 96.10806       4.680645      0.000000       0.000000      96.10806       4.680645  ?        ?        702.3944 17.15919 0.000000       17.15919 
1 1 1 6   9  9  o 983.7233 14.44381 188.3436       5.518012      199.9570       9.339012      182.1147       6.839575  1011.598 23.77196 966.6581 18.21915 44.93994       29.95069 
1 1 1 6   9  10 o 1031.466 18.71864 207.3739       7.498205      0.000000       0.000000      207.3739       7.498205  ?        ?        1031.466 18.71864 0.000000       18.71864 
1 1 1 6   9  11 f 715.2253 13.50603 99.51424       3.751445      99.59203       5.231789      99.43190       5.382092  714.8810 18.84467 714.2291 19.40375 0.6519775      27.04860 
1 1 1 6   9  12 o 532.8373 15.50669 55.25085       3.208792      57.19868       4.461702      53.16401       4.618177  541.6322 21.21134 522.0165 22.78024 19.61572       31.12652 
1 1 1 6   9  13 o 539.1763 18.99187 56.61208       3.976735      57.36978       4.568191      54.24115       8.080822  542.5362 21.68141 523.7110 40.03486 18.82520       45.52882 
1 1 1 6   9  14 o 255.8853 28.27004 12.93783       2.762394      13.41238       3.763505      12.38353       4.067400  258.7305 38.63969 247.3296 43.95655 11.40085       58.52524 
1 1 1 6   9  15 o 485.1791 18.25711 45.80184       3.440029      49.65407       4.724065      41.45322       5.019209  504.7913 24.09772 460.0714 28.22837 44.71991       37.11524 
1 1 1 6   9  16 o 442.2204 19.90310 38.05464       3.418121      37.83055       4.718592      38.30207       4.958210  439.6041 27.78193 442.1825 29.03456 -2.578400      40.18509 
1 1 1 6   9  17 o 584.3680 17.66793 66.41164       4.009592      66.26520       5.563717      66.56989       5.783506  583.3021 24.56086 584.5753 25.47550 -1.273193      35.38696 
1 1 1 6   9  18 o 231.4096 39.59031 10.76727       3.430047      16.63469       4.698101      4.069679       5.019470  288.2481 43.30785 162.0742 60.04595 126.1739       74.03436 
1 1 1 6   9  19 o 1698.569 16.93087 561.0840       11.16839      548.5882       15.31736      575.2676       16.31916  1678.362 23.50014 1718.480 24.45261 -40.11865      33.91440 
1 1 1 6   9  20 o 266.7739 38.72466 14.22674       3.894758      12.00944       5.232156      16.98224       5.832690  241.6353 56.72710 288.7410 54.00069 -47.10564      78.32010 
1 1 1 6   9  21 o 1477.893 19.75562 425.2137       11.33866      412.4211       19.37946      431.8723       13.98158  1451.694 34.37466 1488.460 24.18751 -36.76575      42.03157 
1 1 1 6   9  22 o 635.3486 21.54536 78.63891       5.316108      76.57985       7.278738      80.99301       7.782770  626.0281 29.93879 643.6496 31.13556 -17.62152      43.19438 
1 1 1 6   9  23 o 967.5455 18.08420 182.2334       6.795143      183.6198       9.292362      180.6399       9.962128  970.1766 24.66308 961.8947 26.66838 8.281982       36.32451 
1 1 1 6   9  24 o 380.5601 37.72509 28.74493       5.502010      26.27323       6.461054      35.26657       10.49504  361.4233 47.15562 413.0940 67.77033 -51.67068      82.56192 
1 1 1 6   9  25 o 681.5453 29.96820 91.07371       7.932012      91.07371       7.932012      0.000000       0.000000  681.5453 29.96820 ?        ?        0.000000       29.96820 
1 1 1 6   9  26 o 439.8141 31.09384 38.21992       5.276713      43.62971       7.071038      31.42133       7.926879  467.7473 39.29036 391.7758 53.49824 75.97150       66.37615 
1 1 1 6   9  27 o 513.2695 28.67176 51.97373       5.692307      55.90536       7.641945      47.07339       8.531610  529.5223 37.40192 482.3631 46.10532 47.15927       59.36839 
1 1 1 6   9  28 o 722.3520 26.13186 102.6409       7.330729      112.2010       11.50338      96.10357       9.512486  747.9950 39.74294 694.4195 35.39052 53.57550       53.21645 
1 1 1 6   9  29 o 382.9260 43.97461 30.08299       6.420866      24.94984       10.06716      33.60305       8.336628  329.3707 79.59025 399.1104 55.26944 -69.73972      96.89850 
1 1 1 6   9  30 o 209.0587 64.53592 9.620647       5.764999      19.42485       8.372643      0.7820039      7.949672  289.9637 74.08076 159.1386 69.13822 130.8251       101.3314 
1 1 1 6   10 0  o 189.7025 34.53823 7.275877       2.450748      10.62091       3.446434      3.854267       3.485662  229.0060 40.21956 146.0153 50.49900 82.99071       64.55820 
1 1 1 6   10 1  o 563.2953 15.07349 61.73870       3.297447      64.96272       4.753246      58.74768       4.578264  577.2396 21.20343 548.9043 21.47713 28.33527       30.18033 
1 1 1 6   10 2  f 309.8416 20.00558 18.78746       2.394377      19.18856       3.407369      18.39618       3.365343  311.9261 28.44068 305.3155 28.72017 6.610596       40.41931 
1 1 1 6   10 3  o 213.8523 25.42475 9.058703       2.070159      7.186421       2.987629      10.78783       2.871138  187.2002 42.11462 232.3084 32.73187 -45.10817      53.33869 
1 1 1 6   10 4  o 1072.013 13.12018 223.5332       5.462202      227.0546       7.821362      220.1807       7.631573  1079.480 18.65691 1063.048 18.48558 16.43213       26.26399 
1 1 1 6   10 5  o 276.2203 45.10208 15.49594       4.671160      14.83639       6.589322      16.16223       6.622841  265.6172 64.51879 277.6644 62.87873 -12.04718      90.09111 
1 1 1 6   10 6  o 829.6007 22.73430 134.3952       7.324513      142.0265       10.93768      128.1906       9.862424  850.1490 33.12852 808.1591 31.42381 41.98993       45.66130 
1 1 1 6   10 7  o 453.4661 42.11417 41.05131       7.331837      0.000000       0.000000      41.05131       7.331837  ?        ?        453.4661 42.11417 0.000000       42.11417 
1 1 1 6   10 8  o 661.7974 33.83130 86.35791       8.665980      0.000000       0.000000      86.35791       8.665980  ?        ?        661.7974 33.83130 0.000000       33.83130 
1 1 1 6   10 9  o 790.1359 16.01122 121.5680       4.913083      119.9787       5.623505      126.6928       10.09841  784.5933 18.45587 803.1530 32.37628 -18.55975      37.26718 
1 1 1 6   10 10 o 939.7484 18.55342 172.0904       6.771167      0.000000       0.000000      172.0904       6.771167  ?        ?        939.7484 18.55342 0.000000       18.55342 
1 1 1 6   10 11 o 1017.833 16.23499 201.6612       6.417359      216.0739       7.820103      171.9414       11.22958  1053.075 19.12164 936.8306 30.86557 116.2446       36.30868 
1 1 1 6   10 12 o 577.1348 17.67192 64.84502       3.960855      64.60215       4.509679      65.66460       8.284434  575.8282 20.16623 577.0690 37.16404 -1.240784      42.28289 
1 1 1 6   10 13 o 1269.637 14.34697 313.4737       7.074044      307.6046       9.792398      319.8796       10.23039  1256.805 20.06287 1281.544 20.55561 -24.73889      28.72372 
1 1 1 6   10 14 f 680.8509 14.89966 90.13949       3.939637      92.19596       5.410196      87.81809       5.748123  688.1632 20.24387 671.4639 22.04324 16.69934       29.92856 
1 1 1 6   10 15 o 101.7851 42.13593 0.5387638      2.720035      -0.5037977     3.563653      1.993854       4.210072  106.9280 46.37260 135.6562 53.74984 -28.72828      70.98918 
1 1 1 6   10 16 o 176.3273 43.83695 6.335280       2.988999      4.692348       3.981203      8.457666       4.524981  159.7630 54.00157 203.8131 55.61807 -44.05002      77.52122 
1 1 1 6   10 17 o 550.3181 18.37941 58.90466       3.928018      54.54026       5.303558      64.20766       5.846101  529.1104 25.81030 574.0612 26.22286 -44.95081      36.79416 
1 1 1 6   10 18 o 154.3337 48.82441 4.612580       3.278227      3.979319       4.353487      5.441906       4.982056  155.3637 56.18186 174.2648 60.36732 -18.90115      82.46584 
1 1 1 6   10 19 o 469.7274 22.63315 42.97013       4.128753      50.93001       5.789773      34.73401       5.889377  510.0438 29.35370 419.7872 36.48831 90.25659       46.82987 
1 1 1 6   10 20 o 1069.876 16.27000 222.6381       6.760038      229.5607       9.563310      215.7247       9.556968  1085.516 22.68526 1052.186 23.38835 33.33008       32.58276 
1 1 1 6   10 21 o 577.1996 21.66765 64.90085       4.856975      60.89981       6.601703      69.62193       7.171183  557.4073 30.61414 596.0150 31.08946 -38.60760      43.63233 
1 1 1 6   10 22 o 546.7213 28.27833 58.53209       5.983553      78.27525       10.72145      49.60102       7.211020  628.9710 44.17307 501.5339 37.28939 127.4371       57.80795 
1 1 1 6   10 23 o 703.8632 23.68840 96.63887       6.475182      109.2324       7.860881      70.05914       11.42020  747.8021 27.06803 592.6676 50.08646 155.1345       56.93269 
1 1 1 6   10 24 o 694.3778 24.42562 94.16689       6.586722      93.48172       7.847973      95.79967       12.11497  690.9847 29.24564 694.1663 45.18600 -3.181580      53.82455 
1 1 1 6   10 25 o 406.8009 37.58414 32.93234       5.870524      35.44088       6.877714      26.19928       11.26783  420.6996 42.68748 346.6350 84.47492 74.06461       94.64794 
1 1 1 6   10 26 o 759.0325 24.46336 112.8218       7.211149      123.7459       8.730776      89.37323       12.79141  793.7938 28.32156 665.1096 49.88528 128.6842       57.36420 
1 1 1 6   10 27 o 127.2908 56.70823 -1.635520      5.667704      -4.913141      8.378873      1.129167       7.695364  143.0413 65.76523 162.8231 69.33416 -19.78177      95.56302 
1 1 1 6   10 28 o 226.9413 64.94366 11.18758       6.013711      7.332501       8.919359      14.40069       8.142921  205.0762 79.11146 254.1924 76.34872 -49.11618      109.9443 
1 1 1 6   10 29 o 147.5116 60.29557 2.382379       5.479122      -8.758017      7.537726      14.86322       7.978329  119.6995 57.26102 255.2221 75.32048 -135.5226      94.61501 
1 1 1 6   10 30 o 260.3164 56.46401 14.80345       5.543972      18.53595       8.006557      11.36554       7.684100  283.2516 72.48491 224.5840 75.02757 58.66754       104.3226 
1 1 1 6   11 0  o 736.8548 14.27553 105.6578       4.085094      101.7781       5.687805      109.7915       5.870937  722.4060 20.27381 750.3265 20.14787 -27.92047      28.58258 
1 1 1 6   11 1  o 1004.192 13.68804 196.1991       5.338093      188.6931       7.335561      204.6480       7.782670  983.8489 19.19893 1024.523 19.56045 -40.67456      27.40821 
1 1 1 6   11 2  o 524.5027 15.30984 53.55371       3.118504      51.18164       4.312413      56.15390       4.515021  512.1063 21.68364 536.4064 21.67394 -24.30011      30.65844 
1 1 1 6   11 3  o 568.6653 14.14993 62.93181       3.124920      60.92194       4.395018      64.98672       4.443999  558.8655 20.25002 577.2628 19.82314 -18.39728      28.33761 
1 1 1 6   11 4  o 786.8257 15.84144 120.5541       4.840623      108.4932       9.838260      124.4064       5.560204  742.6298 34.11284 798.9835 17.91946 -56.35370      38.53301 
1 1 1 6   11 5  o 614.7126 35.82930 74.69482       8.516312      0.000000       0.000000      74.69482       8.516312  ?        ?        614.7126 35.82930 0.000000       35.82930 
1 1 1 6   11 6  o 633.9330 16.93642 78.29268       4.169586      76.78638       4.721217      83.63230       8.888987  627.4855 19.37413 650.6921 35.30836 -23.20667      40.27453 
1 1 1 6   11 7  o 1047.117 31.08095 215.2514       12.63914      0.000000       0.000000      215.2514       12.63914  ?        ?        1047.117 31.08095 0.000000       31.08095 
1 1 1 6   11 8  o 617.9917 25.04118 74.67013       6.009876      74.39606       8.534657      74.93969       8.464274  613.6204 35.97164 615.9922 35.53317 -2.371887      50.56248 
1 1 1 6   11 9  o 455.1124 30.23223 40.77224       5.312991      40.09507       7.446720      41.47434       7.582530  448.1190 43.33099 455.8174 43.35693 -7.698364      61.29762 
1 1 1 6   11 10 o 629.5999 16.56207 77.16991       4.049554      79.65594       4.603141      68.65887       8.517123  639.4527 18.53608 589.6246 37.38887 49.82806       41.73145 
1 1 1 6   11 11 o 1095.486 13.41163 233.3833       5.705799      248.0990       8.390746      220.7253       7.782028  1128.610 19.14383 1064.583 18.82284 64.02661       26.84745 
1 1 1 6   11 12 o 102.0649 41.92063 0.6781906      2.664460      0.6781906      2.664460      0.000000       0.000000  102.0649 41.92063 ?        ?        0.000000       41.92063 
1 1 1 6   11 13 o 595.9112 14.81818 69.05346       3.429291      69.54189       4.733212      68.51378       4.975344  597.6313 20.39363 593.0989 21.60071 4.532410       29.70675 
1 1 1 6   11 14 o 510.0757 16.54452 50.60148       3.277304      53.10629       4.488423      47.74100       4.796516  522.2178 22.13167 494.3072 25.06828 27.91061       33.43994 
1 1 1 6   11 15 o 269.2621 37.50660 14.44982       3.815529      14.44982       3.815529      0.000000       0.000000  269.2621 37.50660 ?        ?        0.000000       37.50660 
1 1 1 6   11 16 o 488.2466 18.59870 46.36879       3.526547      42.70284       4.693605      51.12120       5.344045  467.4525 25.95691 511.4633 27.00034 -44.01077      37.45370 
1 1 1 6   11 17 o 971.4954 15.23987 183.4801       5.749762      184.6278       8.082902      182.3045       8.180764  973.9774 21.36931 967.7882 21.76635 6.189209       30.50281 
1 1 1 6   11 18 o 557.2237 19.30688 60.41571       4.178013      65.69946       5.810631      54.75994       6.011703  580.6138 25.76962 528.9816 29.37934 51.63220       39.07964 
1 1 1 6   11 19 o 505.0513 21.18194 49.66750       4.154601      49.31265       5.647381      50.08611       6.133686  501.7976 29.10449 505.3813 31.40716 -3.583679      42.81916 
1 1 1 6   11 20 o 674.2834 18.63233 88.49036       4.879077      89.08560       6.582047      87.76437       7.269116  675.9091 25.07522 670.5404 27.91442 5.368652       37.52308 
1 1 1 6   11 21 o 404.9188 27.61957 32.15569       4.317307      28.38054       5.797079      36.85706       6.469265  378.1087 40.09044 431.6447 39.01397 -53.53604      55.94044 
1 1 1 6   11 22 o 178.4709 67.20271 4.861724       6.337514      4.737562       8.973027      4.985311       8.952205  197.8426 78.44427 199.1381 78.54447 -1.295456      111.0078 
1 1 1 6   11 23 o 876.2861 27.09151 150.0723       9.219493      147.1197       13.45200      152.6877       12.66062  864.3168 40.07614 881.4366 36.98589 -17.11975      54.53487 
1 1 1 6   11 24 o 593.3019 23.42364 68.75299       5.397071      71.50949       7.297115      65.42406       8.019090  602.9207 31.27209 575.3815 36.06969 27.53912       47.73852 
1 1 1 6   11 25 o 273.2025 47.25599 15.29784       4.832374      8.581377       6.350685      24.53504       7.447672  206.9461 68.16749 344.0563 57.78828 -137.1102      89.36605 
1 1 1 6   11 26 o 169.3074 62.89912 4.827992       5.515336      -1.568184      6.564129      20.18571       10.17139  138.3708 61.36936 301.3137 83.85077 -162.9428      103.9093 
1 1 1 6   11 27 o 454.2496 36.76102 41.31240       6.429402      49.80526       9.663496      34.56699       8.612146  492.3719 51.29029 407.2131 55.93536 85.15875       75.89110 
1 1 1 6   11 28 o 483.4370 31.55834 46.57683       5.892408      50.90134       8.093807      41.70016       8.595006  500.6347 42.01839 448.6174 50.19373 52.01733       65.45958 
1 1 1 6   11 29 o 98.34293 47.41606 -7.500644      5.406075      -4.561259      7.597072      -10.51594      7.694550  133.6342 61.86037 116.1521 56.14203 17.48207       83.53821 
1 1 1 6   11 30 o 400.2068 36.96451 32.59980       5.680182      38.20475       8.427736      27.93443       7.688979  424.3074 52.24878 359.1941 57.02591 65.11334       77.34267 
1 1 1 6   12 0  o 735.2484 21.11069 105.5371       6.027881      0.000000       0.000000      105.5371       6.027881  ?        ?        735.2484 21.11069 0.000000       21.11069 
1 1 1 6   12 1  o 158.6071 39.35789 5.168792       2.412776      7.055604       3.308151      3.024462       3.526686  184.7141 46.22702 136.7380 50.39437 47.97609       68.38516 
1 1 1 6   12 2  o 236.2558 26.99858 11.07143       2.432662      7.677200       3.508113      14.21534       3.376280  192.5466 47.26458 266.8156 33.30921 -74.26898      57.82253 
1 1 1 6   12 3  o 325.8263 27.03170 20.93383       3.389594      0.000000       0.000000      20.93383       3.389594  ?        ?        325.8263 27.03170 0.000000       27.03170 
1 1 1 6   12 4  o 694.8976 14.51255 94.00021       3.916451      93.74751       6.155322      94.17210       5.076634  692.6750 22.88196 694.9411 18.81048 -2.266052      29.62125 
1 1 1 6   12 5  o 197.4302 30.62730 7.826396       2.272207      0.000000       0.000000      7.826396       2.272207  ?        ?        197.4302 30.62730 0.000000       30.62730 
1 1 1 6   12 6  o 381.1242 36.25292 28.87421       5.301198      25.16517       7.427997      32.72440       7.568016  349.6867 56.63382 402.1724 49.50023 -52.48569      75.21743 
1 1 1 6   12 7  o 267.9491 48.66320 14.71056       4.877338      14.42929       6.737478      15.02026       7.069704  261.4850 66.26436 266.4858 68.06779 -5.000885      94.99574 
1 1 1 6   12 8  f 881.4556 22.88958 151.6746       7.835492      150.3618       11.19243      152.9364       10.97295  875.1485 32.93172 882.8773 32.00333 -7.728821      45.92071 
1 1 1 6   12 9  o 836.8583 22.95491 136.6554       7.460285      135.7210       10.63386      137.5611       10.46894  831.8506 32.91681 837.6552 32.18174 -5.804626      46.03456 
1 1 1 6   12 10 o 588.5541 26.75533 67.66578       6.115398      68.65667       8.634241      66.66833       8.662786  589.9116 37.88894 581.0984 38.60630 8.813232       54.09269 
1 1 1 6   12 11 o 1278.150 16.79021 317.8845       8.334239      323.6105       9.941224      304.3419       15.28853  1289.074 19.85794 1247.333 31.56132 41.74036       37.28880 
1 1 1 6   12 12 o 429.5231 15.80411 35.88308       2.636238      35.90001       3.534503      35.86187       3.957694  429.3408 21.19816 428.2817 23.89012 1.059082       31.93900 
1 1 1 6   12 13 o 810.1384 19.17101 127.7230       6.031594      127.7230       6.031594      0.000000       0.000000  810.1384 19.17101 ?        ?        0.000000       19.17101 
1 1 1 6   12 14 o 1273.090 14.50894 315.0719       7.173366      316.9050       10.08412      313.1941       10.20632  1276.088 20.34836 1268.543 20.71745 7.545288       29.03909 
1 1 1 6   12 15 o 250.7201 29.53110 12.42721       2.820248      11.75139       3.670009      13.40185       4.407324  241.8106 40.51399 257.6295 45.72525 -15.81888      61.09159 
1 1 1 6   12 16 o 1458.410 15.64768 413.5167       8.862528      428.4172       12.88709      400.1463       12.20752  1483.499 22.36864 1433.787 21.92374 49.71167       31.32102 
1 1 1 6   12 17 o 519.4348 19.05500 52.49361       3.843864      50.64758       5.176711      54.76221       5.738715  509.1023 26.27265 529.2098 28.02261 -20.10748      38.41249 
1 1 1 6   12 18 o 191.1204 46.18369 7.467658       3.389685      4.074405       4.440429      12.20648       5.247492  156.8188 56.73517 243.6516 56.54708 -86.83273      80.10276 
1 1 1 6   12 19 o 372.8301 27.48573 27.27062       3.951599      31.91604       5.304340      21.47720       5.923613  402.4415 34.26535 326.7622 48.12032 75.67923       59.07351 
1 1 1 6   12 20 o 838.9710 17.41777 136.9662       5.675022      133.8286       7.668758      140.7645       8.437606  828.5402 23.83326 849.4841 25.57620 -20.94391      34.95950 
1 1 1 6   12 21 o 835.6030 20.27271 135.9946       6.578696      139.7469       7.968237      127.9607       11.65952  846.4991 24.23861 807.6476 37.17327 38.85156       44.37750 
1 1 1 6   12 22 o 897.7887 20.38869 157.0506       7.108721      158.3233       8.547206      154.1949       12.80335  900.7449 24.43399 886.0518 37.20802 14.69305       44.51355 
1 1 1 6   12 23 o 1004.631 21.68643 196.8877       8.461020      209.9463       15.21878      191.0457       10.17917  1032.513 37.95390 988.4866 26.51633 44.02606       46.29918 
1 1 1 6   12 24 o 222.2760 55.47633 10.32072       4.773650      14.51493       6.353108      4.882285       7.234332  262.2934 63.13091 183.6567 71.13575 78.63675       95.10944 
1 1 1 6   12 25 o 452.3918 30.04055 40.41756       5.247762      43.00183       6.934939      36.95514       8.027209  464.1426 38.83038 426.4043 49.38904 37.73831       62.82575 
1 1 1 6   12 26 f 224.1437 63.23791 10.72269       5.743950      9.293866       8.295273      12.03880       7.961357  217.7314 77.69105 237.6121 76.18490 -19.88077      108.8119 
1 1 1 6   12 27 o 369.1519 42.92929 27.76952       6.039484      23.19757       7.215694      38.46577       11.03679  330.4925 58.35328 420.7064 70.01217 -90.21387      91.14169 
1 1 1 6   12 28 o 502.1354 30.81247 50.26684       5.979589      51.44705       8.349062      49.02392       8.568019  501.8052 43.26534 488.3739 45.70677 13.43137       62.93646 
1 1 1 6   12 29 o 539.5141 28.69317 57.98151       5.990254      80.49899       8.930743      39.56561       8.076518  631.1345 36.59366 434.9860 48.64307 196.1485       60.87072 
1 1 1 6   13 0  o 630.1647 17.31269 77.40372       4.236884      77.54592       6.577557      77.30286       5.539095  629.0476 26.92484 628.8977 22.67936 0.1499023      35.20370 
1 1 1 6   13 1  o 566.6727 22.34650 62.74381       4.917789      0.000000       0.000000      62.74381       4.917789  ?        ?        566.6727 22.34650 0.000000       22.34650 
1 1 1 6   13 2  o 76.81579 35.59069 -2.100374      2.523067      -6.090849      3.834332      0.9469062      3.350685  81.71969 39.53108 114.4687 47.01197 -32.74898      61.42338 
1 1 1 6   13 3  o 487.9907 16.88150 46.39868       3.199268      40.55398       4.753975      51.23674       4.325250  454.2191 27.07324 512.2262 21.74310 -58.00714      34.72352 
1 1 1 6   13 4  o 133.3582 38.02594 3.598936       2.065536      3.851666       3.033032      3.380350       2.820727  142.1822 47.12243 134.6095 45.45502 7.572662       65.47276 
1 1 1 6   13 5  o 289.7723 18.60224 16.43443       2.082329      16.04288       3.066941      16.76929       2.836281  284.8370 28.09142 291.7592 25.28198 -6.922211      37.79294 
1 1 1 6   13 6  o 146.6189 58.20960 2.471021       4.946824      -6.984224      6.734294      13.55262       7.290493  119.1721 56.15818 253.5940 71.13841 -134.4219      90.63342 
1 1 1 6   13 7  o 863.3768 22.94429 145.4972       7.693128      135.9806       10.48710      156.5855       11.32003  832.5131 32.43669 893.3090 32.63005 -60.79590      46.00934 
1 1 1 6   13 8  o 581.6090 27.59002 66.13634       6.231766      63.76532       8.753126      68.57341       8.874218  567.6211 39.96293 588.9825 39.01813 -21.36139      55.85204 
1 1 1 6   13 9  o 210.8722 58.88516 9.140010       5.007183      5.416044       7.121540      12.78083       7.041588  188.2414 71.15624 248.0813 70.02682 -59.83984      99.83469 
1 1 1 6   13 10 o 256.5132 53.06921 13.49902       5.112280      14.64706       7.079101      12.24770       7.390670  265.2073 68.31441 244.3715 72.58730 20.83582       99.67836 
1 1 1 6   13 11 o 313.6304 44.13469 19.70991       5.226885      26.99281       7.463599      12.70017       7.322290  365.5780 54.21305 248.5904 71.81566 116.9876       89.98079 
1 1 1 6   13 12 o 547.5001 17.09319 58.30790       3.634422      58.06901       4.008507      59.41156       8.615947  546.2712 18.89497 548.9542 40.70462 -2.682922      44.87634 
1 1 1 6   13 13 f 1108.342 13.84126 238.7811       5.957685      241.2991       8.363491      236.1871       8.488785  1113.617 19.33854 1101.698 19.84060 11.91846       27.70611 
1 1 1 6   13 14 o 134.0137 42.63896 3.452317       2.497476      3.759896       3.106369      2.890065       4.199920  142.5566 47.70318 143.5938 54.55673 -1.037231      72.47089 
1 1 1 6   13 15 o 694.2973 15.41177 93.71557       4.155526      87.68874       5.537795      101.4830       6.286809  671.2380 21.24380 722.0125 22.42114 -50.77441      30.88700 
1 1 1 6   13 16 o 703.9129 15.85960 96.34249       4.335501      95.60394       5.824922      97.25983       6.491796  700.8245 21.40193 706.6770 23.65462 -5.852478      31.89958 
1 1 1 6   13 17 o 948.4625 15.30891 174.9204       5.638876      176.3377       7.753048      173.3287       8.216245  951.7188 20.97664 943.3885 22.42615 8.330200       30.70752 
1 1 1 6   13 18 f 572.5848 19.32344 63.81604       4.296871      61.18666       5.724487      67.20931       6.503093  560.0856 26.31808 586.7726 28.53791 -26.68695      38.82079 
1 1 1 6   13 19 o 340.0330 48.16702 23.24115       6.182733      0.000000       0.000000      23.24115       6.182733  ?        ?        340.0330 48.16702 0.000000       48.16702 
1 1 1 6   13 20 o 611.1561 23.16896 72.81125       5.499038      75.35636       6.539336      66.66579       10.16150  621.2999 27.10219 579.8794 45.48726 41.42053       52.94922 
1 1 1 6   13 21 o 883.4443 20.08688 152.0374       6.891592      152.5850       8.266544      150.7896       12.47892  884.4166 24.06795 876.5437 36.65856 7.872864       43.85335 
1 1 1 6   13 22 o 584.8986 22.70005 66.74403       5.156266      70.64911       6.927588      61.89342       7.720863  600.7594 29.69296 560.2122 35.67397 40.54718       46.41448 
1 1 1 6   13 23 o 327.3797 48.33772 21.76716       5.960766      34.46537       10.50535      15.73794       7.238854  405.9420 69.11394 272.5757 68.47317 133.3664       97.28983 
1 1 1 6   13 24 o 350.6206 46.59262 24.94122       6.187181      27.28832       10.91249      23.82923       7.511172  353.6952 81.16585 338.2550 59.34305 15.44016       100.5460 
1 1 1 6   13 25 o 331.8320 44.83058 22.40843       5.629350      20.27086       8.253013      24.26822       7.698126  305.8793 70.86521 339.6307 60.58681 -33.75140      93.23433 
1 1 1 6   13 26 o 352.8463 39.19601 25.14087       5.280237      31.72157       7.063808      16.80730       7.949105  393.6935 47.13850 275.8129 73.05233 117.8806       86.94068 
1 1 1 6   13 27 o 325.0393 49.47020 22.03861       6.047619      20.07562       7.293015      26.35979       10.82056  303.3153 63.92896 337.3996 83.12240 -34.08426      104.8630 
1 1 1 6   13 28 f 692.1420 27.19284 94.84000       7.309332      91.22826       8.987700      101.8947       12.56112  674.1502 34.44419 703.5405 46.23127 -29.39032      57.65183 
1 1 1 6   13 29 o 402.7165 34.54933 32.81426       5.351079      35.97616       7.930442      30.17142       7.250345  412.7805 50.52579 377.4966 50.74074 35.28391       71.60641 
1 1 1 6   14 0  o 553.4922 24.50769 59.92528       5.267952      0.000000       0.000000      59.92528       5.267952  ?        ?        553.4922 24.50769 0.000000       24.50769 
1 1 1 6   14 1  o 434.2196 20.62280 36.79763       3.477643      37.89911       5.368269      36.00110       4.565046  438.0439 31.77257 427.7701 27.62701 10.27380       42.10402 
1 1 1 6   14 2  o 596.8829 22.36017 69.58073       5.183132      0.000000       0.000000      69.58073       5.183132  ?        ?        596.8829 22.36017 0.000000       22.36017 
1 1 1 6   14 3  o 533.8548 15.87308 55.49646       3.290881      56.02332       4.656921      54.97091       4.651103  535.6396 22.38712 530.5601 22.57321 5.079529       31.79203 
1 1 1 6   14 4  o 623.8262 14.25055 75.72960       3.452416      78.99707       4.957205      72.65205       4.810984  636.4673 20.05547 610.3403 20.29709 26.12701       28.53408 
1 1 1 6   14 5  o 707.6869 16.90433 97.52643       4.645869      96.72337       5.210493      100.6411       10.26143  704.4965 19.04461 714.0842 37.13054 -9.587708      41.72978 
1 1 1 6   14 6  o 599.1815 27.32131 70.19907       6.357522      71.54854       8.835258      68.75014       9.155055  601.8248 37.99765 589.2785 40.24548 12.54633       55.34908 
1 1 1 6   14 7  o 458.3127 32.48288 41.35636       5.744099      43.11545       8.026559      39.50975       8.223797  465.1381 44.99668 444.1599 48.46309 20.97815       66.13148 
1 1 1 6   14 8  o 766.1117 24.77992 114.5174       7.372588      97.79932       9.873178      135.5891       11.08446  705.1776 36.17384 831.7920 34.31403 -126.6144      49.85979 
1 1 1 6   14 9  o 269.0557 51.64195 14.78111       5.199794      13.05546       7.414970      16.45081       7.293767  251.4712 72.15898 281.0966 67.63506 -29.62543      98.90106 
1 1 1 6   14 10 o 1015.902 23.05504 201.0935       9.095900      196.5288       12.69764      205.9049       13.03613  1002.581 32.61184 1026.197 32.71070 -23.61566      46.19007 
1 1 1 6   14 11 o 401.7145 36.69098 31.84224       5.660882      29.12833       7.967644      34.60861       8.044298  380.0479 55.63099 416.0446 50.84554 -35.99667      75.36627 
1 1 1 6   14 12 o 1001.829 16.12967 195.1651       6.275479      192.4545       7.128923      204.4963       13.22695  994.6292 18.45588 1023.134 33.28888 -28.50488      38.06269 
1 1 1 6   14 13 o 550.8475 14.69011 58.98532       3.142567      62.79046       4.302354      54.63321       4.601204  568.0967 19.50096 529.7485 22.36525 38.34814       29.67308 
1 1 1 6   14 14 o 344.4001 21.56965 23.17651       2.870373      21.69639       3.687068      25.45360       4.573223  332.3226 28.85531 359.5474 33.12453 -27.22473      43.93021 
1 1 1 6   14 15 o 803.1621 19.83430 125.5218       6.186543      125.5218       6.186543      0.000000       0.000000  803.1621 19.83430 ?        ?        0.000000       19.83430 
1 1 1 6   14 16 o 865.7600 20.49234 145.9043       6.889967      145.9043       6.889967      0.000000       0.000000  865.7600 20.49234 ?        ?        0.000000       20.49234 
1 1 1 6   14 17 o 493.8659 20.46994 47.48877       3.926029      44.23501       5.070327      52.36054       6.204212  475.3347 27.58545 516.7571 31.05943 -41.42233      41.54089 
1 1 1 6   14 18 o 858.9721 16.32585 143.5345       5.446064      149.3146       7.453273      136.9133       7.977189  875.4498 21.92239 837.9592 24.51315 37.49066       32.88594 
1 1 1 6   14 19 o 130.3896 52.35207 1.640106       4.046806      7.186965       4.712098      -13.94858      7.899425  189.7929 58.30555 113.5792 55.35388 76.21370       80.39645 
1 1 1 6   14 20 o 401.4317 31.19267 31.71377       4.824680      31.83066       5.682298      31.41181       9.132856  401.1171 36.89093 392.0106 62.05670 9.106506       72.19401 
1 1 1 6   14 21 o 555.8507 22.63974 60.26556       4.887172      64.95758       6.452203      53.95072       7.485306  575.5513 28.95917 522.6792 37.11756 52.87213       47.07809 
1 1 1 6   14 22 o 915.0473 18.10468 163.1425       6.433724      166.2417       8.673186      159.3507       9.593595  922.4601 24.21046 902.3757 27.37575 20.08441       36.54556 
1 1 1 6   14 23 o 529.1321 25.26363 54.79658       5.191440      50.73880       6.698736      60.89865       8.214614  506.3907 34.26435 553.7067 38.43955 -47.31601      51.49412 
1 1 1 6   14 24 o 525.8384 39.86782 55.23348       8.080895      0.000000       0.000000      55.23348       8.080895  ?        ?        525.8384 39.86782 0.000000       39.86782 
1 1 1 6   14 25 o 622.2505 23.77211 75.92004       5.744616      76.96551       7.730920      74.63108       8.584131  623.2808 32.04729 612.0212 36.27798 11.25952       48.40580 
1 1 1 6   14 26 f 486.8651 28.60703 46.95987       5.385140      54.07703       7.197613      37.90977       8.116373  519.7017 35.88184 428.6180 49.68123 91.08374       61.28402 
1 1 1 6   14 27 o 564.9548 26.87552 63.08241       5.896558      75.14914       8.261247      50.55050       8.418974  612.0544 34.90041 496.7594 44.09856 115.2951       56.23808 
1 1 1 6   14 28 o 417.0342 37.50386 35.36156       6.009053      31.22384       7.524678      42.64544       9.983647  384.0423 51.77158 444.2793 59.34713 -60.23700      78.75518 
1 1 1 6   15 0  o 551.5309 17.90733 59.27328       3.835559      56.13544       5.261449      62.83209       5.603271  535.8038 25.28550 566.8364 25.45399 -31.03265      35.87844 
1 1 1 6   15 1  o 381.5451 21.77559 28.50094       3.213212      31.42436       4.566992      25.63525       4.521683  399.3562 29.65882 359.8766 32.71051 39.47958       44.15454 
1 1 1 6   15 2  o 102.6925 41.81036 0.8360450      2.621510      0.3565699      3.699803      1.319465       3.714993  114.8642 48.45367 122.9405 49.87802 -8.076332      69.53830 
1 1 1 6   15 3  o 286.1018 24.94574 16.10987       2.743961      14.97235       3.916813      17.20621       3.845270  273.2762 37.92920 294.0673 34.31609 -20.79105      51.14899 
1 1 1 6   15 4  o 447.0748 21.86087 38.98256       3.795557      39.76206       4.229250      35.75590       8.604596  450.6523 24.25466 420.3513 53.95515 30.30103       59.15612 
1 1 1 6   15 5  o 170.8373 34.39842 5.925730       2.203223      6.368976       3.246913      5.547476       2.999437  176.3294 46.68166 164.9908 45.38940 11.33861       65.11048 
1 1 1 6   15 6  o 499.4762 14.89844 48.52864       2.889905      46.98107       4.003215      50.21282       4.176155  491.0187 20.99341 507.6097 21.18452 -16.59100      29.82460 
1 1 1 6   15 7  o 1261.316 23.18668 310.1472       11.35770      313.1053       16.05386      307.1829       16.07058  1264.849 32.68231 1252.724 33.03301 12.12524       46.46841 
1 1 1 6   15 8  o 1311.108 23.31963 335.0315       11.87376      319.8115       16.09532      353.2051       17.58783  1278.778 32.40980 1343.492 33.70925 -64.71387      46.76226 
1 1 1 6   15 9  o 672.1459 26.56101 88.11724       6.933240      94.04295       9.957011      82.53989       9.659901  691.9297 37.19077 647.8160 38.57119 44.11377       53.58069 
1 1 1 6   15 10 o 1558.679 24.12794 473.3503       14.60511      463.6963       20.23236      483.8548       21.10473  1540.190 33.82551 1573.088 34.54608 -32.89832      48.34870 
1 1 1 6   15 11 o 906.3092 24.24125 160.0030       8.532166      156.2299       11.61331      164.4281       12.57681  894.2820 33.43902 917.1290 35.31116 -22.84692      48.63174 
1 1 1 6   15 12 o 641.6321 28.08119 80.26944       6.997284      75.66365       9.559458      85.58538       10.27002  620.4137 39.88705 659.9177 40.26580 -39.50397      56.67726 
1 1 1 6   15 13 o 1011.441 16.63547 198.9318       6.534368      201.0042       7.544267      192.7081       13.07379  1016.462 19.11164 993.2449 33.89355 23.21692       38.91050 
1 1 1 6   15 14 o 863.9819 19.24775 145.2390       6.458216      145.2390       6.458216      0.000000       0.000000  863.9819 19.24775 ?        ?        0.000000       19.24775 
1 1 1 6   15 15 o 158.0829 43.97618 5.052057       2.798226      6.378212       3.417452      2.354179       4.874348  177.1569 48.33082 146.0672 57.84762 31.08975       75.38047 
1 1 1 6   15 16 o 318.1984 26.95875 19.89282       3.300077      20.07782       4.116368      19.56002       5.521004  318.6304 33.78111 311.8164 47.05655 6.813995       57.92653 
1 1 1 6   15 17 o 451.2352 27.93661 39.90094       4.871510      39.90094       4.871510      0.000000       0.000000  451.2352 27.93661 ?        ?        0.000000       27.93661 
1 1 1 6   15 18 o 643.9271 20.28880 80.75390       5.073657      83.04284       6.025856      75.17889       9.404248  652.6276 23.77526 617.5504 39.41809 35.07727       46.03313 
1 1 1 6   15 19 o 148.5519 55.22612 3.424070       4.253228      2.983906       4.896139      4.777732       8.586212  150.9499 58.50639 195.1839 76.94209 -44.23398      96.65962 
1 1 1 6   15 20 o 626.7083 20.35383 76.53603       4.953813      80.66486       6.524165      70.91461       7.612606  642.6537 26.14086 600.7014 32.75591 41.95239       41.90816 
1 1 1 6   15 21 o 705.5987 19.84198 97.05717       5.437144      100.9573       7.387076      92.44646       8.031898  718.5328 26.47268 686.8746 30.11014 31.65814       40.09269 
1 1 1 6   15 22 o 157.2984 55.93779 4.385481       4.296837      -1.234086      5.616771      12.31445       6.671809  129.8835 57.22714 241.6284 68.14864 -111.7449      88.98978 
1 1 1 6   15 23 o 148.2558 58.62886 2.719010       5.000128      8.107924       7.134170      -2.483895      7.009964  205.6166 72.18122 139.3770 62.50777 66.23962       95.48481 
1 1 1 6   15 24 o 603.3599 29.63539 71.70777       6.944085      77.97917       13.35648      69.38468       8.129107  615.6096 56.49784 590.6478 35.60585 24.96179       66.78160 
1 1 1 6   15 25 o 270.6464 59.93375 15.72868       6.133265      3.722087       10.85922      21.35282       7.432193  197.9150 83.22364 315.1032 62.93732 -117.1881      104.3421 
1 1 1 6   15 26 o 91.37777 44.11409 -6.881342      4.714702      -0.5382183     6.361938      -14.60900      7.022016  139.2481 61.14154 99.74699 49.31559 39.50109       78.55135 
1 1 1 6   15 27 o 230.4666 55.36320 11.56362       4.893154      11.83086       6.798576      11.27640       7.048097  229.3008 69.96303 224.4525 71.65237 4.848343       100.1443 
1 1 1 6   15 28 o 216.0990 60.75806 10.39619       5.311814      9.517605       6.640685      11.95693       8.850850  207.7342 69.74612 229.1647 80.40074 -21.43056      106.4368 
1 1 1 6   16 0  o 636.4895 17.08891 78.87861       4.224095      76.35001       5.845500      81.64202       6.110877  625.3713 24.06887 646.6429 24.33386 -21.27161      34.22641 
1 1 1 6   16 1  o 1246.937 15.14692 302.5398       7.334941      309.2814       10.42227      295.9238       10.32476  1259.483 21.30797 1231.920 21.58089 27.56287       30.32762 
1 1 1 6   16 2  o 430.1884 55.78809 37.46591       9.100792      0.000000       0.000000      37.46591       9.100792  ?        ?        430.1884 55.78809 0.000000       55.78809 
1 1 1 6   16 3  o 780.9677 14.59353 118.6388       4.426103      115.8208       6.182022      121.6024       6.339873  770.9600 20.64765 789.9658 20.66542 -19.00574      29.21276 
1 1 1 6   16 4  f 760.9896 14.39694 112.6313       4.254779      114.8194       6.026329      110.4565       6.008047  767.7427 20.21199 752.9753 20.54587 14.76746       28.82113 
1 1 1 6   16 5  o 749.8962 14.17377 109.3565       4.127760      108.8527       5.844254      109.8580       5.830837  747.6033 20.12936 751.0631 19.99063 -3.459778      28.36928 
1 1 1 6   16 6  o 271.5887 23.55378 14.48451       2.459678      13.69445       3.308256      15.46107       3.678080  262.5307 33.18970 278.9211 34.70618 -16.39041      48.02161 
1 1 1 6   16 7  o 427.5128 20.14988 35.58305       3.345412      35.06479       3.630252      38.50221       8.615748  423.6993 22.13917 438.6581 51.55893 -14.95883      56.11119 
1 1 1 6   16 8  o 271.8422 24.57183 14.51814       2.566033      16.43891       2.699836      -3.431742      8.253352  289.4438 24.24170 151.2599 67.83194 138.1840       72.03355 
1 1 1 6   16 9  o 366.8710 43.63129 26.77649       6.094504      15.02375       8.323408      40.36031       8.948344  269.9435 76.11185 449.5681 52.22612 -179.6245      92.30699 
1 1 1 6   16 10 o 841.5782 24.77468 137.9799       8.097120      134.9158       11.20321      141.3311       11.71612  830.8665 34.72027 850.2700 35.48126 -19.40350      49.64289 
1 1 1 6   16 11 o 759.0057 26.35569 112.2724       7.768684      107.6100       10.62246      117.6337       11.39091  741.7863 36.87383 775.4213 37.82619 -33.63501      52.82518 
1 1 1 6   16 12 o 428.7219 36.94530 36.21014       6.091177      33.31833       8.243676      39.68738       9.039700  407.8522 53.32301 445.7084 53.28073 -37.85623      75.38023 
1 1 1 6   16 13 o 489.2187 18.29889 46.56081       3.476608      44.97052       3.715806      57.73343       9.849015  480.7089 19.90411 539.8665 47.45827 -59.15765      51.46320 
1 1 1 6   16 14 o 185.2244 31.80211 6.889612       2.205209      9.210732       3.208012      4.810273       3.036336  213.3380 40.19487 155.5338 46.60027 57.80426       61.54034 
1 1 1 6   16 15 o 786.2859 14.79323 120.2229       4.517223      127.5334       6.381913      112.8829       6.394742  809.3227 20.30492 761.2798 21.62971 48.04291       29.66705 
1 1 1 6   16 16 o 498.2445 25.45781 48.54789       4.909522      48.54789       4.909522      0.000000       0.000000  498.2445 25.45781 ?        ?        0.000000       25.45781 
1 1 1 6   16 17 o 300.2056 34.33923 17.87411       3.931457      19.64355       4.545263      12.61779       7.833985  314.1926 38.02478 248.3232 74.95422 65.86945       84.04771 
1 1 1 6   16 18 o 214.9592 50.01786 9.501859       4.097014      10.56102       4.658717      5.886941       8.606654  226.2883 53.80072 202.1416 77.78728 24.14674       94.58000 
1 1 1 6   16 19 o 348.1431 31.09172 23.91182       4.159457      26.81917       5.373759      19.56668       6.569490  367.4620 38.21534 308.7029 56.89401 58.75912       68.53714 
1 1 1 6   16 20 o 381.4744 30.18526 28.68336       4.435338      32.18256       5.798441      23.74870       6.885821  402.6620 37.51192 341.1259 53.75687 61.53613       65.55109 
1 1 1 6   16 21 o 280.5861 41.62119 15.90919       4.397832      17.82883       5.705531      13.09908       6.903159  294.5374 51.76966 248.9672 69.00518 45.57016       86.26594 
1 1 1 6   16 22 o 651.5502 23.83493 83.06690       6.031006      81.16777       8.956172      84.64257       8.157874  639.9088 36.18760 655.6812 32.03733 -15.77240      48.33149 
1 1 1 6   16 23 o 186.7676 62.22869 6.944181       5.286795      13.75569       7.637609      0.6780484      7.325470  252.1576 73.49021 157.4889 67.36903 94.66866       99.69653 
1 1 1 6   16 24 o 173.9634 58.17593 6.018262       4.620003      3.279666       6.091681      9.726278       7.088332  161.0296 64.38049 216.0931 72.05804 -55.06352      96.62923 
1 1 1 6   16 25 o 287.7863 57.26211 17.73475       6.174651      16.19445       11.37182      18.37873       7.352992  266.3002 91.26096 288.7685 66.88186 -22.46826      113.1448 
1 1 1 6   16 26 o 379.3001 35.24316 29.05403       5.132057      29.72723       7.170625      28.34705       7.348285  376.5018 50.29892 365.9367 53.27066 10.56506       73.26489 
1 1 1 6   16 27 o 106.1082 48.88862 -2.898597      4.663881      -0.2444605     6.333975      -6.041775      6.892857  138.9126 61.00033 120.4375 56.77309 18.47511       83.33201 
1 1 1 6   17 0  o 281.8611 39.51896 15.90899       4.206923      14.40310       4.663839      22.48443       9.745608  266.3372 46.79821 326.3608 77.96145 -60.02356      90.92887 
1 1 1 6   17 1  o 1345.728 15.53642 352.3046       8.119631      349.1688       11.23318      355.7356       11.75003  1338.567 21.60900 1350.916 22.39662 -12.34900      31.12165 
1 1 1 6   17 2  o 644.1792 16.49011 80.73959       4.125325      87.04008       5.850109      74.50762       5.818204  668.2571 22.54200 618.0975 24.23840 50.15961       33.10048 
1 1 1 6   17 3  o 1143.960 14.65787 254.4972       6.511930      249.3647       9.030517      260.0572       9.399055  1131.532 20.55027 1155.470 20.94583 -23.93762      29.34351 
1 1 1 6   17 4  o 135.9082 43.64075 3.545944       2.611625      4.829087       3.691576      2.260270       3.695217  159.0416 51.95238 131.7763 50.89643 27.26532       72.72893 
1 1 1 6   17 5  o 607.7258 15.74819 71.83048       3.716777      65.63803       4.978410      79.62849       5.586646  580.4910 22.08346 639.3313 22.50076 -58.84027      31.52719 
1 1 1 6   17 6  o 1593.724 15.67821 493.9426       9.703707      483.1906       13.29832      506.1872       14.19140  1575.193 21.73878 1612.039 22.66845 -36.84570      31.40753 
1 1 1 6   17 7  o 689.8657 14.73968 92.52784       3.948940      94.09975       5.380661      90.69270       5.813738  695.3400 19.92556 682.4702 21.93531 12.86975       29.63420 
1 1 1 6   17 8  o 1270.661 14.34853 313.8715       7.080519      317.1197       7.855317      299.7994       16.35008  1277.060 15.83887 1238.604 33.99065 38.45618       37.49979 
1 1 1 6   17 9  o 146.3008 44.72459 4.211090       2.776488      4.357952       2.952268      3.086817       8.168413  149.2165 46.20259 183.0106 74.06117 -33.79411      87.29110 
1 1 1 6   17 10 o 411.8920 39.90435 33.52832       6.303054      28.10003       8.556823      39.96764       9.319686  372.0549 61.36065 446.8990 54.85015 -74.84415      82.30230 
1 1 1 6   17 11 o 356.8414 45.81973 25.40797       6.203051      26.18231       8.502530      24.52685       9.069799  358.2434 63.43587 344.8831 70.10618 13.36032       94.54621 
1 1 1 6   17 12 o 1056.954 24.52940 217.6963       10.06864      208.2611       13.55503      229.3099       15.03867  1032.150 33.81658 1082.623 35.76878 -50.47290      49.22364 
1 1 1 6   17 13 o 660.8640 17.15291 84.96403       4.402282      84.47514       4.817779      87.43721       10.83611  658.8337 18.82969 666.0056 42.11238 -7.171875      46.13035 
1 1 1 6   17 14 o 944.6705 17.20986 173.6328       6.313724      177.9728       7.218562      159.5033       13.02463  956.1390 19.44024 902.1031 37.17757 54.03583       41.95349 
1 1 1 6   17 15 o 832.2397 14.34004 134.6891       4.634755      139.9440       6.645421      129.7122       6.467275  847.7091 20.18588 816.1055 20.40549 31.60358       28.70285 
1 1 1 6   17 16 o 406.3356 22.96997 32.28691       3.609864      31.43022       4.520677      33.79441       5.996809  400.0026 29.30530 413.3366 37.77602 -13.33401      47.81033 
1 1 1 6   17 17 o 656.7814 19.55325 84.01050       4.987327      92.41389       6.096438      67.00740       8.671869  688.4786 22.80120 582.8419 38.52929 105.6367       44.77054 
1 1 1 6   17 18 o 99.66420 44.58010 -1.469913      3.540748      -5.017010      4.324061      5.748461       6.168436  94.04678 44.52469 183.8823 66.81676 -89.83550      80.29276 
1 1 1 6   17 19 o 511.6672 22.45785 51.08710       4.462556      53.95211       5.666168      46.40704       7.241901  524.3904 27.92378 483.8151 38.87111 40.57532       47.86126 
1 1 1 6   17 20 o 604.3544 21.36644 71.29237       5.014779      75.04739       6.479005      65.68133       7.919987  619.1171 26.94682 576.3948 35.55509 42.72235       44.61273 
1 1 1 6   17 21 o 635.8395 23.40664 79.07684       5.779824      78.37494       8.303409      79.73659       8.050280  629.5844 34.08751 635.4871 32.73059 -5.902649      47.25727 
1 1 1 6   17 22 o 100.4243 47.05836 -4.371072      4.614562      -2.583154      6.280016      -6.469361      6.803299  130.2943 58.73588 120.7933 56.77402 9.500961       81.68961 
1 1 1 6   17 23 o 187.9829 56.55124 7.371207       4.464874      8.480660       5.843248      5.814593       6.921340  202.2731 65.31190 185.2954 70.12341 16.97772       95.82764 
1 1 1 6   17 24 o 116.0245 51.20405 -0.8963246     4.514698      2.847413       5.869989      -6.318042      7.064038  155.2991 62.80519 123.0655 57.84509 32.23364       85.38470 
1 1 1 6   17 25 o 597.6121 29.60278 70.86305       6.870365      81.46046       13.07717      66.82286       8.074487  623.1166 54.59066 576.2318 36.26696 46.88483       65.53955 
1 1 1 6   17 26 o 323.2273 49.31769 22.06456       5.994616      33.45510       10.69428      16.84573       7.238787  381.7416 74.81140 272.0643 68.54343 109.6773       101.4640 
1 1 1 6   18 0  f 494.6814 30.52557 47.99981       5.835662      0.000000       0.000000      47.99981       5.835662  ?        ?        494.6814 30.52557 0.000000       30.52557 
1 1 1 6   18 1  o 415.1002 32.89656 33.90686       5.259691      0.000000       0.000000      33.90686       5.259691  ?        ?        415.1002 32.89656 0.000000       32.89656 
1 1 1 6   18 2  o 154.8514 46.72745 4.760587       3.044945      4.559361       4.207788      4.981805       4.411863  159.6745 55.46909 165.4532 56.83667 -5.778702      79.41805 
1 1 1 6   18 3  o 893.5582 15.13508 155.2626       5.252130      157.0785       7.368854      153.3876       7.487841  898.1579 21.12610 887.4719 21.72571 10.68604       30.30377 
1 1 1 6   18 4  o 484.2827 18.61472 45.63527       3.500931      45.62003       4.887219      45.65133       5.017478  483.0142 26.15139 483.0876 26.85026 -0.7342529E-01 37.48108 
1 1 1 6   18 5  o 333.9099 23.47183 21.82532       3.024369      23.27566       4.222649      20.29767       4.333722  343.7389 31.99974 320.2336 35.44126 23.50525       47.75003 
1 1 1 6   18 6  o 315.5833 24.44159 19.51906       2.972152      19.69333       3.940021      19.28896       4.527452  315.8715 32.58696 311.6235 38.21133 4.247986       50.21967 
1 1 1 6   18 7  o 767.8962 14.73773 114.6372       4.395023      109.9932       5.844855      120.6794       6.666972  751.7997 20.01905 787.3109 21.80491 -35.51111      29.60096 
1 1 1 6   18 8  o 982.8648 13.73267 187.7752       5.241755      184.9051       5.633954      206.2632       14.29907  975.2363 14.87563 1027.009 35.85136 -51.77234      38.81500 
1 1 1 6   18 9  o 241.0254 23.45059 11.42146       2.167254      11.56100       2.232489      9.137838       9.031169  242.4330 24.02855 227.5278 81.07698 14.90527       84.56268 
1 1 1 6   18 10 o 285.8301 32.50245 16.16477       3.543723      16.50802       3.865303      14.35561       8.873975  288.4240 35.24136 265.2159 79.71188 23.20804       87.15467 
1 1 1 6   18 11 o 681.7297 17.62322 90.42110       4.665793      92.70318       5.132501      79.55714       11.19842  690.1574 19.14930 634.3418 45.76482 55.81561       49.60962 
1 1 1 6   18 12 o 1501.940 18.34326 439.0152       10.69934      429.2064       12.20420      471.5938       22.24171  1484.514 21.16883 1551.367 36.91692 -66.85352      42.55560 
1 1 1 6   18 13 o 812.6604 17.15327 128.5035       5.413573      130.2660       6.049275      121.4150       12.13149  818.0181 19.04200 785.3759 39.90601 32.64215       44.21637 
1 1 1 6   18 14 o 432.1889 17.91630 36.35504       3.007114      35.97829       3.164796      39.85574       9.647072  429.8834 18.95689 444.3637 57.23251 -14.48029      60.29033 
1 1 1 6   18 15 o 560.8130 22.78252 61.31015       4.961898      61.31015       4.961898      0.000000       0.000000  560.8130 22.78252 ?        ?        0.000000       22.78252 
1 1 1 6   18 16 o 709.9365 16.69269 98.08484       4.602290      94.10582       5.948712      104.0175       7.263724  694.8140 22.04583 729.9941 25.62194 -35.18018      33.80092 
1 1 1 6   18 17 o 451.0382 21.04580 39.65485       3.686436      40.08545       4.966544      39.12657       5.501166  451.8888 28.44571 445.7882 31.98860 6.100555       42.80688 
1 1 1 6   18 18 o 391.3342 25.59437 30.05546       3.868309      29.53474       5.007638      30.82598       6.091471  386.4095 33.70760 393.2798 40.46066 -6.870270      52.66182 
1 1 1 6   18 19 o 566.6378 21.12318 62.66617       4.648286      59.53749       5.856740      67.99117       7.640738  551.3596 27.35225 586.9936 33.65824 -35.63397      43.37075 
1 1 1 6   18 20 o 241.9619 50.25147 12.15045       4.567588      14.76175       6.137909      8.909775       6.837695  264.3585 61.02309 211.2841 70.77396 53.07442       93.44930 
1 1 1 6   18 21 f 556.0671 24.78896 60.60597       5.353201      60.35736       7.523026      60.86097       7.619026  551.2232 35.32884 553.4170 35.63974 -2.193787      50.18285 
1 1 1 6   18 22 o 487.3673 25.28433 46.76466       4.769153      51.28063       6.290715      40.66093       7.313436  508.3532 32.02821 448.6872 42.47669 59.66599       53.19845 
1 1 1 6   18 23 o 452.7990 40.40016 41.44407       7.029602      0.000000       0.000000      41.44407       7.029602  ?        ?        452.7990 40.40016 0.000000       40.40016 
1 1 1 6   18 24 o 466.2435 26.96375 43.09021       4.861421      50.37265       6.750184      35.24268       7.007193  500.8654 34.92149 414.2976 44.23542 86.56775       56.35852 
1 1 1 6   18 25 f 113.0272 50.09929 -0.9063995     4.368268      -0.3469216     5.932002      -1.569211      6.456615  134.6142 59.07480 133.9883 60.04758 0.6259766      84.23505 
1 1 1 6   19 0  o 967.7797 16.14502 182.1607       6.067966      178.7950       8.291892      186.0413       8.903519  958.0956 22.28522 977.1547 23.46229 -19.05914      32.35907 
1 1 1 6   19 1  o 305.9846 30.54106 18.46227       3.580720      17.61517       4.989215      19.36206       5.142050  296.1885 44.77173 311.0203 43.78354 -14.83176      62.62193 
1 1 1 6   19 2  f 748.6309 16.38304 109.0011       4.763105      111.3764       6.679785      106.5441       6.793756  756.1812 22.74619 739.5015 23.65609 16.67963       32.81767 
1 1 1 6   19 3  o 292.6185 28.87681 16.86811       3.238753      16.83965       4.512261      16.89835       4.651489  290.2446 41.18690 290.5005 42.48622 -0.2559814     59.17296 
1 1 1 6   19 4  o 1108.658 15.07418 238.9816       6.490216      238.8370       9.086261      239.1323       9.273711  1107.621 21.12351 1108.247 21.54710 -0.6264648     30.17417 
1 1 1 6   19 5  o 704.8842 15.98908 96.62108       4.376926      97.04879       6.024695      96.14301       6.369503  705.9819 21.97422 702.5544 23.34520 3.427490       32.06033 
1 1 1 6   19 6  o 840.9303 15.19588 137.4980       4.962650      138.2176       6.775512      136.6653       7.289093  842.6473 20.70467 837.7255 22.40494 4.921875       30.50680 
1 1 1 6   19 7  o 976.6507 14.75823 185.4522       5.597594      179.0210       7.505922      193.5106       8.402046  959.0374 20.15304 996.9041 21.70220 -37.86670      29.61639 
1 1 1 6   19 8  o 817.5468 17.94203 130.0396       5.696554      131.8214       6.439290      123.6248       12.21795  822.9182 20.14899 794.1161 39.61742 28.80200       44.44684 
1 1 1 6   19 9  o 872.3546 14.12794 147.9586       4.786300      151.4727       5.181176      127.5052       12.49987  882.5714 15.11647 806.2213 39.92302 76.35010       42.68906 
1 1 1 6   19 10 o 972.4789 14.06912 183.8816       5.313431      181.5192       5.724172      198.5934       14.28454  966.0984 15.25679 1006.782 36.53448 -40.68341      39.59215 
1 1 1 6   19 11 o 657.1849 44.70624 85.42200       11.34212      0.000000       0.000000      85.42200       11.34212  ?        ?        657.1849 44.70624 0.000000       44.70624 
1 1 1 6   19 12 o 119.3100 47.43493 1.497077       3.289293      0.4416823      3.513516      8.983097       9.357505  113.1885 47.45396 226.9407 82.32136 -113.7522      95.01939 
1 1 1 6   19 13 o 179.6836 46.61144 6.607690       3.280314      8.012028       3.500016      -3.536521      9.406832  197.6572 46.39236 161.9635 72.53956 35.69365       86.10597 
1 1 1 6   19 14 o 210.6287 33.11154 8.892992       2.619102      8.892992       2.619102      0.000000       0.000000  210.6287 33.11154 ?        ?        0.000000       33.11154 
1 1 1 6   19 15 o 208.7999 39.08972 8.841788       3.053221      8.841788       3.053221      0.000000       0.000000  208.7999 39.08972 ?        ?        0.000000       39.08972 
1 1 1 6   19 16 o 190.1999 39.40578 7.378850       2.815008      8.191989       4.043163      6.613849       3.921661  199.3206 51.76908 180.4806 52.67791 18.84003       73.85797 
1 1 1 6   19 17 o 779.6628 15.75282 118.3359       4.769722      117.8753       6.624277      118.8318       6.873430  777.2153 21.94670 780.2313 22.68413 -3.016052      31.56307 
1 1 1 6   19 18 f 429.4838 23.21194 36.14749       3.857188      32.45019       5.073972      41.20929       5.936878  405.0265 32.53244 456.4352 33.73172 -51.40878      46.86351 
1 1 1 6   19 19 o 553.1158 22.64830 59.81683       4.864965      71.29388       7.069701      49.49343       6.704977  601.4704 30.36440 499.6576 34.77053 101.8128       46.16261 
1 1 1 6   19 20 o 420.6646 29.70739 34.99408       4.822001      35.68537       6.580150      34.19226       7.086666  421.5431 40.70056 410.9976 45.14276 10.54550       60.78161 
1 1 1 6   19 21 o 269.2100 40.76706 14.78025       4.128751      17.10799       5.372101      11.42121       6.453347  286.9044 50.03407 230.4474 67.66466 56.45697       84.15411 
1 1 1 6   19 22 o 307.1495 35.34244 19.01413       4.138888      18.63281       5.698845      19.43977       6.020973  298.3696 51.01481 304.1222 52.89985 -5.752594      73.49085 
1 1 1 6   19 23 o 612.2179 29.85941 74.33289       7.099295      74.33289       7.099295      0.000000       0.000000  612.2179 29.85941 ?        ?        0.000000       29.85941 
1 1 1 6   19 24 o 136.0649 53.57170 2.596481       4.157661      5.508233       5.704389      -0.7031953     6.072503  172.1230 63.96352 134.3106 59.32371 37.81241       87.23895 
1 1 1 6   19 25 o 118.6555 51.08422 0.2478116      4.261521      -2.663510      5.714999      3.893940       6.395685  120.2368 54.91937 163.6671 65.77869 -43.43031      85.69115 
1 1 1 6   20 0  o 572.9536 20.19501 63.90774       4.493570      57.03885       6.058280      72.30827       6.699765  539.7844 29.00656 608.6908 28.34228 -68.90643      40.55447 
1 1 1 6   20 1  o 1347.546 16.10927 353.1731       8.430386      352.0026       11.72957      354.4240       12.12499  1344.285 22.46793 1348.770 23.14810 -4.485596      32.25899 
1 1 1 6   20 2  o 549.2694 19.65308 58.72275       4.192220      55.57719       5.736103      62.32932       6.142086  533.0034 27.80781 565.1929 27.98280 -32.18951      39.45012 
1 1 1 6   20 3  o 315.0351 29.09758 19.53481       3.519725      22.99422       4.860562      15.72079       5.103612  340.6663 37.35173 278.5573 48.96473 62.10904       61.58487 
1 1 1 6   20 4  o 865.7557 15.93319 145.7726       5.357056      148.6179       7.461218      142.7452       7.696292  873.5390 21.99376 855.9665 23.15244 17.57251       31.93369 
1 1 1 6   20 5  o 287.7130 29.95854 16.33748       3.298311      17.55468       4.380265      14.74362       5.012417  296.7814 38.94467 269.3447 49.75206 27.43665       63.18192 
1 1 1 6   20 6  o 424.4804 21.74249 35.18725       3.572192      35.34795       4.636035      34.95241       5.604257  424.6223 28.27523 421.2371 34.56267 3.385223       44.65498 
1 1 1 6   20 7  o 639.0345 17.32114 79.45653       4.298619      79.67519       5.651699      79.15641       6.621062  639.4418 22.75884 636.9293 26.76754 2.512451       35.13496 
1 1 1 6   20 8  o 1039.489 18.06026 210.2963       7.290742      212.6841       8.386653      202.9090       14.75149  1045.004 20.66534 1017.267 37.33988 27.73712       42.67696 
1 1 1 6   20 9  o 644.8311 15.38992 80.87897       3.853989      81.79353       4.080572      73.32301       11.72889  648.4062 16.20488 607.0121 50.20502 41.39404       52.75550 
1 1 1 6   20 10 o 499.4910 21.10394 48.60670       4.093730      49.26551       4.432148      44.78021       10.68164  502.7336 22.70117 470.5192 59.80788 32.21448       63.97129 
1 1 1 6   20 11 o 682.9984 15.34565 90.74405       4.070360      89.40327       4.323441      101.2011       12.07407  677.8453 16.42370 715.4590 43.66413 -37.61377      46.65077 
1 1 1 6   20 12 o 817.2438 14.78987 129.9099       4.694008      132.7865       5.050825      111.6820       12.71442  826.1485 15.74259 751.5757 43.75005 74.57275       46.49619 
1 1 1 6   20 13 o 402.1459 19.63804 31.50104       3.066972      31.50104       3.066972      0.000000       0.000000  402.1459 19.63804 ?        ?        0.000000       19.63804 
1 1 1 6   20 14 o 450.1986 25.65060 39.70642       4.466095      39.70642       4.466095      0.000000       0.000000  450.1986 25.65060 ?        ?        0.000000       25.65060 
1 1 1 6   20 15 o 107.0593 44.36590 0.6286222      3.020122      -1.198136      3.170317      18.54918       9.929742  95.10693 42.38827 294.9867 83.11828 -199.8798      93.30281 
1 1 1 6   20 16 o 579.0108 21.91939 65.43517       4.928822      63.24700       5.456501      75.13529       11.48848  568.8528 24.69940 612.4932 48.70059 -43.64038      54.60593 
1 1 1 6   20 17 o 193.2838 42.31388 7.689818       3.088107      9.050479       4.421785      6.394282       4.314670  208.3392 54.15210 178.4029 55.95650 29.93633       77.86900 
1 1 1 6   20 18 o 372.5359 26.61934 27.34826       3.825811      25.33685       5.581870      29.13034       5.254027  354.8283 41.27876 382.3469 35.80079 -27.51855      54.64094 
1 1 1 6   20 19 f 445.8412 25.32152 39.10870       4.366191      46.87202       6.293706      31.90589       6.062250  485.9269 33.55651 398.6198 39.68807 87.30716       51.97290 
1 1 1 6   20 20 o 371.1438 28.62466 27.29414       4.093958      23.00283       5.371338      33.24284       6.324101  336.5469 42.01194 405.9386 40.66212 -69.39166      58.46718 
1 1 1 6   20 21 o 293.9301 36.58673 17.48029       4.085948      13.17066       5.424594      23.13167       6.211903  247.6244 57.50996 333.7874 49.41418 -86.16298      75.82320 
1 1 1 6   20 22 o 283.0530 38.40544 16.36522       4.112694      15.33294       5.601285      17.57270       6.057979  267.0038 55.81525 285.9740 56.55095 -18.97015      79.45660 
1 1 1 6   20 23 o 434.5804 25.66528 37.45307       4.312340      55.08089       6.410384      22.88154       5.828238  524.6301 31.61082 330.9586 46.63894 193.6715       56.34212 
1 1 1 6   20 24 o 94.32531 43.53029 -2.510532      3.719531      -2.947246      5.416467      -2.120812      5.116741  115.4187 52.99546 115.6529 52.49125 -0.2341080     74.59122 
1 1 1 6   21 0  o 646.6105 19.53310 81.40914       4.905032      74.17877       6.592626      90.37449       7.341108  616.3962 27.54042 680.3339 27.78508 -63.93768      39.12141 
1 1 1 6   21 1  o 392.3765 26.63724 30.18305       4.034968      28.94708       5.586292      31.53125       5.834405  382.2862 38.13664 399.1474 38.10151 -16.86118      53.90852 
1 1 1 6   21 2  o 849.5270 16.79715 140.4191       5.541670      130.5596       7.558947      151.8762       8.148417  818.3337 23.78498 882.6159 23.77242 -64.28223      33.62817 
1 1 1 6   21 3  o 230.1689 42.10135 10.73332       3.624634      10.22646       4.905146      11.34298       5.379666  222.7139 56.59534 234.2971 59.12310 -11.58313      81.84481 
1 1 1 6   21 4  o 463.5552 22.14876 41.87397       3.987300      35.20653       5.219157      51.22081       6.179494  423.0562 32.00362 510.8469 31.29920 -87.79074      44.76462 
1 1 1 6   21 5  o 500.9405 20.71078 48.88107       4.029123      47.97227       5.347162      50.07485       6.128503  494.8487 27.93844 505.0353 31.40223 -10.18661      42.03161 
1 1 1 6   21 6  o 808.3066 16.53905 127.1276       5.191760      126.8153       6.969378      127.5171       7.782200  806.6451 22.24762 808.5139 24.78488 -1.868835      33.30536 
1 1 1 6   21 7  o 459.1833 22.12143 41.09510       3.944820      39.68810       5.061176      43.27288       6.296678  449.7167 29.13577 468.6467 34.84617 -18.93002      45.42190 
1 1 1 6   21 8  o 521.4072 22.82069 53.00351       4.620977      50.78587       5.046121      64.52551       11.50207  510.1305 25.47114 568.0753 52.73820 -57.94476      58.56702 
1 1 1 6   21 9  o 631.4728 20.32680 77.68128       4.984846      75.38205       5.461350      89.15919       12.20224  621.8178 22.61564 670.2020 47.18308 -48.38416      52.32313 
1 1 1 6   21 10 o 683.5463 15.73926 90.90601       4.178113      89.11213       4.436170      104.9930       12.43142  676.6680 16.88125 728.4014 44.15478 -51.73340      47.27178 
1 1 1 6   21 11 o 467.5430 20.17439 42.58867       3.663110      42.58867       3.663110      0.000000       0.000000  467.5430 20.17439 ?        ?        0.000000       20.17439 
1 1 1 6   21 12 o 663.0221 17.49314 85.58604       4.504265      85.58604       4.504265      0.000000       0.000000  663.0221 17.49314 ?        ?        0.000000       17.49314 
1 1 1 6   21 13 o 315.4067 24.34916 19.53731       2.959428      19.49661       3.070947      20.06735       11.08238  314.9326 25.32291 306.2972 88.31190 8.635406       91.87079 
1 1 1 6   21 14 f 463.8944 19.13588 41.94386       3.447431      43.00341       3.639812      32.70803       10.74622  469.6399 19.95657 394.4536 72.83379 75.18637       75.51839 
1 1 1 6   21 15 f 217.6296 38.60344 9.619675       3.143187      10.70749       3.311903      -0.2484294     9.975112  229.9282 38.44762 178.6507 77.53075 51.27759       86.54038 
1 1 1 6   21 16 o 308.3946 29.91945 18.85040       3.538257      18.43247       3.778938      21.82141       10.07550  304.3766 32.47029 316.0656 81.54352 -11.68896      87.77052 
1 1 1 6   21 17 o 252.9095 47.68922 13.21290       4.512187      13.32303       5.200292      12.87737       9.076585  252.0336 54.70053 247.5707 81.49185 4.462906       98.14820 
1 1 1 6   21 18 o 598.7039 18.25191 69.98167       4.243736      75.69651       6.119458      64.68699       5.890204  621.1017 25.37010 573.9058 26.42784 47.19592       36.63432 
1 1 1 6   21 19 o 588.4468 19.03116 67.68791       4.349110      67.54921       6.020681      67.83926       6.289247  586.0292 26.45443 586.9572 27.59080 -0.9279785     38.22419 
1 1 1 6   21 20 o 415.3837 25.40353 34.08221       4.078300      36.31249       5.504034      31.36698       6.073028  426.1875 33.52530 393.3751 40.32283 32.81241       52.43926 
1 1 1 6   21 21 o 393.2497 27.70633 30.73088       4.204261      28.15551       5.770106      33.64552       6.138417  371.4574 40.66293 407.0050 39.32540 -35.54761      56.56820 
1 1 1 6   21 22 o 347.0098 31.04769 24.17526       4.139860      23.53004       5.661596      24.91664       6.068894  336.7074 44.37835 345.6380 46.38298 -8.930634      64.19360 
1 1 1 6   21 23 o 382.8540 29.01525 29.33439       4.282009      24.83509       5.906655      34.31823       6.216574  344.8351 45.19447 409.2331 39.61149 -64.39798      60.09667 
1 1 1 6   22 0  o 734.1232 23.50071 105.1269       6.700049      108.7273       7.644361      93.19498       13.91618  746.1478 26.38083 683.0312 52.87475 63.11658       59.09050 
1 1 1 6   22 1  o 709.7342 18.89147 98.09699       5.207024      96.10213       7.104517      100.4122       7.653811  701.5568 26.07617 716.8953 27.49122 -15.33856      37.89108 
1 1 1 6   22 2  o 647.3969 19.36296 81.63240       4.868222      80.86082       6.664698      82.51498       7.128046  643.4523 26.67080 649.7729 28.24756 -6.320618      38.84915 
1 1 1 6   22 3  o 508.6774 21.76739 50.43732       4.300083      45.29968       5.818125      56.62219       6.383608  480.0835 31.37863 537.0845 30.73284 -57.00107      43.92182 
1 1 1 6   22 4  o 82.61123 39.32393 -4.400820      3.464068      -3.818155      4.530787      -5.220663      5.374396  102.5546 47.57871 108.6205 50.86272 -6.065872      69.64732 
1 1 1 6   22 5  o 878.3389 16.56162 150.1388       5.649276      146.0205       7.490352      155.5718       8.603352  865.4258 22.28663 892.8504 24.81195 -27.42456      33.35157 
1 1 1 6   22 6  o 279.1199 36.16848 15.53623       3.828381      14.02391       4.926348      17.84214       6.083091  261.8828 50.26626 295.0251 55.11987 -33.14236      74.59824 
1 1 1 6   22 7  o 1577.062 16.79014 484.0616       10.28327      478.6247       13.97743      490.4766       15.18269  1566.601 22.97423 1585.358 24.66001 -18.75708      33.70358 
1 1 1 6   22 8  o 564.9065 22.69779 62.23168       4.979528      62.19715       5.473601      62.39746       11.99340  564.4964 24.96801 556.9831 56.21535 7.513306       61.51071 
1 1 1 6   22 9  o 840.3179 15.36693 137.3919       5.014859      131.9764       5.317008      181.0194       15.09130  823.4485 16.62658 958.8150 40.52880 -135.3665      43.80669 
1 1 1 6   22 10 o 575.2040 18.88000 64.44929       4.217470      64.44929       4.217470      0.000000       0.000000  575.2040 18.88000 ?        ?        0.000000       18.88000 
1 1 1 6   22 11 o 599.5660 18.16723 70.01994       4.230129      70.01994       4.230129      0.000000       0.000000  599.5660 18.16723 ?        ?        0.000000       18.16723 
1 1 1 6   22 12 o 249.9640 32.96248 12.47193       3.121770      13.98125       3.273843      -2.651461      10.36315  264.9887 32.49371 172.9179 76.88038 92.07082       83.46516 
1 1 1 6   22 13 o 1041.536 15.25241 211.1962       6.169372      213.7596       6.738272      197.9092       15.34080  1047.592 16.56259 1000.801 39.47049 46.79163       42.80466 
1 1 1 6   22 14 o 327.3491 25.60229 21.10316       3.228832      21.63175       3.391580      15.98852       10.54986  331.2673 26.58705 273.9290 87.68620 57.33826       91.62828 
1 1 1 6   22 15 o 409.8654 22.48535 32.94532       3.565389      33.85174       3.800404      26.28908       10.29862  415.2630 23.66358 347.5572 78.19223 67.70584       81.69449 
1 1 1 6   22 16 o 497.9305 21.57786 48.48975       4.172583      48.42067       4.557763      48.84745       10.37072  497.2265 23.60312 487.2599 55.81154 9.966583       60.59732 
1 1 1 6   22 17 o 623.8077 18.31133 75.99748       4.436072      74.56497       4.816475      84.00670       11.38872  617.5411 20.08332 644.7683 45.77998 -27.22723      49.99146 
1 1 1 6   22 18 o 208.4962 53.21519 9.231032       4.323357      9.034621       4.832967      10.01781       9.672875  205.9423 57.97321 225.9502 83.42578 -20.00789      101.5911 
1 1 1 6   22 19 o 326.9273 29.29213 21.30367       3.679600      18.27050       5.183602      24.38443       5.224113  296.7281 46.51126 346.4657 39.53405 -49.73758      61.04293 
1 1 1 6   22 20 o 413.1714 25.16769 33.79128       4.019076      26.28047       5.641342      41.53271       5.727298  358.2718 41.30178 455.3994 32.59953 -97.12766      52.61717 
1 1 1 6   22 21 o 121.3924 49.52325 1.491517       3.687241      -5.708678      4.980577      10.22376       5.484922  98.71292 47.03360 214.8452 62.18137 -116.1323      77.96590 
1 1 1 6   22 22 o 174.9087 52.96133 6.562995       3.906675      7.673867       5.450016      5.388924       5.602901  189.0840 63.18627 169.5808 63.31815 19.50316       89.45218 
1 1 1 6   23 0  o 652.0098 25.78637 83.04363       6.529386      81.90884       7.381498      87.12502       13.99881  646.9645 29.37894 658.7073 55.23296 -11.74280      62.56039 
1 1 1 6   23 1  o 750.6576 23.01798 109.9328       6.710227      104.1317       7.507659      132.9716       14.96157  730.0283 26.48115 818.1249 47.29178 -88.09662      54.20114 
1 1 1 6   23 2  o 178.5972 53.43485 6.431328       3.994375      6.802338       5.396639      5.981816       5.940199  188.3628 62.87643 184.1856 65.74159 4.177139       90.96924 
1 1 1 6   23 3  o 841.2133 17.90463 137.7938       5.849239      132.6218       7.799253      144.4425       8.842830  824.2915 24.36375 859.8387 26.48172 -35.54724      35.98436 
1 1 1 6   23 4  o 122.0724 49.95982 1.107749       3.767590      -3.105908      4.878944      7.332067       5.929829  110.9793 50.71134 195.8865 65.90679 -84.90723      83.15855 
1 1 1 6   23 5  o 443.2281 25.03838 38.47707       4.292208      36.62800       5.675922      40.94682       6.559747  430.7896 34.20837 454.9232 37.46272 -24.13361      50.73133 
1 1 1 6   23 6  o 766.8317 18.02898 114.5135       5.369073      122.7912       7.218154      104.2611       8.033087  793.2737 23.43015 730.1495 28.32975 63.12421       36.76339 
1 1 1 6   23 7  o 574.9318 20.62573 64.43411       4.605254      63.64621       5.854723      65.71268       7.458162  570.6988 26.41627 577.8662 33.37561 -7.167419      42.56467 
1 1 1 6   23 8  o 721.2671 18.00863 101.3255       5.044345      97.97294       6.363731      106.9932       8.274169  708.5320 23.12727 739.4050 28.81470 -30.87292      36.94803 
1 1 1 6   23 9  o 229.3357 55.35028 10.92906       4.873367      10.92906       4.873367      0.000000       0.000000  229.3357 55.35028 ?        ?        0.000000       55.35028 
1 1 1 6   23 10 o 362.8680 25.87335 25.87780       3.622219      25.87780       3.622219      0.000000       0.000000  362.8680 25.87335 ?        ?        0.000000       25.87335 
1 1 1 6   23 11 o 205.9147 39.73785 8.654047       3.062634      6.186384       3.201456      35.27099       10.51438  173.3601 46.56407 410.6529 68.33081 -237.2928      82.68804 
1 1 1 6   23 12 o 637.3942 24.80941 79.50064       6.141191      77.51566       7.033285      85.87033       12.59908  628.5433 28.81343 653.0319 50.06057 -24.48853      57.76049 
1 1 1 6   23 13 f 194.3113 43.01040 7.798654       3.159844      9.091127       3.317312      -4.853833      10.37919  210.3062 42.08590 163.2902 74.36173 47.01604       85.44524 
1 1 1 6   23 14 o 435.2849 23.10519 37.19036       3.891824      37.46995       4.161430      35.23999       10.99118  436.6018 24.64380 405.4149 72.46967 31.18683       76.54522 
1 1 1 6   23 15 f 299.9819 30.47004 17.91719       3.500466      19.64689       3.784498      7.674166       9.209524  314.0211 31.45584 211.2302 80.66035 102.7908       86.57691 
1 1 1 6   23 16 o 121.8117 48.21054 1.790493       3.383529      1.455308       3.650769      3.831773       9.009349  122.0597 49.47143 186.8443 76.95334 -64.78461      91.48354 
1 1 1 6   23 17 o 244.1303 38.52919 12.18723       3.531745      10.15298       3.807378      24.73045       9.454272  220.1866 46.00800 332.7680 74.95776 -112.5814      87.95113 
1 1 1 6   23 18 o 378.2952 26.52602 28.37237       3.872355      26.51908       4.189112      39.25547       10.15142  364.6692 29.84114 427.0483 63.11126 -62.37906      69.81063 
1 1 1 6   23 19 o 386.0657 32.65916 29.93862       4.850672      31.42725       5.514335      24.84678       10.19850  394.0335 36.44855 325.2621 81.03535 68.77148       88.85508 
1 1 1 6   23 20 o 312.6299 30.46202 19.65296       3.651445      14.96348       5.281781      23.94603       5.053618  263.0708 53.52011 341.9704 38.73595 -78.89960      66.06721 
1 1 1 6   23 21 o 138.5952 50.89634 3.453350       3.592721      7.325839       5.255037      0.5482819E-01  4.922954  185.1750 62.04487 125.1505 54.38965 60.02454       82.50939 
1 1 1 6   24 0  o 429.3875 29.27519 36.26963       4.852650      40.93438       6.743484      31.25985       6.988434  454.2198 38.59431 394.4586 46.51398 59.76129       60.44064 
1 1 1 6   24 1  o 799.3615 23.20101 124.7339       7.202414      128.6009       8.238894      112.1998       14.83285  811.0778 26.15643 748.8618 51.31230 62.21600       57.59436 
1 1 1 6   24 2  o 271.9814 42.30454 14.94283       4.323197      23.99167       5.901011      4.459077       6.351680  345.3348 45.07574 174.7460 66.92495 170.5888       80.68935 
1 1 1 6   24 3  o 492.7738 24.59363 47.43242       4.706502      50.37596       6.280492      43.66202       7.108068  505.7861 32.14097 469.0392 39.38710 36.74686       50.83685 
1 1 1 6   24 4  o 504.0536 23.82334 49.61324       4.663450      51.11734       6.240267      47.71069       7.018312  509.5847 31.68947 491.0001 37.07983 18.58463       48.77639 
1 1 1 6   24 5  o 709.3807 18.95967 98.07044       5.223217      99.28885       6.965586      96.50525       7.894873  712.7880 25.16340 701.9988 28.95882 10.78925       38.36417 
1 1 1 6   24 6  o 521.8155 22.53171 53.15434       4.566032      49.78472       5.821512      58.54119       7.360604  503.1231 29.92939 544.5072 34.99355 -41.38412      46.04691 
1 1 1 6   24 7  o 521.0568 24.52492 53.06631       4.962729      56.26220       5.798188      44.31124       9.596787  535.2768 27.98963 467.5600 53.83490 67.71677       60.67632 
1 1 1 6   24 8  o 138.1882 52.53950 2.787046       3.896782      0.3151724      4.438774      11.09533       8.137774  124.4589 52.81752 234.0108 77.16888 -109.5519      93.51324 
1 1 1 6   24 9  f 856.5950 16.29506 142.9458       5.420753      142.6646       5.781818      144.9884       15.58377  855.5559 17.40155 851.2005 47.32947 4.355408       50.42710 
1 1 1 6   24 10 o 390.1781 24.21834 29.90275       3.651614      30.33599       3.844107      25.89898       11.68600  392.7954 25.33513 341.9368 87.60714 50.85864       91.19693 
1 1 1 6   24 11 o 328.0274 27.01289 21.24874       3.410600      21.54199       3.591777      18.56000       10.87592  330.0321 28.29736 290.3235 88.46921 39.70868       92.88456 
1 1 1 6   24 12 o 339.7459 26.58249 22.79064       3.479379      24.86654       3.682791      5.540606       10.61618  354.8958 26.92128 208.1079 84.35677 146.7879       88.54841 
1 1 1 6   24 13 o 509.3034 21.68868 50.76191       4.289805      48.52623       4.573750      67.10906       12.36770  497.5928 23.66848 570.5447 56.56298 -72.95187      61.31532 
1 1 1 6   24 14 o 93.14328 41.95918 -1.450815      3.198347      -1.867233      3.402396      1.711847       9.376627  93.96548 42.70798 179.0541 76.39692 -85.08863      87.52406 
1 1 1 6   24 15 o 208.6336 40.95621 9.011326       3.199960      9.761802       3.379386      2.501688       9.952861  217.1805 41.58161 185.9248 79.00347 31.25569       89.27810 
1 1 1 6   24 16 o 564.6354 18.57191 62.38037       4.072421      61.10209       4.369946      70.82037       11.22884  558.4445 20.14968 586.2352 49.79252 -27.79077      53.71503 
1 1 1 6   24 17 f 112.2506 46.53328 0.9140137      3.324059      0.4458960      3.597759      3.644225       8.688658  112.1679 47.57357 180.2418 75.01794 -68.07384      88.83094 
1 1 1 6   24 18 o 523.8539 20.82790 53.92135       4.237245      50.46794       4.567005      75.27760       11.35716  506.0725 23.23757 601.4827 49.04747 -95.41013      54.27374 
1 1 1 6   24 19 o 310.6619 32.46902 19.51708       3.859405      17.71567       4.210093      28.99876       9.658912  293.7696 37.77799 355.3288 72.45178 -61.55923      81.70947 
1 1 1 6   25 0  o 461.0428 28.09749 41.81190       5.006788      45.77750       6.785016      37.07102       7.418674  480.3891 36.64531 429.5718 45.14489 50.81735       58.14585 
1 1 1 6   25 1  o 801.6635 19.40966 125.3473       6.042798      127.7475       8.181800      122.4668       8.963163  807.8594 26.07865 790.1834 29.20824 17.67596       39.15632 
1 1 1 6   25 2  o 148.3398 59.57163 2.339569       5.241107      -1.900697      5.768047      22.41772       12.55146  128.2619 57.16948 319.0263 94.55614 -190.7644      110.4953 
1 1 1 6   25 3  o 430.9911 37.30506 36.93341       6.182441      36.93341       6.182441      0.000000       0.000000  430.9911 37.30506 ?        ?        0.000000       37.30506 
1 1 1 6   25 4  o 724.4644 19.98661 102.4141       5.623207      111.2177       7.690920      92.30233       8.242537  753.6198 26.27835 685.4293 30.96495 68.19049       40.61256 
1 1 1 6   25 5  o 270.6982 42.17176 14.86875       4.288974      8.187694       5.412087      26.14875       7.032291  200.3802 62.64065 357.5042 52.18896 -157.1240      81.53244 
1 1 1 6   25 6  o 828.1755 19.92396 133.8762       6.408051      131.7488       7.702851      138.6575       11.54779  820.5644 24.17190 838.1245 35.47826 -17.56006      42.93003 
1 1 1 6   25 7  o 104.3618 47.48565 -2.392913      4.221045      -1.385842      4.785918      -5.919631      8.956131  118.0075 52.36675 146.3299 67.53600 -28.32241      85.45986 
1 1 1 6   25 8  o 626.9238 20.48909 76.78033       4.988447      78.55488       6.231619      73.61446       8.323444  633.1176 25.34478 609.2885 35.32810 23.82904       43.47911 
1 1 1 6   25 9  o 306.6198 30.64357 18.69301       3.600080      16.55789       3.764961      41.48075       12.29986  287.4933 34.40479 439.1985 74.79295 -151.7052      82.32664 
1 1 1 6   25 10 o 732.0807 21.86782 104.8758       6.217164      99.06560       6.916599      129.3237       14.18785  710.6551 25.06142 801.3961 45.77694 -90.74097      52.18815 
1 1 1 6   25 11 o 603.3302 18.35674 71.09460       4.301092      73.09719       4.589019      56.62154       12.33683  611.5771 19.32150 519.8279 62.35489 91.74915       65.27980 
1 1 1 6   25 12 o 129.4586 48.83193 2.600460       3.349421      -0.8635868     3.570283      28.02859       9.673151  103.0392 45.50086 358.0026 72.06915 -254.9633      85.23080 
1 1 1 6   25 13 o 284.3604 33.27609 16.25425       3.605273      12.81121       3.823024      43.92169       10.83729  249.7810 40.82160 454.4259 63.11255 -204.6450      75.16380 
1 1 1 6   25 14 o 266.3593 44.26067 14.70105       4.417716      15.26760       4.948172      12.47553       9.807161  269.7537 49.03987 240.1346 84.60355 29.61914       97.78890 
1 1 1 6   25 15 o 660.8345 20.60227 85.67354       5.287323      88.69968       5.934289      74.02091       11.64491  671.6512 22.75081 597.2853 50.68093 74.36591       55.55318 
1 1 1 6   25 16 o 206.2767 41.13377 8.905383       3.179579      9.051275       3.391779      7.847662       9.132649  207.2293 43.52970 205.2631 79.80804 1.966187       90.90741 
1 1 1 6   25 17 o 463.7964 21.30548 42.32056       3.837485      42.30129       4.149659      42.43433       10.08473  463.1703 23.06979 441.9024 60.34094 21.26794       64.60065 
1 1 1 6   25 18 o 329.7670 29.26487 21.83284       3.708905      21.53924       4.007271      23.58711       9.795316  326.4847 32.01713 313.0026 80.21504 13.48209       86.36868 
1 1 1 6   26 0  o 741.2992 31.38340 108.2877       9.034862      0.000000       0.000000      108.2877       9.034862  ?        ?        741.2992 31.38340 0.000000       31.38340 
1 1 1 6   26 1  o 786.5891 33.15600 122.1210       10.12833      122.1210       10.12833      0.000000       0.000000  786.5891 33.15600 ?        ?        0.000000       33.15600 
1 1 1 6   26 2  o 415.0659 30.27218 34.08609       4.846007      32.55494       6.336531      36.24338       7.521352  402.4385 41.12143 422.8883 46.56948 -20.44986      62.12639 
1 1 1 6   26 3  f 398.2166 37.38930 31.70152       5.714514      32.52445       6.334352      28.10322       13.24553  402.2078 41.13177 350.7590 94.92464 51.44885       103.4529 
1 1 1 6   26 4  o 330.1055 38.53624 21.91476       4.847280      23.97346       5.889655      17.59278       8.533669  343.3123 45.27938 283.5457 75.96536 59.76657       88.43618 
1 1 1 6   26 5  o 383.4490 32.81711 29.23744       4.839848      25.60384       5.749959      38.06860       8.964069  355.7863 42.45313 429.6446 54.98537 -73.85831      69.46696 
1 1 1 6   26 6  o 248.7696 47.60566 12.83629       4.431666      16.95929       5.467568      4.939919       7.566608  285.6631 51.16368 184.2924 72.36275 101.3707       88.62330 
1 1 1 6   26 7  o 558.1152 22.62484 61.01109       4.903852      60.64110       6.139105      61.66334       8.151206  554.2818 28.61743 555.5411 38.00973 -1.259277      47.57833 
1 1 1 6   26 8  o 420.5120 27.49971 34.93854       4.466177      33.81895       5.450756      37.22574       7.790739  411.6894 34.40794 426.9586 47.80602 -15.26917      58.90094 
1 1 1 6   26 9  o 425.2816 29.04344 35.83031       4.768133      36.12185       5.190502      34.25451       12.06735  426.2502 31.58039 390.6223 82.15227 35.62790       88.01316 
1 1 1 6   26 10 o 236.9825 40.45554 11.54046       3.589603      11.44005       3.799169      12.37605       10.95946  235.0887 43.20511 244.1846 89.01107 -9.095901      98.94267 
1 1 1 6   26 11 o 401.8510 25.32523 31.90215       3.932050      30.00713       4.193783      45.67824       11.30739  388.9546 27.95017 461.6436 64.85999 -72.68906      70.62598 
1 1 1 6   26 12 f 192.7989 45.35513 7.837227       3.339140      6.700630       3.544328      16.80977       9.958374  178.0294 49.48151 269.7339 85.07139 -91.70448      98.41525 
1 1 1 6   26 13 o 238.6225 36.63945 11.65888       3.286851      10.64006       3.482854      19.95405       9.937997  226.2755 41.15004 291.0004 83.54881 -64.72493      93.13287 
1 1 1 6   26 14 o 216.6150 37.30658 9.688376       3.025102      8.514077       3.193464      19.95258       9.441377  201.2363 42.21016 290.5554 80.76041 -89.31912      91.12596 
1 1 1 6   26 15 o 517.7203 22.79850 52.83152       4.583841      55.19821       5.161838      44.00353       9.969311  528.3354 25.15745 451.7710 58.17390 76.56448       63.38059 
1 1 1 6   26 16 o 492.8984 19.64352 47.73782       3.760147      48.30456       4.038405      44.04528       10.30821  495.4016 20.99059 448.7408 60.70921 46.66077       64.23561 
1 1 1 6   27 0  o 225.3760 65.45072 10.94074       6.067638      6.026732       11.39338      12.88621       7.168816  212.3604 86.89155 242.9505 71.31164 -30.59007      112.4077 
1 1 1 6   27 1  o 379.5462 33.00048 28.74247       4.815804      21.40262       6.298236      39.07430       7.472471  320.3369 52.44239 438.5486 44.49107 -118.2116      68.77252 
1 1 1 6   27 2  o 763.7238 25.08325 114.5894       7.439575      115.5114       9.962571      113.4272       11.18561  763.2723 33.60965 753.1081 38.37217 10.16418       51.01011 
1 1 1 6   27 3  o 451.7231 46.48832 41.60737       8.038937      41.60737       8.038937      0.000000       0.000000  451.7231 46.48832 ?        ?        0.000000       46.48832 
1 1 1 6   27 4  o 420.8031 38.06993 35.59886       6.154045      35.59886       6.154045      0.000000       0.000000  420.8031 38.06993 ?        ?        0.000000       38.06993 
1 1 1 6   27 5  o 252.2243 47.41668 13.26368       4.474074      12.03284       5.667438      15.29948       7.288736  236.0637 61.28200 263.5507 70.02261 -27.48698      93.05186 
1 1 1 6   27 6  o 333.4660 35.46723 22.36696       4.522610      22.90821       5.668603      21.41903       7.501727  334.1952 44.80458 314.9729 63.52045 19.22235       77.73222 
1 1 1 6   27 7  o 234.1436 48.80126 11.54066       4.293653      9.571767       5.244460      15.54308       7.477394  211.0386 60.72316 264.4925 71.21358 -53.45384      93.58780 
1 1 1 6   27 8  o 423.7323 27.83838 35.59838       4.555545      39.85012       5.598193      27.26378       7.838022  446.8009 32.48540 358.0176 58.38599 88.78336       66.81486 
1 1 1 6   27 9  o 255.8155 51.45708 13.88789       4.934987      14.80958       5.475459      9.898450       11.39161  262.8008 55.39554 228.4307 89.04497 34.37012       104.8698 
1 1 1 6   27 10 o 491.5678 22.71166 47.51252       4.335711      47.23671       4.678618      49.18986       11.53781  488.9834 24.71763 477.1527 63.86626 11.83066       68.48255 
1 1 1 6   27 11 o 101.8936 47.25764 -3.284402      4.464857      -3.003962      5.003946      -4.379619      9.888773  110.5542 50.82664 155.1759 71.38171 -44.62176      87.62817 
1 1 1 6   27 12 f 272.6479 33.72537 15.09462       3.494815      13.78351       3.712514      25.30062       10.35803  258.8273 38.07183 325.9655 81.91994 -67.13821      90.33461 
1 1 1 6   27 13 o 343.5294 27.05569 23.54867       3.580315      21.80001       3.832782      35.52556       10.03076  329.3192 30.30894 398.4034 67.22351 -69.08420      73.74030 
1 1 1 6   27 14 o 424.8594 21.62380 35.65186       3.556050      35.59025       3.828993      36.03834       9.590477  423.8995 23.34918 403.1228 63.34904 20.77670       67.51508 
1 1 1 6   27 15 o 222.8918 35.35061 10.25377       2.957854      11.30382       3.158389      2.763646       8.435390  234.0471 35.89371 170.2257 72.54140 63.82146       80.93587 
1 1 1 6   28 0  o 365.8181 51.85014 28.04093       7.160002      24.36391       12.25429      29.94690       8.822642  317.4014 93.25553 371.9216 63.35368 -54.52020      112.7399 
1 1 1 6   28 1  o 167.0648 67.94087 3.439973       6.912187      2.275690       11.09693      4.178094       8.835631  190.6106 82.24709 184.9277 76.19105 5.682892       112.1145 
1 1 1 6   28 2  o 285.6786 48.07779 17.07242       5.144536      21.54646       6.483043      9.464215       8.454156  318.8318 54.30511 215.4615 78.23326 103.3704       95.23386 
1 1 1 6   28 3  o 536.5674 25.28479 56.73877       5.268799      61.29841       6.972491      50.66951       8.044342  554.1635 32.54107 499.1689 41.88401 54.99460       53.03953 
1 1 1 6   28 4  o 299.9649 55.99212 19.24713       6.282770      21.98641       7.245141      10.94165       12.61570  318.6821 60.75890 237.2480 93.34738 81.43413       111.3794 
1 1 1 6   28 5  o 176.1284 61.76304 6.138083       5.222722      6.765958       5.774525      3.315808       12.24276  184.1514 64.91520 200.8474 86.52724 -16.69608      108.1709 
1 1 1 6   28 6  o 120.7891 51.70827 0.3320549      4.321301      0.4563724      5.320436      0.9107403E-01  7.407508  133.2574 57.21938 151.9900 66.37384 -18.73256      87.63301 
1 1 1 6   28 7  o 471.4480 26.73965 44.09262       4.875576      44.46207       6.177257      43.48219       7.940217  470.3663 34.04695 459.3859 45.08790 10.98038       56.49879 
1 1 1 6   28 8  o 189.1615 57.07507 7.712057       4.543014      7.376555       5.816168      8.237079       7.275750  188.5440 65.23032 200.4042 72.60537 -11.86018      97.60397 
1 1 1 6   28 9  o 125.7384 54.12447 0.3363478      4.782227      -2.355265      5.343548      11.16646       10.71865  117.5436 53.46200 228.6591 87.08919 -111.1155      102.1896 
1 1 1 6   28 10 f 204.3775 45.27616 8.903254       3.498980      9.925942       3.736369      1.613604       9.975422  215.7815 45.99284 176.5550 77.06480 39.22644       89.74589 
1 1 1 6   28 11 o 227.6055 40.01280 10.82491       3.407695      10.15538       3.615666      16.14778       10.19470  218.7626 44.08187 257.1052 86.41687 -38.34264      97.01076 
1 1 1 6   28 12 o 351.1857 26.79612 24.63881       3.626990      24.94081       3.888038      22.61370       10.06818  352.6490 28.63698 302.9012 83.08923 49.74786       87.88570 
1 1 1 6   29 0  o 191.9362 59.27192 8.010495       4.862382      3.217983       6.183395      15.77579       7.870898  157.8389 64.23212 260.0946 74.25213 -102.2557      98.17914 
1 1 1 6   29 1  o 466.0047 40.08295 44.41129       7.183412      32.79816       11.68095      51.47438       9.109624  370.3126 83.24739 496.7976 47.80666 -126.4850      95.99794 
1 1 1 6   29 2  o 441.9443 35.81305 39.56699       6.093771      26.29167       10.94973      45.52338       7.334534  328.9313 85.07861 471.6150 40.43687 -142.6837      94.19931 
1 1 1 6   29 3  o 492.4550 26.13445 48.16048       4.980243      49.92786       6.826001      46.14886       7.282384  496.7756 35.61806 475.1324 39.83432 21.64313       53.43612 
1 1 1 6   29 4  o 639.2216 21.91909 80.47394       5.441290      84.69794       7.537235      75.87643       7.863417  651.9202 29.77074 614.3967 33.07784 37.52344       44.50214 
1 1 1 6   29 5  o 406.1847 84.32632 39.69176       12.86664      0.000000       0.000000      39.69176       12.86664  ?        ?        406.1847 84.32632 0.000000       84.32632 
1 1 1 6   29 6  o 348.8284 45.50461 25.47381       6.017626      24.53303       7.047122      28.00666       11.56309  336.3043 55.92119 335.6018 87.73457 0.7024841      104.0410 
1 1 1 6   29 7  o 480.0665 29.45700 46.14352       5.465299      48.02319       7.523032      44.04281       7.953085  483.4611 40.43993 459.8185 45.11819 23.64264       60.58910 
1 1 1 6   29 8  o 256.4420 46.03483 13.98185       4.416145      14.47767       5.447670      13.03149       7.542091  256.0088 56.32296 235.6463 73.99288 20.36250       92.99044 
1 1 1 6   29 9  o 129.2283 53.65024 1.549862       4.427929      1.591845       4.934104      1.376160       10.03629  134.7099 56.33850 174.0052 76.58910 -39.29532      95.07848 
1 1 1 6   29 10 o 382.4845 34.12045 29.74413       5.015014      28.06358       5.690077      35.59283       10.61507  368.1319 40.46831 390.8112 72.61336 -22.67929      83.12872 
1 1 1 6   30 0  o 218.0974 54.88351 10.59613       4.644880      15.73818       6.436880      5.009642       6.709289  261.5964 63.90692 170.9514 67.81567 90.64499       93.18293 
1 1 1 6   30 1  o 220.9215 53.83419 10.81723       4.576440      10.08461       6.416944      11.57557       6.528630  209.7966 68.49400 222.9722 68.65182 -13.17561      96.97680 
1 1 1 6   30 2  o 106.0768 50.86514 -7.102316      6.027366      -7.918619      10.34650      -6.682984      7.415612  144.6761 68.60371 122.4298 58.06203 22.24622       89.87585 
1 1 1 6   30 3  f 223.5330 62.20655 11.40872       5.598031      10.45615       10.92829      11.74759       6.518164  219.4744 86.71278 224.6205 68.49834 -5.146118      110.5040 
1 1 1 6   30 4  o 99.96327 47.07642 -4.259283      4.718606      -2.762440      6.897588      -5.575981      6.469224  131.2711 60.10059 116.1576 54.83034 15.11343       81.35384 
1 1 1 6   30 5  o 170.0632 60.06959 5.986915       4.947015      4.531225       6.906211      7.520970       7.089668  169.0467 68.20808 190.3413 71.19472 -21.29453      98.59528 
1 1 1 6   30 6  o 426.0079 39.51395 37.47793       6.462856      36.69691       7.626356      39.46795       12.17349  415.6787 48.13285 402.5927 80.67192 13.08606       93.94003 
1 1 1 7   0  0  o 2074.786 24.35453 837.4310       19.61761      837.4310       19.61761      837.4310       19.61761  2074.786 24.35453 2074.786 24.35453 0.000000       0.000000 
1 1 1 7   0  1  o 637.3352 17.59335 79.11435       4.347057      79.11435       4.347057      79.11435       4.347057  637.3352 17.59335 637.3352 17.59335 0.000000       0.000000 
1 1 1 7   0  2  o 734.0295 17.40666 104.8796       4.955701      104.8796       4.955701      104.8796       4.955701  734.0295 17.40666 734.0295 17.40666 0.000000       0.000000 
1 1 1 7   0  3  o 435.8598 23.09185 37.25028       3.883652      37.25028       3.883652      37.25028       3.883652  435.8598 23.09185 435.8598 23.09185 0.000000       0.000000 
1 1 1 7   0  4  f 1390.769 20.17936 376.2555       10.89393      376.2555       10.89393      376.2555       10.89393  1390.769 20.17936 1390.769 20.17936 0.000000       0.000000 
1 1 1 7   0  5  o 272.0034 38.83376 15.27853       3.860018      15.27853       3.860018      15.27853       3.860018  272.0034 38.83376 272.0034 38.83376 0.000000       0.000000 
1 1 1 7   0  6  o 1040.854 19.62238 210.8636       7.925402      210.8636       7.925402      210.8636       7.925402  1040.854 19.62238 1040.854 19.62238 0.000000       0.000000 
1 1 1 7   0  7  o 1203.717 20.13116 282.0177       9.404750      282.0177       9.404750      282.0177       9.404750  1203.717 20.13116 1203.717 20.13116 0.000000       0.000000 
1 1 1 7   0  8  o 634.2828 21.03542 78.52928       5.168665      78.52928       5.168665      78.52928       5.168665  634.2828 21.03542 634.2828 21.03542 0.000000       0.000000 
1 1 1 7   0  9  o 240.7029 41.91857 12.30791       3.562508      12.30791       3.562508      12.30791       3.562508  240.7029 41.91857 240.7029 41.91857 0.000000       0.000000 
1 1 1 7   0  10 o 73.05502 47.81061 -0.4075157     3.360255      -0.4075157     3.360255      -0.4075157     3.360255  73.05502 47.81061 73.05502 47.81061 0.000000       0.000000 
1 1 1 7   0  11 o 302.3756 35.15139 18.59583       3.982239      18.59583       3.982239      18.59583       3.982239  302.3756 35.15139 302.3756 35.15139 0.000000       0.000000 
1 1 1 7   0  12 o 235.4205 49.84352 12.24048       4.008284      12.24048       4.008284      12.24048       4.008284  235.4205 49.84352 235.4205 49.84352 0.000000       0.000000 
1 1 1 7   0  13 o 506.7621 35.70440 51.01271       6.946617      51.01271       6.946617      51.01271       6.946617  506.7621 35.70440 506.7621 35.70440 0.000000       0.000000 
1 1 1 7   0  14 o 505.4887 26.13806 50.21513       5.099807      50.21513       5.099807      50.21513       5.099807  505.4887 26.13806 505.4887 26.13806 0.000000       0.000000 
1 1 1 7   0  15 o 126.2060 65.41431 4.621382       4.143840      4.621382       4.143840      4.621382       4.143840  126.2060 65.41431 126.2060 65.41431 0.000000       0.000000 
1 1 1 7   0  16 o 594.9724 24.70635 69.28710       5.686272      69.28710       5.686272      69.28710       5.686272  594.9724 24.70635 594.9724 24.70635 0.000000       0.000000 
1 1 1 7   0  17 o 473.9456 30.22296 44.31169       5.510934      44.31169       5.510934      44.31169       5.510934  473.9456 30.22296 473.9456 30.22296 0.000000       0.000000 
1 1 1 7   0  18 o 588.6191 37.20227 68.43027       8.426292      68.43027       8.426292      68.43027       8.426292  588.6191 37.20227 588.6191 37.20227 0.000000       0.000000 
1 1 1 7   0  19 o 338.3643 44.40854 23.50272       5.556896      23.50272       5.556896      23.50272       5.556896  338.3643 44.40854 338.3643 44.40854 0.000000       0.000000 
1 1 1 7   0  20 o 1052.509 33.00202 216.6770       13.45942      216.6770       13.45942      216.6770       13.45942  1052.509 33.00202 1052.509 33.00202 0.000000       0.000000 
1 1 1 7   0  21 o 720.2697 26.57937 101.4819       7.411802      101.4819       7.411802      101.4819       7.411802  720.2697 26.57937 720.2697 26.57937 0.000000       0.000000 
1 1 1 7   0  22 o 1011.375 24.32101 199.6038       9.540126      199.6038       9.540126      199.6038       9.540126  1011.375 24.32101 1011.375 24.32101 0.000000       0.000000 
1 1 1 7   0  23 o 877.8099 26.33631 150.6523       8.959786      150.6523       8.959786      150.6523       8.959786  877.8099 26.33631 877.8099 26.33631 0.000000       0.000000 
1 1 1 7   0  24 o 896.9261 26.68588 157.3777       9.276737      157.3777       9.276737      157.3777       9.276737  896.9261 26.68588 896.9261 26.68588 0.000000       0.000000 
1 1 1 7   0  25 o 205.2870 96.42414 12.75923       8.633096      12.75923       8.633096      12.75923       8.633096  205.2870 96.42414 205.2870 96.42414 0.000000       0.000000 
1 1 1 7   0  26 o 588.0251 35.48980 68.73592       8.036910      68.73592       8.036910      68.73592       8.036910  588.0251 35.48980 588.0251 35.48980 0.000000       0.000000 
1 1 1 7   0  27 o 179.9497 86.01122 10.03658       6.899961      10.03658       6.899961      10.03658       6.899961  179.9497 86.01122 179.9497 86.01122 0.000000       0.000000 
1 1 1 7   0  28 o 332.5763 60.98426 24.59568       7.094476      24.59568       7.094476      24.59568       7.094476  332.5763 60.98426 332.5763 60.98426 0.000000       0.000000 
1 1 1 7   0  29 o 155.1017 83.59613 7.933815       6.987842      7.933815       6.987842      7.933815       6.987842  155.1017 83.59613 155.1017 83.59613 0.000000       0.000000 
1 1 1 7   0  30 o 430.7997 47.98568 39.43547       7.773282      39.43547       7.773282      39.43547       7.773282  430.7997 47.98568 430.7997 47.98568 0.000000       0.000000 
1 1 1 7   0  31 o 104.5619 72.66525 -4.847150      10.41058      -4.847150      10.41058      -4.847150      10.41058  104.5619 72.66525 104.5619 72.66525 0.000000       0.000000 
1 1 1 7   1  0  o 602.3258 12.70896 70.50646       2.972825      67.18006       4.067910      74.31929       4.355198  587.7052 17.82312 618.1260 18.14274 -30.42084      25.43271 
1 1 1 7   1  1  o 409.4859 14.71761 32.59629       2.340476      33.76244       3.328189      31.45540       3.291972  416.5211 20.57515 401.4560 21.19002 15.06512       29.53563 
1 1 1 7   1  2  o 951.0671 12.42597 175.7821       4.589544      176.2935       6.512516      175.2775       6.468895  952.0580 17.61398 949.3167 17.54652 2.741333       24.86227 
1 1 1 7   1  3  o 378.4309 17.22911 27.85278       2.532081      31.41658       3.742635      24.84469       3.438475  400.8816 24.15271 356.2284 25.01332 44.65323       34.77096 
1 1 1 7   1  4  o 958.7094 13.35757 178.6513       4.973274      196.1686       10.83897      173.9800       5.597239  1002.940 27.82819 945.9501 15.23624 56.99005       31.72619 
1 1 1 7   1  5  o 638.0508 14.92428 79.15508       3.698083      80.37370       5.282916      77.98419       5.178409  642.5169 21.17196 632.9020 21.06842 9.614929       29.86855 
1 1 1 7   1  6  o 498.9870 16.40558 48.43044       3.179134      52.14663       4.598227      45.02736       4.400253  517.3599 22.88598 480.7000 23.57086 36.65988       32.85352 
1 1 1 7   1  7  o 1001.163 13.80533 194.8872       5.367592      212.5919       7.981481      180.2686       7.252603  1044.938 19.66822 962.2598 19.40768 82.67780       27.63145 
1 1 1 7   1  8  o 1089.480 13.93439 230.8338       5.895697      239.0025       8.546173      223.4160       8.143912  1107.717 19.86620 1071.036 19.57948 36.68115       27.89305 
1 1 1 7   1  9  o 1241.923 14.25567 300.0396       6.875593      313.9337       10.08267      287.9626       9.400269  1269.129 20.45700 1215.620 19.91199 53.50952       28.54778 
1 1 1 7   1  10 o 682.8519 14.60098 90.73602       3.872011      85.42421       5.434750      96.21159       5.517898  661.7877 21.14622 702.4647 20.22652 -40.67706      29.26217 
1 1 1 7   1  11 o 489.3517 19.72031 46.69200       3.747684      46.23542       4.706259      47.48333       6.195779  485.7065 25.03535 490.6556 32.70290 -4.949097      41.18554 
1 1 1 7   1  12 o 179.6528 43.85860 6.645611       3.033286      5.641060       3.728126      8.612933       5.217261  167.9495 51.90619 204.8644 61.01820 -36.91492      80.10914 
1 1 1 7   1  13 o 715.3777 15.04208 99.59945       4.178988      101.1402       5.985266      98.13387       5.837469  720.0516 21.40385 709.3015 21.19169 10.75012       30.11997 
1 1 1 7   1  14 o 939.2397 16.91246 171.7368       6.168951      190.4789       11.39985      163.9757       7.335863  986.5232 29.75527 917.2051 20.59476 69.31812       36.18730 
1 1 1 7   1  15 o 701.7222 16.02202 95.80409       4.366270      93.58392       6.176436      98.02197       6.173240  692.8262 22.95544 709.1302 22.41606 -16.30408      32.08476 
1 1 1 7   1  16 o 234.6493 35.98414 11.02502       3.174500      13.68734       4.603006      8.610172       4.383849  259.7069 47.38437 204.9667 54.23247 54.74016       72.01694 
1 1 1 7   1  17 o 1003.663 17.40395 195.9402       6.783659      195.8212       11.66135      196.0010       8.340004  1001.662 29.97779 1003.376 21.40299 -1.714111      36.83417 
1 1 1 7   1  18 o 175.8370 58.92558 5.759708       4.739935      3.837626       6.840435      7.535007       6.574058  176.3284 68.92745 202.5876 69.38857 -26.25919      97.80474 
1 1 1 7   1  19 o 411.9689 28.57866 33.24072       4.544021      32.39739       5.636545      34.80628       7.679835  405.6252 36.16084 418.4111 48.14038 -12.78589      60.20882 
1 1 1 7   1  20 o 629.2283 19.24212 77.02151       4.702071      82.50219       6.634351      71.48969       6.665223  650.7169 26.25297 605.5619 28.34185 45.15497       38.63261 
1 1 1 7   1  21 o 301.7463 41.66279 18.17954       4.752000      19.45139       5.727112      15.36888       8.513785  310.7679 49.08360 272.9565 76.98296 37.81134       91.29936 
1 1 1 7   1  22 o 456.8026 26.12884 40.82361       4.616044      46.99343       6.544487      34.71531       6.511779  488.9016 34.69409 418.7718 40.54781 70.12982       53.36482 
1 1 1 7   1  23 o 320.8310 41.62959 20.54486       5.064623      15.18692       6.210672      31.18043       8.750243  271.2426 60.49868 392.0348 59.32836 -120.7922      84.73455 
1 1 1 7   1  24 o 656.0947 41.68564 84.96766       10.56626      0.000000       0.000000      84.96766       10.56626  ?        ?        656.0947 41.68564 0.000000       41.68564 
1 1 1 7   1  25 o 565.8337 24.77738 62.49028       5.444677      65.25719       7.556311      59.50253       7.852075  575.9609 33.93218 549.2026 37.03112 26.75830       50.22645 
1 1 1 7   1  26 o 659.1750 25.87740 84.95539       6.624442      89.14474       10.92180      82.51725       8.332027  670.1828 42.17881 647.3801 33.25307 22.80273       53.71051 
1 1 1 7   1  27 o 214.8686 57.63631 9.661635       4.908871      0.6952931      6.833391      19.22266       7.056360  153.8958 65.42950 302.4140 62.16032 -148.5182      90.24923 
1 1 1 7   1  28 o 292.6900 45.43135 17.51866       4.996646      16.22249       6.957546      18.89917       7.180369  274.9704 65.99377 297.8238 63.98821 -22.85336      91.92208 
1 1 1 7   1  29 o 213.9309 58.08776 9.759862       4.950298      1.025741       6.904500      18.99872       7.101200  154.4358 65.71661 297.0838 63.47615 -142.6480      91.36681 
1 1 1 7   1  30 o 355.5516 46.36705 26.10251       6.249968      26.96145       7.504743      24.15851       11.29029  356.8018 56.00441 319.6667 88.11134 37.13504       104.4035 
1 1 1 7   1  31 o 348.6068 46.55198 25.30471       6.144886      25.06237       7.486746      25.80498       10.75670  340.4519 58.74798 329.2525 83.88656 11.19943       102.4123 
1 1 1 7   2  0  f 662.6710 12.44267 85.34009       3.202133      85.59690       4.507894      85.07853       4.549392  663.3995 17.49728 661.3743 17.71243 2.025146       24.89749 
1 1 1 7   2  1  o 753.9197 12.28930 110.4581       3.598159      108.4088       4.993481      112.6713       5.189296  746.6040 17.22206 761.1168 17.55614 -14.51276      24.59304 
1 1 1 7   2  2  o 761.8495 12.71709 112.8017       3.762572      116.0906       4.494486      105.0972       6.878946  772.7459 14.97667 734.5403 24.11450 38.20557       28.38679 
1 1 1 7   2  3  o 893.6995 14.16216 155.2607       4.915287      151.4460       5.975945      163.2388       8.642299  882.4005 17.43865 915.3889 24.31060 -32.98840      29.91842 
1 1 1 7   2  4  o 467.2155 20.72722 42.49112       3.760852      33.67760       6.211938      47.59084       4.725259  412.8356 39.21645 494.2097 24.61991 -81.37408      46.30410 
1 1 1 7   2  5  o 1172.055 12.27330 266.9862       5.586467      271.9659       9.187909      264.0655       7.036572  1182.044 20.01498 1165.306 15.54866 16.73767       25.34483 
1 1 1 7   2  6  o 523.0264 15.98488 53.20660       3.246840      55.83298       4.692773      50.79485       4.496935  535.3390 22.57214 510.6068 22.67786 24.73224       31.99667 
1 1 1 7   2  7  o 1132.536 13.92343 249.4057       6.123875      248.7226       8.655602      250.0902       8.665340  1130.194 19.72042 1133.302 19.68847 -3.107910      27.86631 
1 1 1 7   2  8  o 725.4572 14.25239 102.3615       4.015389      100.7445       5.686308      103.9698       5.670958  719.0889 20.36197 730.5533 19.98833 -11.46448      28.53320 
1 1 1 7   2  9  o 1186.573 14.05297 273.8892       6.475755      274.6129       9.186314      273.1743       9.130145  1187.052 19.92707 1183.954 19.85705 3.098267       28.13167 
1 1 1 7   2  10 o 729.6984 16.41080 103.6753       4.650517      100.9668       5.791411      108.5925       7.803199  719.5176 20.72598 745.0699 26.96793 -25.55225      34.01228 
1 1 1 7   2  11 o 452.0446 20.40041 39.85670       3.581361      39.47445       4.537205      40.48850       5.833151  448.4812 26.16410 452.7315 33.41292 -4.250305      42.43799 
1 1 1 7   2  12 o 702.1577 14.79763 95.95821       4.035104      95.33208       5.678144      96.59698       5.735285  699.0496 20.91560 703.6606 20.98764 -4.611023      29.63011 
1 1 1 7   2  13 f 518.0211 17.17468 52.26019       3.455129      56.69933       4.963946      48.08835       4.812168  538.8560 23.72064 495.4663 25.09095 43.38965       34.52860 
1 1 1 7   2  14 o 965.9942 14.58639 181.5356       5.472053      188.5374       7.940586      175.2033       7.551379  983.4971 20.78986 948.1296 20.50834 35.36749       29.20292 
1 1 1 7   2  15 o 288.7661 40.48294 16.69888       4.415137      0.000000       0.000000      16.69888       4.415137  ?        ?        288.7661 40.48294 0.000000       40.48294 
1 1 1 7   2  16 o 926.1801 17.59018 166.9008       6.326939      169.9919       11.33095      165.5005       7.626606  932.7021 31.28207 921.8563 21.30297 10.84583       37.84686 
1 1 1 7   2  17 o 528.2012 22.80650 54.33339       4.678278      45.71918       8.174647      58.52874       5.704866  480.6145 44.29548 547.9091 26.81075 -67.29456      51.77746 
1 1 1 7   2  18 o 862.6741 15.95872 144.6910       5.346539      138.3300       7.407784      151.6074       7.724449  842.9594 22.62839 882.4965 22.53858 -39.53711      31.93793 
1 1 1 7   2  19 o 882.9240 18.82242 151.6272       6.453969      149.8622       7.832942      155.3587       11.38950  877.4070 22.98772 892.1830 32.87173 -14.77594      40.11217 
1 1 1 7   2  20 o 511.9243 25.46262 51.05255       5.062171      52.48788       6.187845      48.14811       8.802241  517.7640 30.91482 493.1742 46.50760 24.58978       55.84516 
1 1 1 7   2  21 o 1029.302 16.72575 206.0512       6.685846      212.6015       9.578692      199.8281       9.336391  1044.711 23.60925 1012.823 23.73654 31.88727       33.47865 
1 1 1 7   2  22 o 1198.766 19.36942 279.7024       9.017356      279.5789       10.93322      279.9650       15.94659  1197.832 23.50303 1196.303 34.32406 1.529419       41.59969 
1 1 1 7   2  23 o 149.7258 58.88112 2.649692       5.017105      9.347986       5.932647      -14.16884      9.400705  215.3712 65.27645 129.3050 62.39056 86.06615       90.29727 
1 1 1 7   2  24 o 938.2821 18.32025 171.3687       6.675639      166.5355       9.184853      176.7807       9.719364  923.8776 25.59940 951.7465 26.29593 -27.86890      36.69884 
1 1 1 7   2  25 o 588.7481 24.03066 67.63757       5.494437      71.77737       7.688461      63.31667       7.854824  604.3394 32.88273 566.8370 35.86702 37.50238       48.65919 
1 1 1 7   2  26 o 335.9866 38.31856 22.53069       4.910436      28.44398       6.787820      16.03844       7.112353  375.5294 47.61288 275.7296 67.06455 99.79984       82.24744 
1 1 1 7   2  27 o 147.6047 63.71130 -0.1236409     6.663198      -0.1236409     6.663198      0.000000       0.000000  147.6047 63.71130 ?        ?        0.000000       63.71130 
1 1 1 7   2  28 o 244.4948 57.51001 12.64790       5.369172      16.69718       8.582845      10.04442       6.882071  276.2816 77.07503 219.9450 70.86577 56.33665       104.7020 
1 1 1 7   2  29 o 407.6609 34.28269 33.19598       5.377136      36.05930       7.456951      30.09441       7.760996  420.2769 46.46476 380.2545 54.07887 40.02231       71.29865 
1 1 1 7   2  30 o 721.5130 26.75950 102.7402       7.498082      106.2105       9.147307      95.63306       13.09051  730.9517 32.22379 681.2001 49.82850 49.75153       59.34013 
1 1 1 7   2  31 o 267.9950 50.79165 15.30072       5.092758      14.09858       7.096433      16.57734       7.312941  249.1850 70.28522 270.4222 69.31313 -21.23723      98.71333 
1 1 1 7   3  0  o 1368.389 13.83080 363.9773       7.349957      362.9119       10.35099      365.0608       10.43837  1365.672 19.51676 1369.693 19.62373 -4.021484      27.67661 
1 1 1 7   3  1  o 870.4804 12.42123 147.2603       4.199054      149.9927       5.994125      144.6272       5.884121  878.1450 17.57647 862.2961 17.57103 15.84888       24.85303 
1 1 1 7   3  2  o 962.6859 12.82218 180.1209       4.793738      182.1118       5.704822      175.3376       8.842443  967.8143 15.17826 948.7332 23.99939 19.08118       28.39631 
1 1 1 7   3  3  o 858.7097 13.01013 143.3210       4.338664      146.2729       6.179529      140.4512       6.092982  867.0939 18.35106 849.6533 18.46546 17.44061       26.03334 
1 1 1 7   3  4  o 514.1403 15.31326 51.40005       3.057575      43.63584       6.597219      53.52402       3.450538  470.8383 36.36128 524.5744 16.93760 -53.73611      40.11266 
1 1 1 7   3  5  o 742.5065 13.80681 107.1813       3.981268      108.4291       8.626804      106.8436       4.487754  745.1846 29.80973 741.2139 15.59041 3.970703       33.64047 
1 1 1 7   3  6  o 619.0986 15.08490 74.53916       3.626855      76.59480       5.285118      72.70946       4.986217  627.0629 21.70279 611.0123 21.01325 16.05060       30.20874 
1 1 1 7   3  7  o 1335.969 14.42731 347.1118       7.485311      347.2953       10.64647      346.9325       10.52621  1335.255 20.53115 1334.602 20.30918 0.6523438      28.87890 
1 1 1 7   3  8  o 914.4301 15.67661 162.7074       5.567122      161.0198       6.937074      165.7607       9.330965  909.1335 19.64811 921.2703 26.08024 -12.13672      32.65313 
1 1 1 7   3  9  o 427.1947 20.20015 35.57409       3.351263      37.43139       4.329597      32.79821       5.293066  436.9532 25.62646 407.4280 33.75655 29.52518       42.38184 
1 1 1 7   3  10 o 638.5786 16.88086 79.41740       4.186364      83.54612       5.380795      73.08534       6.663636  654.4119 21.17227 610.9941 28.08318 43.41772       35.17001 
1 1 1 7   3  11 o 197.2759 36.10993 7.894941       2.664538      6.832019       3.919627      8.808149       3.633114  182.6338 52.48029 206.6573 46.40477 -24.02350      70.05415 
1 1 1 7   3  12 o 362.7385 20.59047 25.74625       2.888645      24.62598       4.090067      26.86115       4.080273  353.1792 30.10746 369.2383 28.67976 -16.05911      41.58110 
1 1 1 7   3  13 o 706.3699 15.07124 97.10216       4.134367      98.36626       5.855049      95.84509       5.838743  710.1765 21.22933 700.9844 21.44781 9.192078       30.17769 
1 1 1 7   3  14 o 602.3761 18.73160 70.67090       4.381982      77.91676       7.483318      66.88992       5.405689  630.9332 30.54097 585.5036 23.77352 45.42963       38.70312 
1 1 1 7   3  15 o 398.1204 30.69076 31.17057       4.708546      0.000000       0.000000      31.17057       4.708546  ?        ?        398.1204 30.69076 0.000000       30.69076 
1 1 1 7   3  16 o 1144.645 31.09529 255.9651       13.82271      255.9651       13.82271      0.000000       0.000000  1144.645 31.09529 ?        ?        0.000000       31.09529 
1 1 1 7   3  17 o 215.9012 41.51876 9.438753       3.354764      8.968194       4.830138      9.877307       4.662982  209.6923 57.56268 219.4810 54.85765 -9.788696      79.51619 
1 1 1 7   3  18 o 530.7646 19.86581 54.80808       4.094834      48.52620       5.666958      61.67158       5.923497  497.9863 29.43325 562.5478 27.11382 -64.56146      40.01844 
1 1 1 7   3  19 o 243.5851 39.92779 11.90566       3.646153      4.188266       4.973621      20.87212       5.361023  162.7643 59.86711 323.5173 43.79574 -160.7530      74.17640 
1 1 1 7   3  20 o 696.3760 21.07090 94.37689       5.698425      106.8124       7.115092      72.13163       9.516281  740.5196 24.74093 605.6064 40.69851 134.9132       47.62859 
1 1 1 7   3  21 o 669.0004 22.22599 87.15484       5.774515      91.12079       7.034791      78.96290       10.11047  683.6417 26.49688 633.2582 41.33819 50.38342       49.10123 
1 1 1 7   3  22 o 1208.571 16.92460 284.1431       7.943619      279.3259       10.92742      289.5416       11.56786  1197.266 23.50168 1218.788 24.43975 -21.52209      33.90620 
1 1 1 7   3  23 o 364.7113 32.84251 26.22338       4.601824      24.60272       6.295493      28.08292       6.743505  350.2332 47.51189 374.6103 47.41453 -24.37708      67.12315 
1 1 1 7   3  24 o 264.7416 53.48917 14.37331       5.310151      16.11621       6.382089      10.45211       9.572733  279.1892 60.60115 237.6864 83.60265 41.50288       103.2565 
1 1 1 7   3  25 o 251.7629 49.50805 12.98379       4.668050      20.59871       6.470319      4.717802       6.741253  317.4950 54.43523 180.1507 68.95819 137.3443       87.85458 
1 1 1 7   3  26 o 288.0659 45.23006 16.83446       4.893267      15.86901       6.652991      17.97221       7.222257  274.8355 63.59400 292.3273 65.26849 -17.49173      91.12724 
1 1 1 7   3  27 o 867.5529 19.69832 146.8857       6.636715      146.5042       9.165251      147.3064       9.622931  864.4258 27.30163 866.3836 28.60021 -1.957825      39.53923 
1 1 1 7   3  28 o 976.6302 19.39296 186.2998       7.355332      181.1508       10.06389      192.2040       10.77668  960.4078 26.98249 988.8184 28.06340 -28.41052      38.93083 
1 1 1 7   3  29 o 254.8456 68.12156 14.20764       6.871629      4.864401       8.576065      30.96372       11.48486  189.2605 76.13310 370.5793 81.97551 -181.3188      111.8760 
1 1 1 7   3  30 o 581.8309 26.97384 66.84731       6.094915      68.67146       8.473558      64.89183       8.773275  584.0900 37.55488 566.3010 40.15237 17.78894       54.97802 
1 1 1 7   3  31 o 144.7122 57.78898 2.793672       4.901845      -0.7104674     6.779735      6.631882       7.095556  141.5810 62.60158 188.0479 71.03996 -46.46692      94.68703 
1 1 1 7   4  0  o 915.8820 12.64939 163.0337       4.499218      161.0287       6.287931      165.1371       6.440522  909.8227 17.79602 921.3366 18.00009 -11.51392      25.31209 
1 1 1 7   4  1  o 603.9229 13.56602 70.89593       3.181720      71.15620       3.776073      70.25878       5.908054  604.9011 16.07415 600.4122 25.33769 4.488892       30.00628 
1 1 1 7   4  2  f 434.8599 14.91601 36.76719       2.519010      39.08050       3.042534      31.72567       4.491584  448.2229 17.47887 402.2002 28.94968 46.02274       33.81708 
1 1 1 7   4  3  o 316.4088 18.83215 19.54981       2.303608      19.69947       3.216984      19.39231       3.300198  316.7716 26.39030 314.1486 27.32270 2.623047       37.98655 
1 1 1 7   4  4  o 212.4277 25.51838 8.923065       2.063067      7.102086       2.878171      10.84741       2.958733  186.7164 40.82988 233.1817 33.64610 -46.46530      52.90688 
1 1 1 7   4  5  o 591.7190 14.36331 68.08053       3.300640      73.95281       7.636179      66.73135       3.660220  614.2103 32.12497 585.7245 16.09110 28.48572       35.92961 
1 1 1 7   4  6  o 985.8917 15.23983 189.0526       5.834952      0.000000       0.000000      189.0526       5.834952  ?        ?        985.8917 15.23983 0.000000       15.23983 
1 1 1 7   4  7  o 467.7428 18.80494 42.60287       3.415915      37.96470       4.337382      50.17805       5.543084  440.3049 25.47450 505.9455 28.32487 -65.64066      38.09526 
1 1 1 7   4  8  o 158.1260 43.09108 5.096478       2.718391      8.118979       3.621745      1.196756       4.113878  198.5830 47.58490 127.2840 52.16199 71.29903       70.60592 
1 1 1 7   4  9  o 506.4046 16.33527 49.92850       3.212565      53.21273       4.669621      46.97719       4.426619  522.1102 23.02987 490.5432 23.23630 31.56696       32.71544 
1 1 1 7   4  10 o 139.9651 41.66551 3.927342       2.433126      3.131261       3.576586      4.613164       3.319678  138.5831 50.79855 153.6042 49.18954 -15.02112      70.71141 
1 1 1 7   4  11 o 623.1158 15.06456 75.58023       3.645466      83.19740       5.311658      68.79748       5.012291  653.0106 20.94508 593.7065 21.73885 59.30408       30.18731 
1 1 1 7   4  12 o 603.4091 15.51481 70.87840       3.635685      71.96687       5.201291      69.83846       5.083985  607.2466 22.05556 598.2231 21.88331 9.023499       31.06972 
1 1 1 7   4  13 o 846.7650 16.33447 139.5815       5.371504      151.7518       9.441216      133.7565       6.531676  880.8372 27.59970 828.3353 20.30442 52.50189       34.26387 
1 1 1 7   4  14 o 642.7697 22.46757 80.56217       5.608405      0.000000       0.000000      80.56217       5.608405  ?        ?        642.7697 22.46757 0.000000       22.46757 
1 1 1 7   4  15 o 911.8078 14.92137 161.6927       5.283721      161.6886       7.441879      161.6969       7.503117  911.0873 21.03268 911.0870 21.20576 0.2441406E-03  29.86734 
1 1 1 7   4  16 o 679.1561 16.54454 89.71497       4.363675      86.49693       6.128195      93.02488       6.215059  666.2795 23.68362 691.0162 23.15949 -24.73676      33.12516 
1 1 1 7   4  17 o 1231.641 17.97897 295.0661       8.599572      279.1514       14.58967      303.5390       10.64540  1195.840 31.41553 1248.668 21.95265 -52.82800      38.32564 
1 1 1 7   4  18 o 270.6714 34.47878 14.53545       3.541989      11.11871       4.926501      18.19144       5.096058  232.9804 55.28114 301.4052 44.90791 -68.42477      71.22307 
1 1 1 7   4  19 o 239.8539 45.57947 11.64809       4.090433      10.55148       4.968068      13.95601       7.207287  226.9688 56.56549 260.5558 69.81532 -33.58702      89.85452 
1 1 1 7   4  20 o 1344.239 16.22412 351.3553       8.469653      345.4681       11.74513      357.7334       12.22508  1332.055 22.70428 1355.410 23.22486 -23.35571      32.47889 
1 1 1 7   4  21 o 755.9514 21.06895 111.2570       6.185358      108.1474       7.389291      118.5366       11.30582  744.8530 25.54490 778.0942 37.41466 -33.24121      45.30341 
1 1 1 7   4  22 o 1298.788 19.48160 328.3547       9.826323      333.9199       11.99772      317.0154       17.12586  1308.996 23.60110 1272.787 34.64725 36.20984       41.92188 
1 1 1 7   4  23 o 830.3989 18.74280 134.2205       6.044345      135.8114       8.314695      132.4376       8.802103  834.4279 25.65840 823.7202 27.51558 10.70770       37.62261 
1 1 1 7   4  24 o 1259.370 17.39913 308.6759       8.509599      316.8280       11.94472      300.2742       12.12611  1274.542 24.13202 1240.559 25.16959 33.98315       34.86923 
1 1 1 7   4  25 f 1007.157 18.53127 197.5754       7.248205      206.2330       10.02264      188.0832       10.49466  1027.664 25.11328 980.8387 27.55134 46.82495       37.27939 
1 1 1 7   4  26 o 152.6171 60.72424 2.678577       5.394376      -1.022018      6.338335      12.40163       10.27403  139.7710 61.20783 250.3568 86.69187 -110.5858      106.1220 
1 1 1 7   4  27 o 517.1605 27.20047 52.58834       5.443784      45.65844       7.321206      61.15767       8.141272  478.3276 39.77272 554.6412 38.02614 -76.31366      55.02596 
1 1 1 7   4  28 o 662.2728 27.15198 86.17865       6.983390      84.60751       8.192471      90.35443       13.35602  654.6403 32.22435 665.9974 52.05262 -11.35718      61.21997 
1 1 1 7   4  29 o 231.5371 57.75562 11.49870       5.176018      15.20157       6.895789      6.720258       7.833543  263.4783 67.18513 196.0676 74.50506 67.41068       100.3237 
1 1 1 7   4  30 o 129.6231 55.91400 0.1759667      5.125424      1.339416       7.017843      -1.154041      7.503381  155.3833 66.18997 147.4312 65.48963 7.952026       93.11285 
1 1 1 7   4  31 o 198.6068 64.19080 8.529079       5.643324      3.023355       8.756595      12.44026       7.380433  176.2423 74.45453 234.0801 73.14591 -57.83780      104.3734 
1 1 1 7   5  0  o 971.8209 12.84030 183.5728       4.846067      184.7467       6.838635      182.3888       6.868209  974.4416 18.07114 968.1822 18.26663 6.259399       25.69506 
1 1 1 7   5  1  o 825.2089 14.18394 132.3916       4.545574      134.5435       5.638018      128.3951       7.683605  831.6248 17.45706 811.6832 24.37533 19.94165       29.98175 
1 1 1 7   5  2  o 786.3735 13.40172 120.2099       4.092770      117.4012       5.667488      123.2711       5.916650  776.7144 18.78890 795.8617 19.14301 -19.14734      26.82308 
1 1 1 7   5  3  o 1289.496 13.99436 323.2834       7.008109      327.7178       10.00484      319.0117       9.819676  1297.484 19.85547 1280.151 19.75186 17.33362       28.00671 
1 1 1 7   5  4  o 894.8569 14.49065 155.7100       5.035812      161.3025       6.539152      147.5598       7.894099  910.3822 18.49565 870.1448 23.36055 40.23743       29.79605 
1 1 1 7   5  5  o 1121.758 15.41311 244.7561       6.714560      263.1297       13.62829      238.8662       7.716081  1160.300 30.24427 1107.846 17.93450 52.45361       35.16194 
1 1 1 7   5  6  o 410.0803 18.72061 32.74342       2.981376      34.04479       6.827759      32.43684       3.314007  413.5798 43.14515 407.4749 21.01386 6.104980       47.99048 
1 1 1 7   5  7  o 697.1213 16.06342 94.57901       4.348849      98.93982       5.714069      88.57572       6.704347  712.4875 20.65096 673.4613 25.63397 39.02625       32.91751 
1 1 1 7   5  8  o 513.2923 16.04930 51.28642       3.199256      50.40701       4.682950      52.05606       4.380991  508.1280 23.73113 516.5861 21.83744 -8.458069      32.24966 
1 1 1 7   5  9  o 572.7870 15.07633 63.85815       3.353643      67.36834       4.900013      60.76499       4.599748  587.6023 21.47266 558.0928 21.22265 29.50952       30.19066 
1 1 1 7   5  10 o 781.3371 14.05568 118.7990       4.264992      120.8397       6.161059      116.9212       5.909991  787.1234 20.15508 774.3403 19.65291 12.78302       28.15074 
1 1 1 7   5  11 o 400.2537 18.78395 31.22687       2.919781      31.62214       4.210814      30.86083       4.052144  401.0417 27.19716 396.2910 26.48197 4.750671       37.96025 
1 1 1 7   5  12 o 635.5135 21.26234 78.78551       5.247638      0.000000       0.000000      78.78551       5.247638  ?        ?        635.5135 21.26234 0.000000       21.26234 
1 1 1 7   5  13 o 534.3329 18.85735 55.62072       3.913095      59.58199       6.552606      53.42497       4.878526  550.7109 30.76108 523.1512 24.01228 27.55975       39.02350 
1 1 1 7   5  14 o 596.8154 16.54695 69.31396       3.835182      71.84737       5.461345      66.84909       5.386952  606.9927 23.16798 585.4414 23.69364 21.55127       33.13825 
1 1 1 7   5  15 o 680.0597 16.00020 89.95924       4.225717      85.16530       5.853054      95.17849       6.107176  661.1013 22.79746 698.9173 22.50021 -37.81604      32.03099 
1 1 1 7   5  16 o 743.1368 15.95146 107.3963       4.603598      109.4535       6.516011      105.3461       6.504943  749.6747 22.38108 735.4352 22.77567 14.23950       31.93186 
1 1 1 7   5  17 o 123.1473 53.34521 -0.5942016     4.705049      0.000000       0.000000      -0.5942016     4.705049  ?        ?        123.1473 53.34521 0.000000       53.34521 
1 1 1 7   5  18 o 499.6696 30.84871 48.88591       5.956877      35.64920       8.393044      62.32161       8.455899  422.6208 52.25068 563.1597 38.90191 -140.5389      65.14209 
1 1 1 7   5  19 o 498.2523 21.30216 48.31232       4.121933      51.15148       5.697283      45.19389       5.970925  511.4137 28.80310 480.1579 32.20717 31.25577       43.20787 
1 1 1 7   5  20 o 377.8853 27.09671 27.97956       3.950133      29.56197       5.521867      26.32103       5.653108  386.9913 37.19984 364.3491 40.64498 22.64218       55.09848 
1 1 1 7   5  21 o 330.2303 32.28864 21.50925       4.087917      25.23419       5.670768      17.47937       5.898320  356.2455 41.78220 293.0645 53.80764 63.18106       68.12498 
1 1 1 7   5  22 o 334.3254 39.21933 22.21454       4.995368      18.38256       5.900075      31.91529       9.387472  300.8401 52.40475 395.7032 63.21495 -94.86313      82.11204 
1 1 1 7   5  23 o 235.9869 49.63536 11.39878       4.404714      14.87386       5.921789      7.095114       6.590075  268.6095 58.43066 198.1373 69.38432 70.47224       90.71011 
1 1 1 7   5  24 o 290.8369 43.09250 17.00699       4.719923      15.98091       6.347082      18.27637       7.059583  277.8302 60.53694 296.9143 63.16518 -19.08411      87.49035 
1 1 1 7   5  25 o 699.1578 21.42712 95.32797       5.817910      96.56216       7.909278      93.87283       8.588114  702.4148 28.99447 691.9812 31.95770 10.43359       43.15060 
1 1 1 7   5  26 o 492.3435 27.85637 47.63529       5.304399      53.45094       6.970038      39.63164       8.176739  519.9666 34.71646 443.4877 48.25436 76.47885       59.44506 
1 1 1 7   5  27 o 528.5396 31.49835 55.17627       6.436022      58.97739       7.418884      43.61379       12.93922  545.3735 35.21624 451.1574 76.58890 94.21613       84.29735 
1 1 1 7   5  28 o 628.5899 28.20771 77.74310       6.885940      73.16200       8.050426      90.23180       13.29207  606.9846 34.29211 665.1673 51.86563 -58.18274      62.17710 
1 1 1 7   5  29 o 129.5500 55.85647 0.7669077E-01  5.110083      -4.890081      6.950096      5.921302       7.539308  127.1371 58.96379 188.6618 72.74683 -61.52468      93.64203 
1 1 1 7   5  30 o 679.9012 24.14739 91.04460       6.375936      91.89928       9.073569      90.21094       8.961349  677.2673 34.61332 671.0696 34.50241 6.197632       48.87226 
1 1 1 7   5  31 o 178.5867 64.70623 6.260335       5.778901      2.543576       9.457949      8.474572       7.300067  178.4016 76.43819 201.9752 72.79523 -23.57359      105.5554 
1 1 1 7   6  0  o 894.0820 13.43852 155.4078       4.666131      156.4565       5.544475      152.8618       8.638915  896.8773 15.91840 885.4072 25.12396 11.47009       29.74237 
1 1 1 7   6  1  o 1307.198 16.02294 332.3708       8.134134      333.3704       10.20387      330.6284       13.47232  1308.524 20.07961 1301.805 26.64825 6.719482       33.36645 
1 1 1 7   6  2  o 518.3690 16.23862 52.26969       3.269010      53.05602       4.224114      51.09553       5.161727  521.9531 20.83897 511.1372 26.09025 10.81589       33.39108 
1 1 1 7   6  3  o 1039.194 14.85546 210.0196       5.995300      213.6179       7.622343      204.1823       9.708429  1047.583 18.73579 1023.310 24.42944 24.27258       30.78681 
1 1 1 7   6  4  o 568.0787 15.12044 62.76894       3.335806      64.00522       4.294839      60.88908       5.296029  573.3439 19.28873 558.7549 24.40625 14.58905       31.10820 
1 1 1 7   6  5  o 857.1742 14.93303 142.9228       4.971014      141.8207       10.01042      143.2835       5.727049  851.5355 30.27064 858.0100 17.18741 -6.474487      34.80975 
1 1 1 7   6  6  o 982.4154 13.33481 187.6973       5.087564      185.9686       11.38238      188.1289       5.687290  974.8182 30.06641 983.3569 14.89245 -8.538635      33.55256 
1 1 1 7   6  7  o 784.7820 13.24925 119.7901       4.038019      117.4315       9.329720      120.3337       4.479302  774.1282 31.03329 786.4131 14.66667 -12.28497      34.32457 
1 1 1 7   6  8  o 876.2284 13.68277 149.3733       4.656067      155.8875       6.845962      143.7667       6.351187  894.2011 19.71384 858.8496 19.04188 35.35150       27.40855 
1 1 1 7   6  9  o 214.9703 29.94729 9.230199       2.432234      11.44487       3.579303      7.330238       3.315249  237.5784 40.22973 188.4806 45.75282 49.09776       60.92415 
1 1 1 7   6  10 o 704.3897 19.67545 96.75656       5.382272      0.000000       0.000000      96.75656       5.382272  ?        ?        704.3897 19.67545 0.000000       19.67545 
1 1 1 7   6  11 o 1005.161 19.60130 196.9906       7.651538      0.000000       0.000000      196.9906       7.651538  ?        ?        1005.161 19.60130 0.000000       19.60130 
1 1 1 7   6  12 o 501.8454 18.68156 49.07114       3.640919      43.54013       5.821005      52.62560       4.666406  470.0949 32.07640 519.2288 23.14173 -49.13382      39.55294 
1 1 1 7   6  13 o 432.5717 18.67584 36.44373       3.137373      34.93802       4.467082      37.90945       4.407351  421.9373 27.40995 439.8214 25.91773 -17.88409      37.72313 
1 1 1 7   6  14 o 291.0724 26.92808 16.67930       3.009436      17.70693       4.161123      15.55231       4.357645  298.3047 36.69244 278.2755 41.59929 20.02914       55.46923 
1 1 1 7   6  15 o 776.5854 15.22537 117.2804       4.591823      116.6150       6.436637      117.9700       6.552552  773.8139 21.41877 778.2685 21.67969 -4.454590      30.47577 
1 1 1 7   6  16 o 619.4053 20.05188 74.66834       4.823452      72.94716       5.704343      78.98634       9.035115  611.9236 24.00383 634.3079 36.83664 -22.38434      43.96728 
1 1 1 7   6  17 o 704.3861 16.63183 96.47727       4.549658      92.76861       6.300761      100.5176       6.576468  690.2355 23.50540 718.4798 23.56949 -28.24426      33.28701 
1 1 1 7   6  18 o 272.9367 35.45340 14.79241       3.669173      12.02764       5.238749      17.45459       5.140632  242.2602 56.68802 294.8266 46.43350 -52.56639      73.27757 
1 1 1 7   6  19 o 1493.714 19.17300 434.0416       11.12206      467.1014       21.08905      421.3035       13.09054  1546.214 35.12040 1471.053 22.91400 75.16064       41.93441 
1 1 1 7   6  20 f 345.6945 30.17199 23.49902       4.010049      23.99109       5.550666      22.96182       5.799655  347.3247 42.00467 339.0512 45.17005 8.273529       61.68246 
1 1 1 7   6  21 o 695.1029 18.98125 94.03218       5.123914      92.64668       7.032550      95.59995       7.480825  689.2516 26.27284 700.0046 27.51824 -10.75293      38.04623 
1 1 1 7   6  22 o 717.6293 19.37899 100.2518       5.400815      97.98434       7.415578      102.8131       7.881508  708.6360 26.94597 725.7517 27.96362 -17.11572      38.83361 
1 1 1 7   6  23 o 540.6893 27.38461 57.21629       5.731437      56.17916       6.787086      59.79430       10.70066  534.8332 32.83542 547.6264 50.89744 -12.79321      60.56991 
1 1 1 7   6  24 o 708.5749 21.13280 97.84728       5.815282      109.3837       7.990504      84.85616       8.479351  748.2418 27.49820 657.2686 33.32843 90.97321       43.20804 
1 1 1 7   6  25 f 265.0978 48.60262 14.37394       4.819331      17.75703       6.388004      9.904524       7.342341  292.7943 58.22886 223.0902 73.28758 69.70410       93.60379 
1 1 1 7   6  26 o 254.2408 56.73468 13.51142       5.459591      16.97255       6.319621      3.327648       10.84018  284.9484 59.04840 201.1980 83.77090 83.75041       102.4904 
1 1 1 7   6  27 o 508.9695 31.62981 51.21671       6.221026      52.61036       7.212718      47.16810       12.29346  514.4200 36.33756 472.9669 68.95755 41.45309       77.94589 
1 1 1 7   6  28 o 230.7324 63.47849 11.42655       5.866384      9.042955       6.742424      18.85290       11.90111  210.0171 70.27952 288.7362 93.20707 -78.71913      116.7337 
1 1 1 7   6  29 o 245.2070 57.95700 12.95707       5.431828      15.50974       7.219550      9.627030       8.245885  264.5110 69.40955 217.1149 77.46067 47.39603       104.0088 
1 1 1 7   6  30 o 477.6906 35.51582 45.94957       6.541534      43.31171       10.35690      47.70033       8.437581  448.6861 61.02018 481.2544 45.69360 -32.56830      76.23232 
1 1 1 7   7  0  o 560.6046 17.14840 61.15727       3.733432      58.70757       4.742663      65.14883       6.053929  548.8580 22.25022 577.6918 26.98442 -28.83386      34.97472 
1 1 1 7   7  1  o 233.3727 29.01842 10.80182       2.573190      10.06115       3.308952      11.93499       4.092852  223.1167 39.64056 242.3631 45.14534 -19.24632      60.07891 
1 1 1 7   7  2  o 312.3909 36.19169 19.38426       4.309386      0.000000       0.000000      19.38426       4.309386  ?        ?        312.3909 36.19169 0.000000       36.19169 
1 1 1 7   7  3  o 629.0385 15.31198 76.97488       3.740560      74.53465       4.666397      81.36151       6.256503  618.6422 19.42290 645.7355 24.94876 -27.09332      31.61787 
1 1 1 7   7  4  o 286.4358 20.18656 16.06374       2.231156      15.13324       2.971526      17.26628       3.378093  276.8804 28.02078 295.6375 29.83066 -18.75711      40.92716 
1 1 1 7   7  5  o 316.8575 18.02611 19.61474       2.208997      19.62984       3.027042      19.59755       3.230901  316.1138 24.85790 315.5874 26.61009 0.5264282      36.41446 
1 1 1 7   7  6  o 807.7960 13.24341 126.9218       4.154603      162.2986       11.10298      121.1620       4.480068  909.9095 31.42051 789.1081 14.61908 120.8014       34.65496 
1 1 1 7   7  7  o 434.7934 15.51249 36.80003       2.619343      43.95100       7.256617      35.72874       2.808701  470.2162 40.12219 428.3193 16.88535 41.89685       43.53051 
1 1 1 7   7  8  o 579.6808 14.97307 65.40954       3.370761      60.21695       4.979284      69.80217       4.579698  555.2593 23.09101 598.2922 19.71040 -43.03290      30.35943 
1 1 1 7   7  9  f 776.8521 19.27459 117.6733       5.815024      0.000000       0.000000      117.6733       5.815024  ?        ?        776.8521 19.27459 0.000000       19.27459 
1 1 1 7   7  10 o 372.5699 21.28555 27.17430       3.067010      29.91012       5.218083      25.73031       3.790965  388.3680 34.97219 361.5571 27.19809 26.81088       44.30339 
1 1 1 7   7  11 o 403.1897 20.51676 31.78375       3.201915      34.49575       5.237125      30.16490       4.046239  417.9926 32.51832 391.8066 26.75195 26.18597       42.10828 
1 1 1 7   7  12 o 1167.510 14.22812 265.1768       6.451138      265.2109       9.142061      265.1429       9.104626  1166.478 20.18085 1166.346 20.10049 0.1322021      28.48327 
1 1 1 7   7  13 o 343.0727 21.87222 23.03508       2.898931      20.98343       4.027587      25.24056       4.175845  325.8052 32.25541 357.9526 30.32439 -32.14743      44.27166 
1 1 1 7   7  14 o 406.5934 20.25177 32.19283       3.197800      40.80755       4.513873      23.51291       4.530921  456.6842 25.55354 344.9099 34.28033 111.7743       42.75658 
1 1 1 7   7  15 o 628.9223 19.40556 76.98170       4.739703      75.14190       5.544020      81.97854       9.136653  621.0750 22.98544 646.1224 36.56194 -25.04736      43.18687 
1 1 1 7   7  16 o 1236.450 21.38961 297.5936       10.27088      297.5936       10.27088      0.000000       0.000000  1236.450 21.38961 ?        ?        0.000000       21.38961 
1 1 1 7   7  17 o 1823.177 17.16495 646.3752       12.15344      644.0521       17.11798      648.7365       17.25801  1818.591 24.23759 1825.169 24.34779 -6.577759      34.35514 
1 1 1 7   7  18 o 2406.928 20.13897 1127.144       18.82471      1127.692       26.60710      1126.595       26.63723  2405.146 28.48578 2403.960 28.53210 1.185303       40.31775 
1 1 1 7   7  19 o 702.2473 21.48741 95.98933       5.860060      87.30071       10.15120      100.3320       7.176628  666.6885 39.38203 717.5809 25.75263 -50.89240      47.05467 
1 1 1 7   7  20 o 1119.851 19.06450 244.0329       8.291123      256.9937       15.11834      238.4581       9.915163  1146.543 33.95359 1106.435 23.07522 40.10791       41.05256 
1 1 1 7   7  21 o 218.4712 47.64648 9.759787       3.928667      1.827251       5.327663      19.21447       5.816399  146.9241 59.68722 308.2591 50.32249 -161.3350      78.06995 
1 1 1 7   7  22 o 819.9332 18.36789 130.8447       5.848786      137.1950       8.127851      124.0251       8.422902  838.7780 24.95173 797.1846 27.20664 41.59338       36.91599 
1 1 1 7   7  23 o 512.8146 28.83821 51.53995       5.719923      56.46182       6.866971      40.38646       10.33725  536.0470 33.14902 446.0617 61.29346 89.98526       69.68318 
1 1 1 7   7  24 o 322.1282 44.00490 20.84304       5.361010      16.82593       6.323071      31.11397       10.11057  285.1986 59.03390 386.9992 69.84241 -101.8005      91.44923 
1 1 1 7   7  25 o 201.9190 62.38547 8.269917       5.385888      12.40052       6.266252      -3.410535      10.53734  243.1016 65.08110 171.4620 76.78561 71.63957       100.6557 
1 1 1 7   7  26 o 313.6467 46.95669 20.02888       5.543684      22.76852       6.463491      12.40540       10.78194  333.3344 51.59671 250.4951 88.65952 82.83931       102.5804 
1 1 1 7   7  27 o 776.2066 21.65081 117.8259       6.526486      125.3628       8.829826      108.7495       9.689672  798.5873 28.47094 742.0089 33.62576 56.57843       44.06002 
1 1 1 7   7  28 o 214.6708 60.17492 9.836833       5.218526      13.60215       6.954247      4.983630       7.895202  249.6715 69.28133 185.8410 73.61499 63.83049       101.0894 
1 1 1 7   7  29 o 352.4776 47.54595 25.72043       6.342310      38.28344       9.816854      16.71983       8.309243  423.2206 61.53011 271.6764 75.85300 151.5443       97.67104 
1 1 1 7   7  30 o 490.2898 43.24414 49.28101       8.149599      51.45890       10.72046      46.29935       12.54364  491.6990 57.21138 453.6351 73.73363 38.06387       93.32625 
1 1 1 7   8  0  o 488.3397 16.15037 46.40765       3.062898      46.82015       3.740203      45.56783       5.336812  490.2491 19.64493 481.9418 28.64293 8.307281       34.73241 
1 1 1 7   8  1  o 413.5909 17.90935 33.30540       2.876595      31.97345       4.088591      34.61101       4.047952  403.7784 26.21557 420.3639 24.90705 -16.58554      36.16099 
1 1 1 7   8  2  o 129.2231 41.19673 3.227936       2.330493      2.762535       3.135249      3.802595       3.483880  130.4593 47.60052 145.4613 50.47594 -15.00200      69.38033 
1 1 1 7   8  3  o 564.9416 14.64692 62.09315       3.213496      64.94497       4.446168      58.97411       4.649809  577.3055 19.83134 549.9285 21.77213 27.37695       29.45009 
1 1 1 7   8  4  o 391.8633 25.04530 30.11518       3.791511      0.000000       0.000000      30.11518       3.791511  ?        ?        391.8633 25.04530 0.000000       25.04530 
1 1 1 7   8  5  o 366.9286 16.63261 26.21608       2.370118      23.59275       3.146416      29.65719       3.603618  346.8246 23.49896 388.9613 23.97318 -42.13669      33.56955 
1 1 1 7   8  6  o 254.8725 23.20513 12.78922       2.271704      6.985460       6.597420      13.56991       2.419672  195.6237 69.34055 262.4743 24.00363 -66.85056      73.37770 
1 1 1 7   8  7  o 737.0750 16.68375 105.8194       4.775661      100.8378       9.686622      107.4191       5.489137  715.8083 34.84557 742.2783 19.04186 -26.47003      39.70902 
1 1 1 7   8  8  o 1041.046 14.82158 210.9697       5.992282      0.000000       0.000000      210.9697       5.992282  ?        ?        1041.046 14.82158 0.000000       14.82158 
1 1 1 7   8  9  o 750.5291 15.39913 109.6690       4.488402      106.2263       7.422508      111.6535       5.635496  736.8663 25.93785 756.7382 19.17602 -19.87189      32.25665 
1 1 1 7   8  10 o 991.1069 13.70676 191.1199       5.275737      190.0402       7.508614      192.1727       7.414320  987.2787 19.58358 992.8751 19.22865 -5.596313      27.44553 
1 1 1 7   8  11 o 576.8799 15.34436 64.76849       3.437654      60.53439       4.843463      69.06655       4.879897  556.9857 22.39154 595.1053 21.11489 -38.11963      30.77693 
1 1 1 7   8  12 o 721.9641 14.50378 101.3945       4.066538      98.60725       5.686121      104.3125       5.818056  711.3209 20.58366 731.6234 20.47681 -20.30249      29.03424 
1 1 1 7   8  13 o 1081.817 16.81768 227.7318       7.065581      234.7338       8.563874      212.8047       12.50397  1097.828 20.08668 1043.156 30.86531 54.67188       36.82584 
1 1 1 7   8  14 o 512.7459 17.29057 51.15017       3.443019      54.08334       4.828646      48.11644       4.910718  526.8008 23.60212 496.0842 25.57656 30.71661       34.80259 
1 1 1 7   8  15 o 653.9658 15.91371 83.16512       4.041611      80.80930       5.572351      85.77999       5.870717  644.1869 22.27402 663.6604 22.77808 -19.47351      31.85864 
1 1 1 7   8  16 o 607.0624 17.23627 71.66847       4.063541      65.81252       5.551484      78.42728       5.964107  581.2734 24.59238 634.5723 24.20117 -53.29889      34.50336 
1 1 1 7   8  17 o 1080.985 15.24219 227.1583       6.398746      227.3374       8.972215      226.9730       9.128186  1080.820 21.37560 1079.909 21.76553 0.9106445      30.50664 
1 1 1 7   8  18 o 327.4985 28.27988 21.06348       3.561507      22.14844       4.800148      19.73474       5.312141  334.4919 37.60409 314.1658 44.80913 20.32608       58.49722 
1 1 1 7   8  19 o 1332.421 16.01313 345.2210       8.286015      347.8209       11.66027      342.5688       11.77699  1336.511 22.46509 1326.316 22.86438 10.19543       32.05402 
1 1 1 7   8  20 o 284.5789 46.73753 16.33773       4.985940      18.10304       8.766594      15.49368       6.061822  294.6339 76.08641 274.5656 58.63233 20.06833       96.05672 
1 1 1 7   8  21 o 1217.148 19.74607 288.4109       9.333662      280.1201       16.28340      292.4679       11.39064  1196.196 35.05216 1224.932 23.94464 -28.73584      42.44997 
1 1 1 7   8  22 o 790.3560 18.37305 121.5832       5.639389      124.6525       7.797884      118.2177       8.165404  799.4478 25.11648 778.2701 27.01590 21.17767       36.88762 
1 1 1 7   8  23 o 667.3311 20.78472 86.76437       5.386585      84.25301       7.340935      89.69385       7.928514  656.5905 28.78915 677.2496 30.14499 -20.65912      41.68375 
1 1 1 7   8  24 o 465.8361 31.88761 42.72629       5.734068      42.33181       6.717081      43.78600       11.00929  462.3994 37.73447 462.7227 62.89444 -0.3232117     73.34576 
1 1 1 7   8  25 o 514.9921 35.93546 52.48825       7.142019      52.48825       7.142019      0.000000       0.000000  514.9921 35.93546 ?        ?        0.000000       35.93546 
1 1 1 7   8  26 o 662.6268 23.06555 85.87026       5.935547      88.79949       8.012727      82.30838       8.835757  671.9875 30.70373 644.7010 35.42634 27.28656       46.88011 
1 1 1 7   8  27 o 691.0664 22.97426 93.52267       6.165799      95.29889       8.330191      91.37043       9.169642  695.2458 30.85237 678.4863 34.91873 16.75952       46.59599 
1 1 1 7   8  28 f 204.3341 61.57799 8.861712       5.290495      11.56132       7.098744      5.488909       7.934623  231.0563 71.66055 188.6763 74.09602 42.37993       103.0798 
1 1 1 7   8  29 o 353.8019 46.99219 25.93846       6.297009      14.71731       9.458835      34.86999       8.438828  254.1147 83.16813 406.7492 54.81911 -152.6345      99.60960 
1 1 1 7   8  30 o 423.6994 52.60460 37.89954       8.469604      0.000000       0.000000      37.89954       8.469604  ?        ?        423.6994 52.60460 0.000000       52.60460 
1 1 1 7   9  0  o 514.4617 15.73198 51.51839       3.143145      50.69000       3.791979      53.33715       5.618709  510.0105 19.14515 521.3859 27.84990 -11.37546      33.79577 
1 1 1 7   9  1  o 392.9931 18.94729 30.09646       2.891745      29.85940       4.145179      30.32121       4.036093  389.7174 27.56618 392.8976 26.60859 -3.180115      38.31333 
1 1 1 7   9  2  o 561.6285 15.24742 61.39211       3.325628      61.90620       4.746567      60.89642       4.660898  563.3007 21.69758 558.7139 21.48088 4.586731       30.53217 
1 1 1 7   9  3  o 524.4647 15.15325 53.53798       3.086385      56.01880       4.400395      51.13581       4.330070  535.8768 21.14457 511.9170 21.78048 23.95978       30.35592 
1 1 1 7   9  4  o 425.1542 22.49979 35.38671       3.701728      35.38671       3.701728      0.000000       0.000000  425.1542 22.49979 ?        ?        0.000000       22.49979 
1 1 1 7   9  5  o 769.0757 18.46289 115.2878       5.514380      115.2878       5.514380      0.000000       0.000000  769.0757 18.46289 ?        ?        0.000000       18.46289 
1 1 1 7   9  6  o 1520.479 16.81517 450.3648       9.929096      0.000000       0.000000      450.3648       9.929096  ?        ?        1520.479 16.81517 0.000000       16.81517 
1 1 1 7   9  7  f 712.5040 14.39493 98.81269       3.983134      0.000000       0.000000      98.81269       3.983134  ?        ?        712.5040 14.39493 0.000000       14.39493 
1 1 1 7   9  8  o 601.5734 14.48456 70.43842       3.383935      0.000000       0.000000      70.43842       3.383935  ?        ?        601.5734 14.48456 0.000000       14.48456 
1 1 1 7   9  9  o 789.2811 11.64329 121.1432       3.568908      128.3807       6.291023      117.7086       4.333776  811.3620 19.96543 777.7159 14.34886 33.64612       24.58675 
1 1 1 7   9  10 o 85.87792 36.80078 -0.9237982E-01 2.192829      3.395704       3.427944      -2.508358      2.852901  140.1826 49.95098 80.94938 37.62308 59.23321       62.53476 
1 1 1 7   9  11 o 252.4473 32.94351 12.69961       3.152752      14.50728       3.554959      6.039616       6.823579  269.7321 34.74483 190.3934 70.10855 79.33875       78.24585 
1 1 1 7   9  12 o 634.0636 18.06930 78.26631       4.449407      78.44249       5.116692      77.71992       9.010907  634.5171 20.76433 628.2101 37.09938 6.307007       42.51496 
1 1 1 7   9  13 o 119.0960 42.58944 2.378871       2.494132      -0.6922338     3.342933      6.234838       3.745821  101.8637 44.53340 175.9603 51.51914 -74.09660      68.09879 
1 1 1 7   9  14 o 243.7772 29.88522 11.77305       2.770036      12.42659       3.763577      11.00055       4.091821  248.6573 40.35728 232.4170 46.94985 16.24030       61.91122 
1 1 1 7   9  15 o 481.5699 18.62621 45.11598       3.483467      43.40257       4.738059      47.13170       5.139071  471.2097 25.99208 490.9628 27.05751 -19.75308      37.51929 
1 1 1 7   9  16 o 656.6063 16.57409 83.83017       4.226325      83.76112       5.847740      83.90567       6.115070  655.9255 22.95649 656.4126 23.98814 -0.4870605     33.20288 
1 1 1 7   9  17 o 1225.501 15.40537 291.9659       7.331857      312.5722       10.74080      273.9859       10.03298  1267.267 21.82430 1186.478 21.77421 80.78979       30.82882 
1 1 1 7   9  18 o 2019.642 18.26150 793.4223       14.32316      794.5766       20.26134      792.2692       20.25067  2019.348 25.83623 2016.407 25.86028 2.940796       36.55495 
1 1 1 7   9  19 o 917.8159 16.35858 163.8300       5.830812      163.6966       8.109577      163.9727       8.389575  916.7650 22.77782 917.4421 23.54688 -0.6771240     32.76102 
1 1 1 7   9  20 o 733.5269 24.58928 104.8872       7.004704      104.8872       7.004704      0.000000       0.000000  733.5269 24.58928 ?        ?        0.000000       24.58928 
1 1 1 7   9  21 o 716.4216 23.00868 100.0239       6.401598      97.17379       11.02944      101.4718       7.861239  702.3350 40.61051 720.9528 28.07735 -18.61786      49.37156 
1 1 1 7   9  22 o 373.9400 31.26383 27.53306       4.498517      24.67860       6.047011      31.07046       6.731644  351.0764 45.41639 394.7242 44.70168 -43.64786      63.72511 
1 1 1 7   9  23 o 1276.465 17.14864 317.1586       8.500936      322.3173       11.89186      311.7676       12.15679  1285.347 23.82327 1263.897 24.76732 21.45007       34.36523 
1 1 1 7   9  24 o 582.3256 27.12774 66.33037       6.134900      62.27054       7.260834      76.46115       11.46975  562.2076 33.40553 618.6547 48.11805 -56.44702      58.57710 
1 1 1 7   9  25 o 810.2571 22.83214 128.2814       7.184514      144.5990       8.775662      95.11446       12.51132  859.3733 26.29481 689.2839 47.01942 170.0894       53.87247 
1 1 1 7   9  26 o 271.8497 49.87014 15.28163       5.070964      19.12499       6.679894      10.05425       7.790346  301.7567 59.11585 223.1114 75.53950 78.64536       95.92132 
1 1 1 7   9  27 o 485.9607 30.21973 46.74891       5.674969      45.22120       7.524232      48.76457       8.642761  474.0298 41.28444 490.3875 45.91672 -16.35767      61.74747 
1 1 1 7   9  28 o 356.6742 45.47686 26.12342       6.155931      22.61178       9.004271      29.20519       8.435171  318.0050 74.25662 370.0491 60.80853 -52.04407      95.97772 
1 1 1 7   9  29 o 116.9065 53.45484 -2.853359      5.432310      1.164653       7.361403      -7.657661      8.049523  157.0643 67.36979 128.2820 60.73748 28.78227       90.70683 
1 1 1 7   9  30 o 554.6830 28.90432 61.29298       6.204832      58.09622       8.654321      64.67442       8.900783  532.4592 42.19781 562.7457 41.00976 -30.28644      58.84263 
1 1 1 7   10 0  o 999.6464 13.68588 194.4528       5.313088      193.3321       6.299409      197.2151       9.889510  996.3223 16.28066 1004.129 25.36046 -7.807129      30.13657 
1 1 1 7   10 1  o 634.1679 15.08591 78.29381       3.715385      79.88469       5.376573      76.83979       5.140097  639.7067 21.64196 627.4797 21.09325 12.22693       30.22085 
1 1 1 7   10 2  o 462.1599 17.03533 41.61278       3.057531      41.79767       4.357257      41.43343       4.291498  461.7515 24.38482 459.7780 24.11852 1.973480       34.29755 
1 1 1 7   10 3  o 404.5456 17.68384 31.89400       2.778255      28.62157       3.937236      35.13932       3.920905  381.4295 26.74887 423.3279 23.94780 -41.89832      35.90264 
1 1 1 7   10 4  o 1144.679 19.26161 255.5400       8.562576      0.000000       0.000000      255.5400       8.562576  ?        ?        1144.679 19.26161 0.000000       19.26161 
1 1 1 7   10 5  o 122.4482 37.54163 2.966714       1.954649      3.052081       2.747802      2.879266       2.781082  129.7467 44.83867 127.8566 45.05227 1.890114       63.56267 
1 1 1 7   10 6  o 524.7204 12.60564 53.56339       2.568743      51.33578       4.313503      54.78748       3.197554  512.7567 21.66161 530.4259 15.52263 -17.66925      26.64915 
1 1 1 7   10 7  o 813.4467 13.19984 128.7435       4.169902      115.0267       10.10756      131.5569       4.577613  764.5869 34.04016 822.1392 14.33725 -57.55231      36.93629 
1 1 1 7   10 8  o 475.1242 13.79563 43.92551       2.545521      33.72131       7.391577      45.29855       2.711376  409.1986 47.39016 482.4424 14.47159 -73.24380      49.55052 
1 1 1 7   10 9  o 642.0353 13.19743 80.18291       3.290608      87.28226       9.245410      79.15314       3.521185  665.1773 35.92311 637.8092 14.21576 27.36810       38.63364 
1 1 1 7   10 10 o 261.3678 33.21004 13.60621       3.294827      16.37134       3.736328      3.936350       6.987118  286.8714 34.21231 176.5424 69.46732 110.3290       77.43508 
1 1 1 7   10 11 o 715.1017 14.03718 99.45494       3.898303      99.77614       5.576372      99.14793       5.451805  715.6610 20.06395 713.4488 19.67657 2.212219       28.10213 
1 1 1 7   10 12 o 1196.869 14.16457 278.5543       6.583822      291.5002       9.642554      267.2479       9.011326  1223.449 20.29449 1171.531 19.80646 51.91821       28.35775 
1 1 1 7   10 13 o 373.6624 19.92312 27.25632       2.880674      26.47047       3.887041      28.21379       4.290560  367.3350 27.44590 379.0309 29.37767 -11.69583      40.20355 
1 1 1 7   10 14 o 137.7979 43.52885 3.673278       2.606413      1.104529       3.438521      7.142536       3.996034  117.9655 47.94020 187.7082 52.67113 -69.74265      71.22156 
1 1 1 7   10 15 o 226.8566 34.13329 10.27284       2.914008      9.837496       3.839957      10.86395       4.474497  219.8213 46.43620 230.5668 51.29486 -10.74542      69.19164 
1 1 1 7   10 16 o 383.6750 22.51622 28.75367       3.340258      25.55940       4.468397      32.79936       5.028779  360.4641 32.26106 408.7382 31.93392 -48.27408      45.39330 
1 1 1 7   10 17 o 466.9281 20.92333 42.42923       3.794101      40.30032       5.094496      45.08058       5.685330  453.6760 29.06820 479.7183 30.67759 -26.04224      42.26197 
1 1 1 7   10 18 o 868.6407 16.10333 146.7281       5.432303      151.7708       7.611459      141.4928       7.755437  882.8606 22.19973 852.3083 23.43050 30.55231       32.27718 
1 1 1 7   10 19 o 929.4691 16.21456 168.0278       5.852861      166.8631       8.111846      169.2925       8.453087  925.5308 22.56840 932.1393 23.35106 -6.608582      32.47468 
1 1 1 7   10 20 o 1345.314 16.35347 352.0663       8.544006      349.9590       11.90794      354.3023       12.26612  1340.132 22.88027 1348.308 23.42556 -8.176514      32.74544 
1 1 1 7   10 21 o 347.0525 31.78334 23.74737       4.236158      21.91951       5.688184      26.02358       6.347573  330.6167 45.50788 360.5251 46.41399 -29.90848      65.00174 
1 1 1 7   10 22 o 393.6472 37.64866 30.68765       5.685327      21.78694       9.740834      35.28632       7.001646  321.2354 78.70042 421.0851 43.43954 -99.84973      89.89299 
1 1 1 7   10 23 o 975.9763 20.21878 185.6413       7.663414      183.7460       9.242621      189.8106       13.70809  970.1404 24.53198 982.9938 35.90857 -12.85333      43.48843 
1 1 1 7   10 24 f 482.1670 27.20872 45.64875       5.074063      52.47512       6.857739      37.39066       7.542682  515.4156 34.45920 431.6880 45.68544 83.72760       57.22409 
1 1 1 7   10 25 o 397.2605 32.92477 31.28190       5.033775      31.73829       6.596474      30.64560       7.788854  397.2245 43.47049 386.9614 53.23960 10.26306       68.73237 
1 1 1 7   10 26 o 253.2262 56.94513 13.54536       5.464192      18.41604       6.480760      1.569106       10.16229  295.6887 58.50850 185.8660 79.42399 109.8227       98.64793 
1 1 1 7   10 27 o 517.7943 31.96887 53.24099       6.397099      75.04833       9.885044      37.52695       8.391141  610.4639 41.95026 426.4855 51.72067 183.9784       66.59469 
1 1 1 7   10 28 o 441.3639 33.61261 38.99183       5.718075      40.53370       7.826699      37.22671       8.374195  444.4074 46.01589 422.5550 52.13636 21.85242       69.53893 
1 1 1 7   10 29 o 278.2966 52.37071 16.53861       5.452387      18.37052       7.447891      14.42305       8.003760  285.7578 68.08253 250.6493 75.78578 35.10847       101.8760 
1 1 1 7   11 0  o 828.8346 14.57822 133.7523       4.692456      125.3857       6.466209      143.0601       6.820202  801.3842 20.77691 856.0629 20.51463 -54.67877      29.19812 
1 1 1 7   11 1  o 145.8382 43.96071 4.272904       2.696093      5.979331       4.238415      3.113148       3.494161  173.4877 55.58356 137.2877 50.22705 36.20000       74.91521 
1 1 1 7   11 2  o 577.2753 17.09093 64.94448       3.831569      63.39232       6.080392      65.96677       4.934587  568.6923 27.53127 581.1302 21.86500 -12.43787      35.15749 
1 1 1 7   11 3  o 721.2031 19.91118 101.4937       5.576769      0.000000       0.000000      101.4937       5.576769  ?        ?        721.2031 19.91118 0.000000       19.91118 
1 1 1 7   11 4  o 484.6432 16.91191 45.76775       3.183045      44.64938       4.824547      46.62978       4.235725  476.8311 26.15321 488.5539 22.32479 -11.72281      34.38585 
1 1 1 7   11 5  f 784.2094 18.33756 119.8961       5.584723      0.000000       0.000000      119.8961       5.584723  ?        ?        784.2094 18.33756 0.000000       18.33756 
1 1 1 7   11 6  o 459.2996 17.97681 41.11546       3.206541      49.54937       8.164699      39.57739       3.486686  498.2568 42.60445 450.4351 19.93208 47.82172       47.03645 
1 1 1 7   11 7  o 512.0313 29.50452 51.55755       5.842118      55.42106       8.322580      47.80452       8.202729  527.9450 40.91154 489.3027 43.62466 38.64230       59.80690 
1 1 1 7   11 8  f 685.7404 25.20086 91.89770       6.711245      81.99051       8.994330      104.3423       10.08054  644.5972 36.07439 728.3721 35.63712 -83.77490      50.70864 
1 1 1 7   11 9  o 1159.566 22.53983 262.3040       10.15019      259.3128       14.34782      265.3009       14.36127  1150.194 32.12084 1163.512 31.78293 -13.31848      45.18742 
1 1 1 7   11 10 o 763.8300 15.76164 113.5205       4.675479      122.0050       10.27825      111.3068       5.250118  789.0374 33.54237 756.1255 17.87916 32.91187       38.00993 
1 1 1 7   11 11 o 1063.559 13.67646 219.9421       5.648890      214.4620       7.918107      225.6221       8.061293  1049.504 19.42715 1076.487 19.28271 -26.98218      27.37219 
1 1 1 7   11 12 o 537.5268 15.64507 56.19340       3.265921      58.17381       4.585604      54.15475       4.652544  546.5250 21.60521 527.2241 22.72308 19.30096       31.35480 
1 1 1 7   11 13 o 656.0228 14.64757 83.67145       3.731750      82.51855       5.180315      84.91509       5.380351  651.0997 20.48711 660.4479 20.97703 -9.348206      29.32162 
1 1 1 7   11 14 f 572.0728 15.80813 63.63138       3.512044      67.01810       4.829492      59.83020       5.116484  586.7923 21.19283 554.2639 23.76989 32.52844       31.84562 
1 1 1 7   11 15 o 323.0590 24.18819 20.43797       3.012657      21.07067       3.975744      19.58479       4.616856  327.0813 31.69707 314.1001 38.66500 12.98114       49.99686 
1 1 1 7   11 16 o 1133.274 14.92230 249.6640       6.567480      254.1622       9.260589      245.1125       9.315291  1142.825 20.86561 1122.234 21.37397 20.59082       29.87005 
1 1 1 7   11 17 o 554.3572 18.82590 59.78848       4.052969      67.55651       5.592703      51.19677       5.881742  588.8792 24.45499 511.3898 29.74445 77.48938       38.50687 
1 1 1 7   11 18 o 863.6226 15.98449 145.0506       5.361062      142.5140       7.266909      148.0798       7.941267  855.4596 21.87370 871.8152 23.45511 -16.35559      32.07180 
1 1 1 7   11 19 o 142.5309 51.19844 3.406673       3.608190      -2.722930      4.696836      12.23306       5.636127  110.6136 50.23765 243.4065 60.00554 -132.7929      78.25909 
1 1 1 7   11 20 o 393.1352 27.71374 30.31819       4.204124      24.29291       5.535751      38.52914       6.462257  349.2304 41.63744 441.6499 38.04851 -92.41953      56.40359 
1 1 1 7   11 21 o 1048.680 16.79351 213.9889       6.839314      218.1830       9.418532      209.3102       9.947644  1057.955 22.92388 1035.891 24.72738 22.06372       33.71865 
1 1 1 7   11 22 o 938.2544 25.70590 171.8823       9.366587      171.6496       13.86864      172.0775       12.70096  934.5190 38.21357 936.6157 34.91782 -2.096680      51.76418 
1 1 1 7   11 23 o 326.4977 45.90657 21.51784       5.660016      30.20841       9.992399      17.41225       6.868048  379.9305 70.31289 288.6021 63.04232 91.32837       94.43642 
1 1 1 7   11 24 o 392.7260 31.91422 30.50476       4.825351      33.71615       6.387424      26.23567       7.364571  410.8029 40.56713 357.5636 54.78095 53.23932       68.16631 
1 1 1 7   11 25 o 248.6793 50.99078 12.86472       4.759152      13.57240       6.286071      11.91432       7.284734  252.4111 64.02850 237.2946 72.42561 15.11653       96.67016 
1 1 1 7   11 26 o 306.9782 54.82306 19.71334       6.295995      30.22018       7.977714      2.362890       10.25174  381.3995 55.48737 189.3069 80.29913 192.0926       97.60532 
1 1 1 7   11 27 o 191.0326 68.09863 7.078400       6.371850      2.998410       7.971100      14.30003       10.60490  173.8081 72.05603 255.1158 88.09169 -81.30775      113.8078 
1 1 1 7   11 28 o 285.7978 49.58957 17.19516       5.304405      23.34269       7.163489      9.732702       7.892511  329.7943 58.05118 215.0931 75.88449 114.7012       95.54264 
1 1 1 7   11 29 o 451.1990 32.83006 40.89583       5.713205      43.04732       8.180926      38.84763       7.982125  455.2827 46.94272 431.3868 48.48565 23.89590       67.48686 
1 1 1 7   12 0  o 629.2912 17.50943 77.20685       4.279092      78.06839       6.750830      76.62822       5.532499  630.9180 27.55220 626.0598 22.75504 4.858215       35.73396 
1 1 1 7   12 1  o 403.1420 28.83033 32.05482       4.483944      0.000000       0.000000      32.05482       4.483944  ?        ?        403.1420 28.83033 0.000000       28.83033 
1 1 1 7   12 2  o 352.4082 22.90706 24.37563       3.118023      22.82545       4.808803      25.50012       4.095652  337.9618 37.25798 359.2169 29.62301 -21.25510      47.59916 
1 1 1 7   12 3  f 329.3339 21.64295 21.27193       2.752681      24.92724       3.996886      17.97380       3.796589  355.2635 29.22895 300.4820 33.08283 54.78149       44.14527 
1 1 1 7   12 4  o 583.6703 14.82227 66.32339       3.359776      62.71680       4.730293      69.99521       4.772877  566.7650 21.49102 598.8940 20.52118 -32.12897      29.71502 
1 1 1 7   12 5  o 494.0074 14.86217 47.50673       2.851305      43.22195       4.045378      51.73677       4.019454  470.4844 22.14042 514.9972 20.09714 -44.51279      29.90139 
1 1 1 7   12 6  o 470.6919 32.89580 43.72282       5.975384      49.24506       8.369529      37.98168       8.533805  496.6996 43.83879 433.3044 51.73631 63.39517       67.81213 
1 1 1 7   12 7  o 321.0090 44.74269 20.77225       5.426210      27.63673       7.754600      14.18653       7.595512  367.7925 56.06420 259.6060 72.53602 108.1865       91.67698 
1 1 1 7   12 8  o 758.8690 24.19498 112.4149       7.130500      108.8093       9.857569      116.3720       10.32690  744.6720 34.08606 770.0104 34.53387 -25.33838      48.52265 
1 1 1 7   12 9  o 361.1275 40.91763 25.98019       5.637232      25.74744       7.881225      26.22400       8.066505  354.7480 59.29975 357.8294 60.18344 -3.081329      84.48969 
1 1 1 7   12 10 o 419.7778 35.47499 34.76810       5.729069      25.09692       7.979856      45.05560       8.230197  350.1669 60.89100 476.1767 45.04050 -126.0098      75.73876 
1 1 1 7   12 11 o 378.9362 23.35915 28.08694       3.420810      29.01629       3.791256      24.01637       7.934494  384.9128 25.50709 342.5181 61.92912 42.39474       66.97632 
1 1 1 7   12 12 o 173.6626 34.53036 6.102583       2.246818      11.36531       3.199419      0.9817644      3.155987  238.4729 35.63983 112.7485 45.88643 125.7244       58.10131 
1 1 1 7   12 13 o 481.2295 16.35334 45.03262       3.056234      48.26632       4.233952      41.51465       4.416139  497.9245 21.89548 460.9638 24.75946 36.96069       33.05212 
1 1 1 7   12 14 o 1304.238 14.68472 330.6638       7.437900      330.6711       10.42711      330.6563       10.61291  1303.563 20.59699 1303.483 20.96530 0.7983398E-01  29.39013 
1 1 1 7   12 15 f 1063.961 14.53125 220.0462       6.004222      228.1519       8.561528      212.2013       8.422678  1082.823 20.35944 1044.242 20.76927 38.58142       29.08383 
1 1 1 7   12 16 o 629.8145 16.56007 77.13686       4.050446      76.45269       5.468941      77.96810       6.028199  626.6278 22.47324 632.6436 24.53581 -6.015747      33.27240 
1 1 1 7   12 17 o 520.4128 29.26393 53.02193       5.890365      0.000000       0.000000      53.02193       5.890365  ?        ?        520.4128 29.26393 0.000000       29.26393 
1 1 1 7   12 18 o 726.1957 16.93803 102.5920       4.776882      101.9146       6.453131      103.4131       7.104860  723.2299 22.97556 728.2846 25.12039 -5.054749      34.04277 
1 1 1 7   12 19 o 1017.124 16.02871 201.2393       6.331408      196.2054       8.572828      207.2798       9.390916  1003.540 21.99691 1031.239 23.44880 -27.69952      32.15136 
1 1 1 7   12 20 o 636.1296 26.05750 78.96152       6.437339      78.96152       6.437339      0.000000       0.000000  636.1296 26.05750 ?        ?        0.000000       26.05750 
1 1 1 7   12 21 o 333.1479 37.64393 22.06126       4.784915      21.70039       5.673260      22.95058       8.906111  328.5988 45.69350 331.3025 71.33064 -2.703705      84.71101 
1 1 1 7   12 22 o 604.8828 29.31816 71.61050       6.887094      71.61050       6.887094      0.000000       0.000000  604.8828 29.31816 ?        ?        0.000000       29.31816 
1 1 1 7   12 23 o 429.5777 35.40825 36.56506       5.854469      21.85173       9.864424      44.56569       7.274087  318.4551 79.89560 473.3185 39.94605 -154.8634      89.32521 
1 1 1 7   12 24 o 180.4143 65.13721 5.798342       5.848619      5.798342       5.848619      0.000000       0.000000  180.4143 65.13721 ?        ?        0.000000       65.13721 
1 1 1 7   12 25 o 582.9432 27.13869 66.74025       6.143886      82.51888       9.393524      54.94406       8.122036  643.7849 37.73647 523.9744 40.22106 119.8105       55.15229 
1 1 1 7   12 26 o 520.5236 30.49782 53.68820       6.138152      67.89501       9.455733      43.34164       8.069468  580.4434 42.23728 461.6791 45.60266 118.7642       62.15779 
1 1 1 7   12 27 o 433.8681 37.20021 37.92272       6.207410      39.42618       7.438543      34.47443       11.26533  439.2532 44.20641 391.7978 76.78344 47.45541       88.59969 
1 1 1 7   12 28 o 140.4031 57.94888 1.892518       5.122530      9.268989       7.294073      -5.286191      7.195633  209.0433 73.00799 127.0371 59.27886 82.00618       94.04333 
1 1 1 7   13 0  o 836.2363 18.58345 136.3848       6.035085      137.2294       12.38586      136.1219       6.910990  832.9106 38.29127 834.8517 21.31586 -1.941162      43.82451 
1 1 1 7   13 1  o 722.8512 15.23654 101.7528       4.277236      97.33002       5.884961      106.7052       6.227407  705.9684 21.46497 739.1425 21.69457 -33.17407      30.51884 
1 1 1 7   13 2  o 421.7025 27.51744 34.98885       4.481828      0.000000       0.000000      34.98885       4.481828  ?        ?        421.7025 27.51744 0.000000       27.51744 
1 1 1 7   13 3  f 431.2477 17.99307 36.24648       3.013423      32.63702       4.183854      40.13735       4.343898  407.4745 26.58485 452.3811 24.82045 -44.90665      36.37044 
1 1 1 7   13 4  o 375.5484 18.74977 27.49148       2.734576      25.82912       3.956838      29.01140       3.783529  362.0435 28.36929 384.3396 25.49330 -22.29608      38.14086 
1 1 1 7   13 5  o 346.1337 24.49685 23.52193       3.271657      19.84689       3.537845      45.22359       8.597151  317.0402 29.05731 475.0217 47.22910 -157.9816      55.45192 
1 1 1 7   13 6  o 518.9819 30.44482 52.93671       6.109258      52.96147       8.507717      52.91035       8.778224  516.0933 42.83511 515.4301 44.28400 0.6631470      61.61103 
1 1 1 7   13 7  o 360.4849 40.91352 25.91242       5.626270      27.85965       7.811273      23.81306       8.110666  369.9309 56.13448 339.1922 63.91648 30.73871       85.06701 
1 1 1 7   13 8  o 465.2861 32.96407 42.60533       5.917913      36.99794       8.191539      48.72698       8.558929  429.5493 50.04287 495.0510 45.01038 -65.50165      67.30693 
1 1 1 7   13 9  o 1080.499 23.06622 227.5630       9.678957      236.6578       14.01663      219.2737       13.38166  1099.738 32.81909 1058.642 32.54864 41.09521       46.22236 
1 1 1 7   13 10 f 193.2641 62.76315 7.232743       5.390720      3.066615       7.583642      11.48791       7.664256  177.2556 71.49094 239.0979 74.51054 -61.84232      103.2607 
1 1 1 7   13 11 o 990.6241 23.70034 191.1873       9.117830      199.5327       13.15712      183.4764       12.64712  1010.336 33.53257 968.8174 33.61411 41.51868       47.47991 
1 1 1 7   13 12 o 1097.578 16.81987 234.2804       7.169455      232.7165       8.308315      238.8408       14.18762  1093.613 19.56236 1105.787 33.03772 -12.17407      38.39502 
1 1 1 7   13 13 f 696.2645 20.70090 94.34155       5.597466      0.000000       0.000000      94.34155       5.597466  ?        ?        696.2645 20.70090 0.000000       20.70090 
1 1 1 7   13 14 o 616.2391 15.24693 73.82658       3.648881      76.37727       4.951469      70.79512       5.397990  626.5032 20.35086 602.9941 23.05107 23.50916       30.74913 
1 1 1 7   13 15 o 469.0378 18.18772 42.79413       3.312943      45.56974       4.424489      39.25203       4.998215  483.7194 23.55275 447.6829 28.90296 36.03650       37.28422 
1 1 1 7   13 16 f 889.5638 14.94765 153.8600       5.163903      151.1425       7.038598      157.0277       7.599316  881.1537 20.56868 898.0079 21.79046 -16.85419      29.96489 
1 1 1 7   13 17 o 677.7150 16.86698 89.34853       4.439278      95.64842       6.085305      82.18189       6.490434  700.7151 22.36212 649.1780 25.74435 51.53705       34.10038 
1 1 1 7   13 18 o 865.2509 15.95249 145.6261       5.360417      141.1766       7.144732      151.3562       8.107824  851.3105 21.61076 881.1844 23.69243 -29.87390      32.06799 
1 1 1 7   13 19 o 660.6490 18.52481 84.95794       4.752833      91.55715       6.377841      76.71617       7.127509  685.2626 23.96562 626.6377 29.28824 58.62494       37.84378 
1 1 1 7   13 20 o 584.6792 22.88327 66.64773       5.195935      66.55154       6.239463      66.86536       9.384975  583.7324 27.52361 581.4558 41.84094 2.276611       50.08207 
1 1 1 7   13 21 f 685.5470 19.77300 91.57069       5.264266      88.14005       6.955584      96.17069       8.054266  671.6454 26.66647 701.0759 29.58237 -29.43054      39.82734 
1 1 1 7   13 22 o 392.3351 29.77431 30.33290       4.502730      34.53102       5.898910      24.47200       6.969894  417.2272 36.78219 346.1915 53.57224 71.03568       64.98396 
1 1 1 7   13 23 o 201.6649 54.74206 8.460734       4.397191      5.196507       5.625411      13.58786       7.050195  174.1979 63.73004 252.9094 69.59310 -78.71153      94.36481 
1 1 1 7   13 24 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 7   13 25 o 313.6964 47.18224 20.21890       5.570012      15.02151       8.066645      24.95516       7.700478  261.7550 75.30775 344.0250 59.80788 -82.26999      96.16776 
1 1 1 7   13 26 o 273.4408 48.92514 15.61906       5.004708      13.21031       6.673835      18.71413       7.565107  245.3604 67.79008 291.8654 68.00406 -46.50502      96.02107 
1 1 1 7   13 27 o 964.7554 20.00491 182.4811       7.495174      190.6265       10.55255      174.1883       10.64764  981.7576 27.67739 937.4799 29.24581 44.27765       40.26605 
1 1 1 7   13 28 o 441.3532 35.39709 39.34898       6.016061      44.28188       7.644342      31.32234       9.751153  464.2820 42.88102 373.3984 69.81097 90.88358       81.92895 
1 1 1 7   14 0  o 484.2726 19.30210 45.73478       3.630132      48.64024       5.072353      42.68420       5.197499  497.8206 26.33029 465.7383 28.87828 32.08231       39.07991 
1 1 1 7   14 1  o 326.7262 24.71380 20.98621       3.112631      23.68321       4.450325      18.40342       4.355072  345.5005 33.59241 303.2202 37.80479 42.28030       50.57324 
1 1 1 7   14 2  f 396.8630 20.57689 30.80224       3.160496      34.70043       4.479177      26.93716       4.460116  420.1483 27.60523 369.2304 31.40246 50.91794       41.81104 
1 1 1 7   14 3  o 285.8483 25.56955 16.09603       2.808510      17.47023       3.901224      14.61764       4.046418  296.2291 34.56109 269.4452 39.87389 26.78387       52.76738 
1 1 1 7   14 4  o 345.3177 26.77146 23.45079       3.562141      25.63322       3.966467      14.35343       8.098258  360.8226 28.53915 261.4529 75.52328 99.36969       80.73567 
1 1 1 7   14 5  o 777.6400 13.75555 117.6214       4.154171      114.8208       5.861853      120.4471       5.888005  767.6526 19.66266 786.2874 19.28230 -18.63477      27.53956 
1 1 1 7   14 6  o 810.6083 25.01351 128.2498       7.874333      128.2590       11.06480      128.2402       11.20857  808.5961 35.23578 808.4279 35.70105 0.1682739      50.16099 
1 1 1 7   14 7  o 1102.481 23.27685 236.9816       9.966055      235.6755       13.97702      238.3324       14.21424  1097.235 32.80097 1103.301 33.17428 -6.065796      46.65229 
1 1 1 7   14 8  o 751.8961 25.54908 110.2762       7.460382      113.7230       10.56382      106.8466       10.53738  761.9172 35.70139 738.3297 36.74975 23.58752       51.23605 
1 1 1 7   14 9  o 479.2496 34.06905 45.15232       6.299577      37.59565       8.643177      53.71558       9.200846  433.2220 52.44101 520.4869 45.99196 -87.26492      69.75184 
1 1 1 7   14 10 o 597.6395 29.12877 69.70081       6.760664      66.07967       9.431686      73.52763       9.695831  578.8340 42.24909 610.9882 41.10145 -32.15417      58.94332 
1 1 1 7   14 11 o 324.1195 46.21704 21.03523       5.652724      17.64203       7.732111      24.93086       8.284795  291.9793 69.23962 349.4500 63.38173 -57.47064      93.86890 
1 1 1 7   14 12 o 1045.767 23.91949 212.9911       9.714373      205.4346       13.23200      221.8257       14.30732  1025.633 33.22047 1065.510 34.57583 -39.87732      47.94881 
1 1 1 7   14 13 o 129.4879 43.79121 3.057859       2.618048      3.032161       2.755033      3.297166       8.407275  130.3892 44.90691 186.3885 75.23843 -55.99924      87.62107 
1 1 1 7   14 14 o 924.9505 20.38832 166.5005       7.323657      0.000000       0.000000      166.5005       7.323657  ?        ?        924.9505 20.38832 0.000000       20.38832 
1 1 1 7   14 15 o 897.0598 14.48072 156.4524       5.044748      167.9808       7.112088      144.7784       7.156825  929.0295 19.71240 862.3108 21.37119 66.71869       29.07415 
1 1 1 7   14 16 o 593.5452 17.22281 68.53883       3.969956      71.19972       5.261560      65.02164       6.049216  604.5566 22.41040 577.3132 26.98110 27.24347       35.07429 
1 1 1 7   14 17 o 686.3653 16.86361 91.65501       4.495043      94.84994       5.948216      87.40122       6.863474  697.7532 21.95113 669.3019 26.40547 28.45129       34.33804 
1 1 1 7   14 18 o 426.8222 23.48553 35.62037       3.877940      38.27831       4.980031      31.52593       6.180979  441.7029 29.19647 398.6270 40.48856 43.07590       49.91750 
1 1 1 7   14 19 o 927.9333 18.33215 167.6257       6.606297      169.5302       8.056622      163.7171       11.54166  932.6283 22.24418 914.5565 32.49599 18.07184       39.38011 
1 1 1 7   14 20 o 326.8543 32.51172 21.13107       4.072119      19.12255       5.157418      24.45605       6.635721  308.2662 44.35768 347.7505 50.62062 -39.48428      67.30565 
1 1 1 7   14 21 o 118.8503 50.09866 0.4087673      3.950645      4.789265       5.032790      -6.624086      6.376947  167.1403 60.41151 116.1704 54.71452 50.96992       81.50600 
1 1 1 7   14 22 o 209.9565 52.00916 9.168916       4.218743      4.562828       5.437583      16.13422       6.686668  167.6992 62.42400 276.6341 63.57432 -108.9349      89.09798 
1 1 1 7   14 23 o 600.7852 25.35203 70.70733       5.915071      65.00122       8.631074      75.76070       8.122424  571.3264 39.13608 618.8577 33.92544 -47.53125      51.79351 
1 1 1 7   14 24 o 281.2965 67.20808 17.07378       7.241561      0.000000       0.000000      17.07378       7.241561  ?        ?        281.2965 67.20808 0.000000       67.20808 
1 1 1 7   14 25 o 599.8748 30.35720 71.27345       7.049115      81.33842       13.29454      67.33712       8.314045  627.3032 55.13134 580.2333 37.09019 47.06982       66.44657 
1 1 1 7   14 26 o 120.6132 52.77682 -0.5034311     4.704255      2.032605       6.321595      -3.650627      7.042241  153.5516 63.95557 132.4108 60.66101 21.14081       88.14803 
1 1 1 7   14 27 o 398.3157 33.34380 31.90638       5.110422      44.53038       7.277925      19.62811       7.177576  467.4029 40.49495 297.8044 63.96912 169.5986       75.70924 
1 1 1 7   15 0  o 733.1383 16.18465 104.6399       4.608051      107.8735       6.459505      101.2890       6.575583  743.5027 22.37117 720.2688 23.50778 23.23389       32.45127 
1 1 1 7   15 1  o 950.2643 15.05874 175.7241       5.557264      185.0460       7.999903      167.0305       7.725591  974.1158 21.14687 925.4175 21.49642 48.69836       30.15437 
1 1 1 7   15 2  o 1009.641 17.81457 198.5140       6.985060      191.4459       7.986831      221.5069       14.40529  990.9916 20.75279 1062.147 34.92281 -71.15570      40.62365 
1 1 1 7   15 3  o 954.4752 14.40034 177.2202       5.337836      173.9811       7.445631      180.6453       7.656464  944.8710 20.29088 962.7655 20.47763 -17.89447      28.82800 
1 1 1 7   15 4  o 389.8067 19.01116 29.59236       2.877968      29.51627       4.153471      29.66264       3.991483  387.6830 27.77109 388.8289 26.59268 -1.145966      38.45002 
1 1 1 7   15 5  o 768.4910 14.01139 114.8500       4.181653      112.2610       5.916556      117.4340       5.910948  759.1784 20.06768 776.5283 19.60071 -17.34991      28.05173 
1 1 1 7   15 6  o 1073.971 13.60521 224.2639       5.674479      218.7135       7.905524      230.1628       8.149904  1059.901 19.20603 1087.275 19.30124 -27.37390      27.22883 
1 1 1 7   15 7  o 825.1210 25.32480 132.7692       8.115059      123.9234       11.05629      143.1001       11.94841  795.4632 35.78997 854.7561 35.99482 -59.29291      50.75972 
1 1 1 7   15 8  o 261.4137 57.47240 14.04949       5.675732      20.26526       7.886407      7.370899       8.174751  313.1092 66.88805 210.0984 76.83121 103.0108       101.8678 
1 1 1 7   15 9  o 779.5352 26.24375 118.4647       7.944920      117.3357       11.02277      119.6853       11.46171  774.3588 36.65394 781.8918 37.74632 -7.533020      52.61459 
1 1 1 7   15 10 o 343.2181 45.09795 23.50952       5.865593      25.57055       8.172832      21.32026       8.423236  354.4406 61.61108 321.2823 69.52766 33.15823       92.89790 
1 1 1 7   15 11 o 152.7546 61.36429 2.238038       5.563235      -2.293466      7.817220      6.888280       7.918973  151.7939 67.16399 205.6312 75.55560 -53.83727      101.0923 
1 1 1 7   15 12 o 680.9603 28.45225 90.42893       7.524305      79.28059       10.10586      104.2967       11.27121  634.8129 41.21508 728.7247 39.97987 -93.91180      57.42014 
1 1 1 7   15 13 o 644.4564 29.18386 81.02940       7.304058      75.22734       9.723822      88.54175       11.06457  618.2701 40.72577 670.5461 42.71148 -52.27594      59.01575 
1 1 1 7   15 14 o 930.3450 16.99037 168.3629       6.138677      170.0784       6.953908      162.3064       13.06625  934.8512 19.15396 910.4924 36.95273 24.35883       41.62185 
1 1 1 7   15 15 o 622.5393 15.77068 75.37682       3.812810      78.26280       5.025257      71.46152       5.853200  633.9976 20.40999 605.4221 24.89471 28.57544       32.19183 
1 1 1 7   15 16 o 227.2035 35.67097 10.34976       3.043768      12.81564       3.760558      5.665751       5.182931  252.5904 39.64111 177.1425 61.56047 75.44788       73.21960 
1 1 1 7   15 17 o 114.1073 46.02119 1.163029       3.142564      0.5179129      3.775929      2.616951       5.668591  117.6229 49.24653 156.0046 62.19292 -38.38171      79.32957 
1 1 1 7   15 18 o 445.5913 24.59034 38.84742       4.238819      50.61510       5.062642      11.25464       7.752283  508.6376 25.71298 236.7467 75.10113 271.8909       79.38096 
1 1 1 7   15 19 o 374.8396 27.42422 27.59772       3.964445      32.50752       5.068943      19.86355       6.361978  406.1265 32.40856 311.7755 54.52970 94.35104       63.43346 
1 1 1 7   15 20 o 294.7202 35.38372 17.30500       3.968917      17.49911       5.016789      16.98026       6.488849  294.0670 45.39021 285.7331 60.36741 8.333862       75.52811 
1 1 1 7   15 21 o 574.4274 34.07094 65.13219       7.566639      0.000000       0.000000      65.13219       7.566639  ?        ?        574.4274 34.07094 0.000000       34.07094 
1 1 1 7   15 22 o 768.6580 21.79590 115.4495       6.506329      123.8506       9.752781      108.7118       8.733968  793.3844 31.65314 743.7414 30.23860 49.64301       43.77550 
1 1 1 7   15 23 f 483.6579 29.27791 46.18532       5.473375      44.43147       7.685874      47.98995       7.796349  470.0587 42.56472 489.0844 41.43631 -19.02573      59.40306 
1 1 1 7   15 24 o 785.2794 19.83391 120.5929       6.048678      122.2602       8.107427      118.4998       9.083851  788.5173 26.47548 774.8441 30.18754 13.67316       40.15269 
1 1 1 7   15 25 o 535.1049 32.43741 57.04521       6.708993      77.58265       12.29706      48.34144       8.005379  612.6611 52.18081 487.8889 42.68000 124.7722       67.41231 
1 1 1 7   15 26 o 212.6023 56.48054 9.811373       4.742433      12.47886       6.526925      6.828112       6.902445  236.4557 67.65524 189.4320 70.36753 47.02374       97.61568 
1 1 1 7   15 27 o 453.0758 28.99804 40.95378       5.075548      37.81272       6.981014      44.47601       7.392460  428.7917 42.48120 466.0247 41.27318 -37.23297      59.22945 
1 1 1 7   16 0  o 475.4240 25.89006 44.26755       4.762145      44.09166       5.329322      44.96444       10.60811  473.9456 29.09517 470.8681 59.32810 3.077423       66.07838 
1 1 1 7   16 1  o 345.1118 25.92041 23.38361       3.448622      26.82103       4.779894      19.65165       4.980463  368.4247 33.78358 313.1953 42.00599 55.22946       53.90578 
1 1 1 7   16 2  f 199.9177 40.00182 8.129785       2.997270      9.951893       4.191693      6.223438       4.287491  219.9752 50.17731 177.5670 55.79394 42.40814       75.03816 
1 1 1 7   16 3  o 219.5526 35.19044 9.677193       2.899136      3.265830       4.139647      15.84868       4.061467  146.0008 54.44299 281.6847 38.10523 -135.6839      66.45335 
1 1 1 7   16 4  o 171.6881 39.63534 6.016173       2.589187      7.612154       3.748127      4.559413       3.580919  192.7085 49.74357 155.1605 51.19131 37.54796       71.37907 
1 1 1 7   16 5  f 1317.664 14.74756 337.6333       7.546626      323.3846       10.29006      354.2166       11.10110  1288.668 20.56123 1348.581 21.19636 -59.91296      29.53049 
1 1 1 7   16 6  o 849.9619 13.79216 140.4497       4.552601      137.2823       6.371865      143.7527       6.506960  839.8140 19.53689 859.3814 19.49684 -19.56744      27.60103 
1 1 1 7   16 7  o 311.8896 51.91509 19.68054       6.067099      18.50572       8.131638      21.15576       9.112190  298.4652 71.15827 318.6704 74.89570 -20.20514      103.3096 
1 1 1 7   16 8  o 709.5914 27.73870 98.19637       7.644032      94.65341       10.39605      102.3662       11.27836  694.2000 38.71584 721.6559 40.40512 -27.45587      55.95972 
1 1 1 7   16 9  o 1214.822 24.16710 287.4786       11.40159      284.6703       15.76158      290.5612       16.51323  1207.081 33.62291 1219.223 34.87553 -12.14209      48.44381 
1 1 1 7   16 10 o 1050.468 24.71336 214.9770       10.08190      207.6388       13.72864      223.5672       14.85365  1030.818 34.29396 1069.329 35.76794 -38.51135      49.55220 
1 1 1 7   16 11 o 575.4191 31.21761 64.82502       6.949980      55.87922       9.211017      76.65028       10.59018  531.6500 45.03543 623.4691 44.02104 -91.81903      62.97652 
1 1 1 7   16 12 o 732.9306 27.66907 104.7742       7.875632      102.3157       10.79744      107.5692       11.51258  721.7520 38.66212 739.7551 40.22464 -18.00311      55.79230 
1 1 1 7   16 13 o 632.3058 30.30063 78.08154       7.440581      70.11385       9.901712      88.41639       11.27708  595.9419 43.07380 669.4318 43.61547 -73.48987      61.29976 
1 1 1 7   16 14 o 804.8466 16.84533 126.0228       5.265269      129.4668       5.872478      111.9054       11.88979  815.6062 18.54014 753.8970 40.76154 61.70917       44.77991 
1 1 1 7   16 15 o 100.7181 41.66498 0.5503403      2.656889      -0.5832531E-01 2.784563      6.734892       8.876093  97.35090 41.58689 209.7408 79.40200 -112.3899      89.63341 
1 1 1 7   16 16 o 375.5859 23.87901 27.61506       3.464909      30.98277       4.063415      18.64176       6.632842  397.5680 26.46922 301.2096 58.81278 96.35837       64.49467 
1 1 1 7   16 17 o 233.5421 39.09144 10.99452       3.420170      10.84127       3.823927      11.60743       7.647249  230.8405 44.26559 239.3233 74.40276 -8.482758      86.57490 
1 1 1 7   16 18 o 427.5067 23.37639 35.75475       3.866338      42.74715       4.844571      23.48828       6.416560  467.0408 26.82246 340.8987 49.94898 126.1421       56.69519 
1 1 1 7   16 19 f 301.1142 32.94600 17.99255       3.789814      17.84876       4.740844      18.24710       6.307907  297.8843 42.15802 297.4829 56.66970 0.4014282      70.63111 
1 1 1 7   16 20 o 240.4306 44.65566 11.81824       4.016102      11.38818       5.062346      12.54853       6.596813  233.5799 56.43714 244.1706 67.37167 -10.59074      87.88682 
1 1 1 7   16 21 o 686.8821 21.68607 92.17076       5.784835      85.01546       8.145646      99.45161       8.216802  657.3740 31.90693 711.6081 29.73267 -54.23407      43.61289 
1 1 1 7   16 22 f 644.6897 22.70045 81.32681       5.683464      75.97643       8.110658      86.48875       7.966545  619.3575 33.84810 662.6599 30.95646 -43.30237      45.86935 
1 1 1 7   16 23 o 331.1835 35.91030 22.01137       4.544662      25.41773       5.890617      17.00226       7.143239  353.5181 43.84756 280.1773 66.62414 73.34079       79.75829 
1 1 1 7   16 24 o 341.9356 35.33742 23.50957       4.624844      29.58629       6.069769      15.09846       7.141082  381.6221 41.63071 261.5440 69.22421 120.0781       80.77814 
1 1 1 7   16 25 o 298.5449 42.68760 18.37456       4.808344      26.26973       6.723994      10.11192       6.878697  354.3579 50.26972 216.0266 70.93441 138.3313       86.94099 
1 1 1 7   16 26 o 240.8869 61.02025 12.85122       5.714881      9.829525       10.56756      14.10023       6.794092  221.6744 85.94371 249.5945 68.16772 -27.92014      109.6958 
1 1 1 7   17 0  o 1738.704 17.14996 588.2928       11.58022      580.7268       15.93033      596.7709       16.86327  1725.762 23.76926 1749.109 24.82544 -23.34619      34.36976 
1 1 1 7   17 1  o 265.3371 33.41379 13.99238       3.366760      13.53421       4.665932      14.49002       4.862803  257.8413 48.37390 266.9389 48.70254 -9.097626      68.64381 
1 1 1 7   17 2  o 956.0701 15.30692 177.7785       5.683366      168.9648       7.754804      188.0056       8.353538  931.3467 21.44033 982.3566 21.89643 -51.00989      30.64541 
1 1 1 7   17 3  o 931.8047 15.02657 168.8485       5.437667      170.1872       7.666831      167.4935       7.713425  934.8104 21.11856 927.3439 21.41798 7.466492       30.07862 
1 1 1 7   17 4  o 391.4210 20.75447 29.91424       3.143615      34.57832       4.574373      25.74022       4.327389  420.0010 28.20856 361.6700 31.11240 58.33105       41.99648 
1 1 1 7   17 5  o 738.8209 14.78489 106.1325       4.242143      100.6076       5.949866      111.8450       6.049978  718.8233 21.31361 757.9784 20.55271 -39.15509      29.60885 
1 1 1 7   17 6  o 875.6362 19.81281 149.2220       6.737485      149.2220       6.737485      0.000000       0.000000  875.6362 19.81281 ?        ?        0.000000       19.81281 
1 1 1 7   17 7  o 630.7854 14.50475 77.35275       3.553202      70.89260       4.815269      85.07519       5.264731  603.5117 20.54503 661.1328 20.50499 -57.62115      29.02676 
1 1 1 7   17 8  o 791.2431 16.45293 121.7504       5.055697      119.0344       5.502274      136.4742       12.81107  782.2433 18.11225 834.7380 39.51911 -52.49475      43.47198 
1 1 1 7   17 9  o 707.9819 29.01643 97.78796       7.978002      101.4184       11.11045      93.92349       11.46300  718.4083 39.98118 690.6336 42.95159 27.77466       58.67992 
1 1 1 7   17 10 o 384.9254 45.13737 29.49318       6.619374      28.34079       9.048953      30.81959       9.708194  372.5009 64.91172 388.3305 66.78149 -15.82962      93.13055 
1 1 1 7   17 11 o 144.2283 60.62934 0.6839840      5.760384      10.76245       8.027258      -10.01592      8.271037  234.6071 76.60828 128.3810 61.01056 106.2261       97.93426 
1 1 1 7   17 12 o 358.0023 48.12664 25.69549       6.521643      30.57150       9.115882      20.58337       9.333977  387.2532 62.76249 313.5025 77.18142 73.75067       99.47915 
1 1 1 7   17 13 o 1058.644 25.28616 218.5838       10.39587      210.2990       14.01322      228.7244       15.50342  1036.341 34.81828 1080.218 36.95627 -43.87708      50.77478 
1 1 1 7   17 14 o 323.2909 55.04345 21.27727       6.663154      40.77246       9.497790      2.383316       9.350189  450.0844 55.51413 188.2249 78.03744 261.8595       95.76879 
1 1 1 7   17 15 o 210.6755 34.50335 8.915465       2.725199      8.915465       2.725199      0.000000       0.000000  210.6755 34.50335 ?        ?        0.000000       34.50335 
1 1 1 7   17 16 o 387.3114 20.53228 29.30552       3.077313      32.69450       3.932380      23.95109       4.942851  408.6000 24.90041 347.4167 37.21428 61.18338       44.77647 
1 1 1 7   17 17 o 173.0964 44.14703 6.138319       2.977013      4.689316       3.540726      9.633548       5.499150  156.1830 50.87309 216.5272 62.14462 -60.34422      80.31205 
1 1 1 7   17 18 o 294.6300 32.07274 17.21639       3.610507      21.78629       4.434489      8.229688       6.218565  331.2463 35.00198 204.8320 67.45389 126.4143       75.99451 
1 1 1 7   17 19 o 96.18661 43.79255 -2.149088      3.596958      -6.112316      4.311382      6.926568       6.524256  89.28873 42.86917 194.5524 68.95562 -105.2636      81.19510 
1 1 1 7   17 20 o 154.5319 54.85222 4.255733       4.129849      8.741629       5.345328      -2.387549      6.504907  205.6640 61.87772 134.4622 60.26502 71.20183       86.37549 
1 1 1 7   17 21 o 292.8322 40.44937 17.34811       4.477195      18.11051       5.988258      16.38172       6.741961  294.9412 54.28030 277.1667 63.93787 17.77448       83.87135 
1 1 1 7   17 22 o 526.7452 23.50935 54.38302       4.809159      55.08049       6.310808      53.41700       7.427080  527.4560 30.94398 517.1891 37.22676 10.26691       48.40828 
1 1 1 7   17 23 o 96.10899 45.01836 -3.899544      4.215986      -2.994383      5.479706      -5.212636      6.599965  117.7462 53.77989 122.0641 56.89592 -4.317909      78.29063 
1 1 1 7   17 24 o 412.2689 29.98322 33.85920       4.767627      35.90523       6.463823      31.41799       7.060504  420.5424 40.06211 389.6633 47.64994 30.87912       62.25343 
1 1 1 7   17 25 o 347.5049 34.64266 24.41067       4.612885      31.76044       6.141878      14.89996       6.986678  394.0193 40.72563 256.6458 68.72620 137.3735       79.88659 
1 1 1 7   17 26 o 173.3977 62.22800 5.950618       5.329075      9.722524       9.537767      4.238640       6.425628  216.5162 82.22643 166.5460 66.27222 49.97023       105.6087 
1 1 1 7   18 0  o 785.6279 17.05976 120.0775       5.204967      114.2518       7.128548      126.7301       7.617638  765.6208 23.97504 806.3022 24.32733 -40.68146      34.15584 
1 1 1 7   18 1  o 488.2748 21.48766 46.43118       4.074566      41.52953       5.625385      51.84089       5.909739  459.9169 31.68861 514.4014 29.70918 -54.48450      43.43735 
1 1 1 7   18 2  o 783.3800 16.37093 119.3627       4.980510      118.7065       6.962440      120.0505       7.127470  780.5927 22.96725 784.9525 23.38105 -4.359863      32.77451 
1 1 1 7   18 3  o 594.3644 17.62925 68.72610       4.069252      74.61369       5.890310      63.35080       5.628215  618.7569 24.51264 570.0688 25.42233 48.68811       35.31522 
1 1 1 7   18 4  o 712.8945 15.77903 98.83023       4.368513      99.97932       6.230165      97.71883       6.127142  716.4912 22.39034 708.3561 22.27298 8.135132       31.58185 
1 1 1 7   18 5  o 466.5333 18.71457 42.34957       3.390709      43.36915       4.874292      41.39358       4.719812  470.8629 26.76617 460.0082 26.53250 10.85471       37.68821 
1 1 1 7   18 6  o 614.1586 15.72822 73.34663       3.751354      69.94699       5.241060      76.91798       5.371785  599.3070 22.51862 628.5028 22.00814 -29.19580      31.48725 
1 1 1 7   18 7  o 741.1456 14.86213 106.7981       4.277723      98.79180       5.800263      116.3461       6.334163  712.3710 20.96590 773.0627 21.09826 -60.69171      29.74400 
1 1 1 7   18 8  o 227.3439 68.79962 10.41694       6.594033      8.700686       8.779031      12.63857       9.988310  222.9368 79.88435 255.5284 85.53937 -32.59151      117.0406 
1 1 1 7   18 9  o 961.5159 25.96040 180.2782       9.693839      171.5772       13.10763      190.7824       14.40192  936.1973 36.05194 986.8586 37.57832 -50.66138      52.07565 
1 1 1 7   18 10 o 278.8152 63.28523 16.08213       6.695659      18.66134       8.924553      12.76092       10.12725  298.6829 76.57825 256.2928 86.13059 42.39008       115.2506 
1 1 1 7   18 11 f 818.5081 27.66248 130.7804       8.793100      106.6551       11.43298      165.7155       13.75794  735.9622 40.15320 919.0865 38.54509 -183.1243      55.65971 
1 1 1 7   18 12 o 517.8058 35.87695 52.79128       7.170099      62.42148       10.00401      42.61884       10.28179  560.8210 46.34804 459.2789 59.01034 101.5421       75.03573 
1 1 1 7   18 13 o 414.7858 43.43160 34.22871       6.892395      28.84645       9.295587      40.80109       10.27203  374.2858 66.38142 448.6244 60.50140 -74.33859      89.81599 
1 1 1 7   18 14 o 348.9348 70.15395 25.32244       9.176967      25.32244       9.176967      0.000000       0.000000  348.9348 70.15395 ?        ?        0.000000       70.15395 
1 1 1 7   18 15 o 763.3657 40.13669 114.9197       11.85700      114.9197       11.85700      0.000000       0.000000  763.3657 40.13669 ?        ?        0.000000       40.13669 
1 1 1 7   18 16 o 241.9887 32.84774 11.68131       3.007162      11.01781       3.179958      17.29346       9.248415  234.2419 36.11761 286.1296 80.07338 -51.88766      87.84206 
1 1 1 7   18 17 f 210.0117 36.00773 8.908454       2.831052      7.942695       3.672144      10.32358       4.445108  196.1972 48.47624 223.2985 52.19533 -27.10130      71.23411 
1 1 1 7   18 18 o 375.5000 25.02183 27.69184       3.627964      33.05244       4.648804      19.34118       5.802228  409.5552 29.42422 307.5934 50.31231 101.9619       58.28476 
1 1 1 7   18 19 o 401.4504 27.91982 31.75660       4.325752      36.61502       5.613782      24.65549       6.786897  429.7858 33.90921 346.9232 51.97467 82.86261       62.05804 
1 1 1 7   18 20 o 765.0388 19.51691 114.2879       5.798592      119.2956       8.250477      109.3999       8.151318  779.5522 27.25247 746.2564 28.12624 33.29584       39.16354 
1 1 1 7   18 21 o 291.9107 36.26958 17.15397       4.023069      15.61836       5.086211      19.72035       6.575279  274.2304 49.58359 306.0016 57.43982 -31.77115      75.88059 
1 1 1 7   18 22 o 543.2457 22.50107 57.87268       4.747089      68.90856       6.463020      44.94407       6.995327  591.1458 28.15224 472.8927 38.42282 118.2531       47.63257 
1 1 1 7   18 23 o 137.2697 53.62479 2.655958       4.138250      2.274820       5.627755      3.104659       6.106219  148.6997 60.98201 158.5509 64.07883 -9.851196      88.45848 
1 1 1 7   18 24 o 515.7452 24.24223 52.44289       4.855521      53.80342       6.678066      50.91695       7.072374  517.9210 33.37937 502.2126 36.51165 15.70844       49.47002 
1 1 1 7   18 25 o 170.7003 56.41344 6.067008       4.348103      0.1426057      5.846687      13.39837       6.503992  136.1417 59.21992 243.1402 66.81745 -106.9984      89.28365 
1 1 1 7   19 0  o 1362.233 16.51343 360.9617       8.736081      343.8304       11.57058      383.6765       13.32338  1328.534 22.42614 1402.978 24.45320 -74.44470      33.17967 
1 1 1 7   19 1  o 910.1122 16.33401 161.1088       5.773187      156.4205       7.850605      166.6298       8.519375  896.0885 22.55923 924.7125 23.72319 -28.62396      32.73696 
1 1 1 7   19 2  o 394.4438 24.72300 30.44405       3.768026      25.64872       5.184395      35.81349       5.485972  359.9462 37.64485 426.7072 33.37087 -66.76102      50.30656 
1 1 1 7   19 3  o 246.4964 36.18885 12.14061       3.361138      6.726480       4.668555      17.96684       4.842977  185.0706 58.23179 299.5649 42.84955 -114.4943      72.29817 
1 1 1 7   19 4  o 551.9246 18.28122 59.27231       3.918436      68.79355       5.668195      50.55716       5.422949  594.1116 24.56681 508.3321 27.57323 85.77951       36.92982 
1 1 1 7   19 5  o 828.9011 15.29304 133.6089       4.922941      129.2143       6.807197      138.4276       7.128061  814.5752 21.51836 843.0871 21.77063 -28.51190      30.61046 
1 1 1 7   19 6  o 268.6201 29.16577 14.25031       2.993680      14.76901       4.144627      13.68450       4.328781  271.4818 40.55448 260.3349 44.40923 11.14688       60.14022 
1 1 1 7   19 7  o 1163.882 14.67249 263.4103       6.631942      252.2866       8.924831      277.1263       9.910361  1138.320 20.18866 1192.847 21.39325 -54.52649      29.41519 
1 1 1 7   19 8  o 877.5479 17.86199 149.8612       6.087354      149.5253       6.809083      151.1986       13.58611  876.3201 20.00773 877.6488 39.86084 -1.328674      44.60040 
1 1 1 7   19 9  o 918.9863 17.52026 164.3477       6.252844      166.1810       6.971956      156.8106       14.13642  923.8662 19.43200 893.3859 40.74480 30.48029       45.14135 
1 1 1 7   19 10 o 483.2867 39.33310 46.16135       7.318241      38.36242       9.767473      56.14262       11.04987  435.1973 59.33878 529.3375 54.53291 -94.14020      80.59113 
1 1 1 7   19 11 o 824.9753 28.18395 132.9463       9.029647      125.9655       12.16412      141.5142       13.47612  800.8173 39.11284 848.3511 40.90359 -47.53381      56.59433 
1 1 1 7   19 12 o 496.7946 39.54184 48.79457       7.565745      59.05905       10.39966      37.25428       11.02704  544.2045 49.75787 425.4207 69.11636 118.7838       85.16405 
1 1 1 7   19 13 o 792.7014 39.87671 123.8525       12.23680      123.8525       12.23680      0.000000       0.000000  792.7014 39.87671 ?        ?        0.000000       39.87671 
1 1 1 7   19 14 o 799.6573 39.57868 125.7966       12.29117      125.7966       12.29117      0.000000       0.000000  799.6573 39.57868 ?        ?        0.000000       39.57868 
1 1 1 7   19 15 o 540.4573 36.73204 57.66967       7.663886      56.71126       10.56389      58.73460       11.13543  531.6249 51.82612 540.4546 53.76797 -8.829651      74.67892 
1 1 1 7   19 16 o 628.5132 18.48528 76.97430       4.511992      77.36377       4.897162      74.78651       11.60677  629.9113 20.01876 611.1884 49.31993 18.72284       53.22787 
1 1 1 7   19 17 o 315.1365 22.61157 19.49667       2.748911      27.33465       4.033467      12.69852       3.756399  372.4589 28.09184 250.4767 39.95969 121.9822       48.84597 
1 1 1 7   19 18 o 131.9954 46.94946 3.043234       3.027061      0.9505106      4.009351      5.817594       4.616359  123.2838 51.10607 173.3994 58.15216 -50.11563      77.41772 
1 1 1 7   19 19 o 210.1253 45.28740 9.154354       3.586677      9.262763       4.704702      9.003910       5.542239  209.8088 56.48662 207.8011 63.11670 2.007736       84.70216 
1 1 1 7   19 20 o 329.8278 30.08036 21.61841       3.810612      26.41021       4.858797      13.96137       6.141998  363.4906 34.84683 255.0107 62.50401 108.4799       71.56153 
1 1 1 7   19 21 f 101.8854 45.36091 -1.138086      3.620146      1.826826       4.827265      -4.948660      5.472558  138.3593 56.57961 109.2890 51.22332 29.07029       76.32222 
1 1 1 7   19 22 o 572.1510 29.15395 64.94933       6.456453      64.94933       6.456453      0.000000       0.000000  572.1510 29.15395 ?        ?        0.000000       29.15395 
1 1 1 7   19 23 o 410.2444 27.14753 33.44078       4.300699      37.75030       5.920212      28.62539       6.258053  432.5756 35.55561 372.4762 44.12010 60.09943       56.66379 
1 1 1 7   19 24 o 150.7377 54.41965 4.256806       4.082233      4.970074       5.487466      3.372909       6.108665  166.0441 62.53159 158.5191 64.08265 7.525040       89.53651 
1 1 1 7   20 0  o 398.1652 40.20514 31.43733       6.131736      0.000000       0.000000      31.43733       6.131736  ?        ?        398.1652 40.20514 0.000000       40.20514 
1 1 1 7   20 1  o 575.3982 20.25181 64.47173       4.525435      73.69410       6.377200      55.11670       6.422909  614.5313 26.72133 530.0609 31.34099 84.47046       41.18601 
1 1 1 7   20 2  o 515.0375 21.28865 51.67022       4.258090      46.71409       5.883975      57.11972       6.169894  487.8578 31.22003 539.9423 29.53600 -52.08447      42.97750 
1 1 1 7   20 3  o 341.8656 27.33328 22.95592       3.598556      24.37027       5.059366      21.50780       5.119418  350.5571 37.75863 328.4259 41.03335 22.13120       55.76244 
1 1 1 7   20 4  o 194.2660 44.77993 7.723294       3.309129      11.54765       4.640791      3.767540       4.719841  237.1748 51.83208 156.1681 58.15311 81.00673       77.89960 
1 1 1 7   20 5  o 814.0742 16.09826 128.9244       5.089452      128.1635       7.077423      129.7392       7.324055  810.9528 22.47251 815.8367 23.11641 -4.883850      32.23945 
1 1 1 7   20 6  o 874.1326 15.61288 148.6379       5.300153      150.1886       7.311370      146.9206       7.694386  877.9853 21.44290 868.1867 22.82090 9.798584       31.31440 
1 1 1 7   20 7  o 368.4840 23.69159 26.58446       3.372350      27.72249       4.451280      25.05120       5.166741  375.2773 30.81454 355.2997 38.03589 19.97757       48.95166 
1 1 1 7   20 8  o 180.0118 48.99738 6.616716       3.517092      5.294898       3.736300      16.90024       10.42142  164.5442 52.13149 285.0518 86.54269 -120.5076      101.0313 
1 1 1 7   20 9  o 324.4385 21.64136 20.60399       2.711102      20.92163       2.810629      16.35571       10.27880  326.8642 22.27433 280.8141 86.08844 46.05002       88.92337 
1 1 1 7   20 10 o 967.3866 18.04185 182.1842       6.778119      181.3731       7.570254      185.4628       15.22014  964.9175 20.20190 971.0911 40.35809 -6.173584      45.13195 
1 1 1 7   20 11 o 628.5803 45.79012 78.40615       11.10105      78.40615       11.10105      0.000000       0.000000  628.5803 45.79012 ?        ?        0.000000       45.79012 
1 1 1 7   20 12 o 168.0585 73.50084 -1.292584      9.113980      -1.292584      9.113980      0.000000       0.000000  168.0585 73.50084 ?        ?        0.000000       73.50084 
1 1 1 7   20 13 o 291.5682 64.01071 17.72493       7.049411      23.09303       9.245779      10.27139       10.89467  330.9765 73.81095 241.3487 88.63027 89.62782       115.3403 
1 1 1 7   20 14 o 870.9774 28.35908 148.4528       9.592394      148.9343       13.21041      147.9158       13.95127  869.3517 39.12848 865.5822 41.50280 3.769592       57.03964 
1 1 1 7   20 15 o 262.3373 68.48487 14.55117       7.052140      15.73615       9.588757      13.15506       10.40800  272.5708 83.07141 255.9389 87.30987 16.63182       120.5150 
1 1 1 7   20 16 o 228.5848 30.64750 10.43885       2.652127      9.927410       2.745325      17.59020       10.26573  222.3664 32.77311 285.3404 85.72947 -62.97400      91.78027 
1 1 1 7   20 17 o 735.7463 20.27175 105.7070       5.792250      104.6815       6.595014      109.1668       12.11383  731.5285 23.21435 739.6052 42.35092 -8.076660      48.29602 
1 1 1 7   20 18 o 263.0290 29.24709 13.77188       2.936955      17.40681       4.159864      10.15917       4.147128  294.0859 37.25872 220.4883 49.62953 73.59763       62.05886 
1 1 1 7   20 19 o 345.8443 25.20478 23.60285       3.361955      24.27711       4.415541      22.67281       5.185861  348.8275 32.98607 334.6469 40.74399 14.18060       52.42283 
1 1 1 7   20 20 o 264.5471 35.45660 14.15643       3.551084      19.68575       4.616843      6.146617       5.556746  311.5148 39.01863 179.3141 63.62880 132.2007       74.63966 
1 1 1 7   20 21 o 326.2135 30.09846 21.25893       3.770063      21.92652       4.956901      20.34281       5.806729  328.0365 39.71935 311.8035 49.61628 16.23303       63.55629 
1 1 1 7   20 22 o 472.0005 31.21296 44.53322       5.689141      44.53322       5.689141      0.000000       0.000000  472.0005 31.21296 ?        ?        0.000000       31.21296 
1 1 1 7   20 23 o 149.9943 50.93193 4.483813       3.541615      9.232801       5.238057      0.4844877      4.806877  204.7761 61.17331 126.9581 54.44758 77.81799       81.89453 
1 1 1 7   21 0  o 1389.908 16.92376 375.9952       9.135047      364.0841       12.34991      390.3857       13.57457  1366.298 23.27505 1414.392 24.71315 -48.09448      33.94802 
1 1 1 7   21 1  o 406.9637 26.76814 32.48260       4.206991      31.30339       5.789286      33.80209       6.123978  397.4591 37.96820 413.0109 38.62936 -15.55179      54.16468 
1 1 1 7   21 2  o 1392.460 16.38474 377.3088       8.860341      368.8808       12.10028      387.0515       13.00995  1375.476 22.65240 1408.651 23.78177 -33.17542      32.84363 
1 1 1 7   21 3  o 598.6442 19.43904 69.79872       4.519304      69.82469       6.253174      69.77033       6.538920  597.9274 26.92924 597.5308 28.17849 0.3965454      38.97706 
1 1 1 7   21 4  o 467.8415 22.11249 42.66750       4.017579      43.35461       5.616985      41.94777       5.748734  469.7153 30.96589 461.7643 32.25977 7.951050       44.71665 
1 1 1 7   21 5  o 650.4578 18.06528 82.37190       4.563434      68.74896       6.004128      101.0060       7.022122  593.3995 26.05402 719.3988 25.13452 -125.9993      36.20161 
1 1 1 7   21 6  o 1021.613 15.62125 203.0629       6.197691      198.4298       8.430207      208.5124       9.142814  1008.996 21.51398 1034.081 22.76656 -25.08478      31.32360 
1 1 1 7   21 7  o 387.5752 24.27878 29.42187       3.635915      26.45556       4.720134      33.75025       5.701760  365.9340 33.58910 413.2322 35.88563 -47.29822      49.15289 
1 1 1 7   21 8  o 886.9244 15.82257 153.0603       5.449939      143.1562       7.025295      168.0285       8.636594  857.0650 21.10682 928.0505 23.96309 -70.98553      31.93317 
1 1 1 7   21 9  o 370.4229 21.11843 26.82865       3.025413      27.99766       3.159487      13.92508       10.49693  378.3748 21.59089 263.7630 87.67564 114.6118       90.29498 
1 1 1 7   21 10 o 745.2551 15.77418 108.0774       4.565410      108.0774       4.565410      0.000000       0.000000  745.2551 15.77418 ?        ?        0.000000       15.77418 
1 1 1 7   21 11 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 7   21 12 o 809.2252 29.89009 128.2510       9.393439      136.7816       13.25501      119.6446       13.31384  832.5790 40.99460 776.4427 44.33748 56.13629       60.38517 
1 1 1 7   21 13 o 698.3270 32.45590 95.74899       8.801982      101.2074       12.18543      89.79365       12.72806  713.3204 44.20516 669.7925 49.27818 43.52789       66.19997 
1 1 1 7   21 14 o 563.2474 36.82684 62.83628       8.011137      61.44354       10.95166      64.43926       11.74926  551.7343 51.71531 564.0562 54.30765 -12.32184      74.99197 
1 1 1 7   21 15 o 916.0924 28.79866 164.7225       10.24565      147.8667       13.71585      186.0021       15.41090  863.2622 40.91214 968.1650 40.98742 -104.9028      57.91176 
1 1 1 7   21 16 o 217.0351 82.39430 8.079017       9.574620      0.000000       0.000000      8.079017       9.574620  ?        ?        217.0351 82.39430 0.000000       82.39430 
1 1 1 7   21 17 o 186.0792 43.65034 7.196140       3.099910      5.398682       3.318693      19.49607       8.681387  162.4876 48.72679 298.0438 75.04933 -135.5563      89.48018 
1 1 1 7   21 18 o 294.8422 34.59674 17.46523       3.886143      18.48817       4.252625      12.28584       9.569094  302.7733 36.93232 241.5825 83.66428 61.19078       91.45331 
1 1 1 7   21 19 o 578.9730 17.35604 65.49309       3.902446      61.03764       5.461737      70.14005       5.577880  557.0227 25.24817 597.4750 24.03928 -40.45233      34.86197 
1 1 1 7   21 20 o 188.0889 46.29384 7.484943       3.358705      6.964416       4.634493      8.060764       4.874438  182.3996 58.08940 194.3033 59.23121 -11.90366      82.96213 
1 1 1 7   21 21 o 252.5853 37.14575 13.07930       3.534895      5.907453       4.791649      21.64316       5.236052  171.3913 59.21212 323.7864 42.68086 -152.3950      72.99131 
1 1 1 7   21 22 o 384.1200 26.99919 29.38810       4.001998      32.62636       5.556824      25.89847       5.768468  401.0009 36.06823 353.7783 42.86032 47.22253       56.01717 
1 1 1 7   22 0  f 1114.997 17.31705 242.0612       7.498517      236.2484       10.18998      248.9266       11.07412  1100.189 23.84941 1128.972 25.25795 -28.78235      34.73843 
1 1 1 7   22 1  o 331.1165 33.75376 21.72182       4.279719      19.18744       5.884001      24.56871       6.236219  306.9458 51.16182 349.2806 47.18223 -42.33475      69.59666 
1 1 1 7   22 2  o 600.8546 20.71793 70.36911       4.834414      68.98548       6.658484      71.91164       7.030458  593.8616 28.87102 606.1703 29.86489 -12.30878      41.53851 
1 1 1 7   22 3  o 510.5292 22.15485 50.82804       4.392557      45.61306       6.005929      56.82572       6.440881  481.4168 32.31144 537.8444 30.96703 -56.42752      44.75473 
1 1 1 7   22 4  o 988.6028 16.35204 190.2177       6.278008      189.0235       8.652283      191.5454       9.123321  984.4495 22.63129 990.7802 23.71088 -6.330688      32.77775 
1 1 1 7   22 5  o 335.2408 29.30634 22.14933       3.777113      23.21077       5.150016      20.91377       5.556391  341.2278 39.59919 322.2624 45.67565 18.96542       60.45131 
1 1 1 7   22 6  o 687.2682 17.74225 91.96883       4.735468      97.09742       6.547491      86.34364       6.857164  705.3849 23.90126 664.7907 26.56022 40.59418       35.73116 
1 1 1 7   22 7  o 940.4591 23.66313 172.5921       8.642513      0.000000       0.000000      172.5921       8.642513  ?        ?        940.4591 23.66313 0.000000       23.66313 
1 1 1 7   22 8  o 475.2472 22.90841 44.06543       4.228072      47.70660       5.184498      36.83496       7.305828  493.2852 27.16804 429.5465 44.43824 63.73868       52.08512 
1 1 1 7   22 9  o 341.0261 24.94982 22.83402       3.281390      22.83402       3.281390      0.000000       0.000000  341.0261 24.94982 ?        ?        0.000000       24.94982 
1 1 1 7   22 10 o 368.9435 23.18819 26.67600       3.305521      26.67600       3.305521      0.000000       0.000000  368.9435 23.18819 ?        ?        0.000000       23.18819 
1 1 1 7   22 11 o 275.7451 28.11649 15.04034       2.968780      14.90488       3.086888      16.70962       10.83623  274.2457 29.44454 281.0698 88.75204 -6.824097      93.50885 
1 1 1 7   22 12 o 455.7403 26.12229 40.78375       4.604065      40.48769       5.013824      42.37616       11.62803  453.5773 28.61020 450.6026 68.61495 2.974731       74.34081 
1 1 1 7   22 13 o 808.0374 30.26813 128.2814       9.498281      128.8828       12.97708      127.5875       13.93973  804.7327 41.66658 799.0043 45.10828 5.728455       61.40734 
1 1 1 7   22 14 f 228.6456 86.96488 9.072413       10.67890      0.000000       0.000000      9.072413       10.67890  ?        ?        228.6456 86.96488 0.000000       86.96488 
1 1 1 7   22 15 o 326.1042 79.92151 23.49865       10.04276      0.000000       0.000000      23.49865       10.04276  ?        ?        326.1042 79.92151 0.000000       79.92151 
1 1 1 7   22 16 o 442.8396 45.10012 39.77034       7.648004      15.06479       10.63702      66.21066       11.00414  263.1475 88.27254 569.7758 50.24511 -306.6284      101.5707 
1 1 1 7   22 17 o 633.1468 19.27177 78.39459       4.738643      76.76162       5.196424      86.45687       11.54633  626.0092 21.37450 652.8492 45.83152 -26.83997      50.57072 
1 1 1 7   22 18 o 240.6394 31.60060 11.66875       2.881780      12.34081       3.026601      5.146005       9.429008  247.3957 32.27031 194.7331 79.29018 52.66264       85.60552 
1 1 1 7   22 19 o 326.3100 31.80009 21.36853       3.978618      21.22256       4.358982      22.09712       9.738617  324.0154 35.20769 308.2125 80.48785 15.80295       87.85144 
1 1 1 7   22 20 o 211.3799 38.05936 9.259677       3.009402      7.760364       4.260943      10.75196       4.250948  189.6520 54.78175 223.8819 50.13867 -34.22998      74.26255 
1 1 1 7   22 21 o 189.6219 45.91949 7.687201       3.345561      13.09115       4.658310      1.930583       4.807912  246.8851 50.29319 136.7584 56.25763 110.1267       75.46075 
1 1 1 7   23 0  o 658.2360 26.10378 84.69246       6.672875      82.07506       7.463362      95.12206       14.89818  647.3569 29.68676 687.2507 56.31455 -39.89380      63.66029 
1 1 1 7   23 1  o 400.1511 29.71108 31.52448       4.584157      30.45102       6.308336      32.72562       6.672975  390.4923 42.27303 404.7531 43.11605 -14.26077      60.38214 
1 1 1 7   23 2  o 486.6099 24.59806 46.36109       4.633384      42.56731       6.381028      50.59221       6.738790  464.0724 35.67933 506.4360 34.46837 -42.36365      49.60930 
1 1 1 7   23 3  o 882.0779 17.56424 151.5260       6.016781      145.8140       8.278054      157.9231       8.760450  864.0613 24.66924 899.1351 25.08843 -35.07373      35.18523 
1 1 1 7   23 4  o 914.5918 17.31072 162.8908       6.148517      158.2408       8.380070      168.3129       9.049045  900.2627 23.96902 928.2260 25.10273 -27.96326      34.70823 
1 1 1 7   23 5  o 500.5691 30.41264 49.26625       5.884151      49.26625       5.884151      0.000000       0.000000  500.5691 30.41264 ?        ?        0.000000       30.41264 
1 1 1 7   23 6  o 467.1250 23.51529 42.70789       4.252250      46.50657       5.685717      37.88636       6.405624  486.2852 30.25687 436.9996 38.12625 49.28561       48.67329 
1 1 1 7   23 7  o 814.4689 18.53510 129.2620       5.862697      128.1456       7.214026      131.4335       10.06109  810.1921 22.92776 818.5394 31.65028 -8.347290      39.08225 
1 1 1 7   23 8  f 559.6906 21.35519 61.12434       4.641726      59.95881       5.535055      63.88657       8.520996  553.7186 25.73978 567.7421 38.88073 -14.02350      46.62882 
1 1 1 7   23 9  o 515.0833 18.97099 51.72938       3.794857      52.88320       4.000721      41.37560       11.98447  520.7025 19.78430 443.9752 71.97154 76.72736       74.64128 
1 1 1 7   23 10 o 551.5424 17.75882 59.29692       3.803829      57.57484       3.972923      78.24507       13.17854  543.3448 18.82811 621.1133 55.21034 -77.76855      58.33249 
1 1 1 7   23 11 o 388.6928 22.04364 29.61835       3.313801      28.16438       3.452828      46.59052       11.79684  378.7375 23.59232 472.6190 66.07977 -93.88156      70.16505 
1 1 1 7   23 12 o 672.5444 16.18909 88.15816       4.228354      89.08264       4.473454      80.40840       12.95205  675.9253 17.04183 628.7582 53.55315 47.16711       56.19933 
1 1 1 7   23 13 o 363.0708 35.10847 26.31400       4.888503      26.43116       5.417914      25.80090       11.33855  362.7193 39.07913 339.3492 85.94429 23.37003       94.41187 
1 1 1 7   23 14 o 94.95787 43.42706 -2.236593      3.587596      -2.582024      3.867832      -0.1085857     9.600045  97.55141 44.78841 173.2716 75.61710 -75.72020      87.88599 
1 1 1 7   23 15 o 212.5872 39.63768 9.297951       3.152066      9.427546       3.329961      8.181330       9.774573  213.5570 41.64702 215.7228 82.92620 -2.165863      92.79671 
1 1 1 7   23 16 o 160.2869 46.21325 5.336473       3.034806      4.274179       3.200247      14.82114       9.562518  147.0987 48.38728 257.4191 83.59228 -110.3204      96.58674 
1 1 1 7   23 17 o 234.4634 37.32292 11.25890       3.284510      10.08998       3.496542      20.02950       9.577686  220.1154 42.44192 294.2607 81.17261 -74.14526      91.59863 
1 1 1 7   23 18 o 455.8968 24.50151 41.09112       4.322069      42.86177       4.786693      33.27562       10.05650  464.9023 26.62292 386.7765 69.50629 78.12585       74.43053 
1 1 1 7   23 19 o 183.6020 42.87501 7.136869       3.001690      8.727794       3.188885      -5.232750      8.891852  203.7685 41.70187 143.0660 66.46926 60.70253       78.46789 
1 1 1 7   23 20 o 277.6611 38.57479 15.89428       4.047183      15.01109       4.444342      20.18378       9.794559  267.2850 44.37195 288.1301 83.00745 -20.84509      94.12283 
1 1 1 7   24 0  o 631.5237 27.86871 78.11470       6.834938      77.92569       7.657550      78.85536       15.15847  630.0515 31.29578 620.4710 63.81785 9.580505       71.07843 
1 1 1 7   24 1  o 188.4874 63.84823 6.811257       5.565555      8.324781       6.144141      -0.1085257     13.13750  204.7188 67.03130 203.8931 88.73091 0.8256226      111.2042 
1 1 1 7   24 2  f 550.6685 23.09961 59.22956       4.939953      59.94904       6.821371      58.43612       7.163476  551.6260 31.97911 544.0672 34.07527 7.558838       46.73101 
1 1 1 7   24 3  o 305.6236 36.74944 18.66209       4.274357      26.30178       5.922234      10.35521       6.175418  361.9475 42.97148 223.4123 66.34940 138.5352       79.04929 
1 1 1 7   24 4  o 440.4695 26.46288 38.10572       4.505696      38.63906       5.938946      37.38244       6.916136  441.7168 34.90521 432.6429 41.67852 9.073883       54.36426 
1 1 1 7   24 5  o 552.7468 23.16809 59.69817       4.973298      57.36578       6.149612      64.10725       8.455149  540.0343 29.43339 568.4462 38.52797 -28.41187      48.48431 
1 1 1 7   24 6  o 258.6455 43.50145 13.62376       4.214452      8.662052       5.092029      24.41429       7.509250  204.6444 60.11051 343.3690 58.40414 -138.7246      83.81120 
1 1 1 7   24 7  o 1051.438 18.14678 215.5627       7.409876      215.5421       9.099244      215.6031       12.76710  1050.272 22.30876 1047.209 31.39286 3.063110       38.51224 
1 1 1 7   24 8  o 376.6807 28.21145 27.99462       4.096955      26.54757       5.074821      30.70276       6.942496  364.8563 36.29730 389.4367 46.84371 -24.58041      59.26067 
1 1 1 7   24 9  o 528.5544 24.06953 54.69064       4.940664      53.44247       5.423046      60.78515       11.98328  521.2961 26.87890 544.3201 57.56154 -23.02399      63.52800 
1 1 1 7   24 10 f 487.7677 26.39179 46.81313       4.980710      43.10513       5.437138      66.15829       12.41900  467.0500 30.13719 567.5278 57.12337 -100.4778      64.58584 
1 1 1 7   24 11 o 336.0934 25.29202 22.28087       3.276996      24.53205       3.406910      -5.559620      11.98102  352.8077 25.02777 173.1450 79.24902 179.6627       83.10714 
1 1 1 7   24 12 o 285.9510 30.32842 16.30096       3.316569      14.65204       3.469331      33.79763       11.30117  270.0637 33.82061 392.5078 76.88957 -122.4441      83.99905 
1 1 1 7   24 13 o 697.4051 16.85118 94.94238       4.563975      94.64047       4.894236      96.95562       12.63848  696.0123 18.10673 690.8905 47.39047 5.121826       50.73175 
1 1 1 7   24 14 o 281.8404 24.25007 15.71950       2.628419      14.98916       2.719698      26.05523       10.23127  274.8263 25.78347 339.7108 79.03893 -64.88452      83.13807 
1 1 1 7   24 15 o 463.5282 17.45160 42.00510       3.141516      42.78080       3.300083      34.51017       10.25797  467.6554 18.17067 396.8814 69.06215 70.77393       71.41256 
1 1 1 7   24 16 f 181.0625 48.05282 6.967308       3.434989      5.197011       3.675248      19.19472       9.658969  159.5834 51.82315 286.0132 82.44054 -126.4298      97.37598 
1 1 1 7   24 17 o 60.80241 29.39931 -3.308184      2.114747      -3.069666      2.179240      -7.159976      8.757416  63.41556 30.45528 136.0283 64.08288 -72.61270      70.95167 
1 1 1 7   24 18 o 302.6851 24.43621 18.21328       2.847964      18.12243       2.985962      19.12860       9.477686  301.5408 25.74494 281.9220 81.77985 19.61877       85.73650 
1 1 1 7   25 0  o 315.7188 39.52443 20.06011       4.739921      23.60395       6.547462      16.15768       6.870739  339.1331 51.31773 275.3201 65.25571 63.81305       83.01697 
1 1 1 7   25 1  o 225.5487 62.50432 10.73859       5.664236      9.776858       6.230522      15.31942       13.59784  216.9369 67.11134 274.5652 99.29088 -57.62831      119.8441 
1 1 1 7   25 2  o 398.9662 37.21041 31.75610       5.698858      33.44522       6.289819      24.01316       13.46669  408.6527 40.15134 326.0945 98.23827 82.55814       106.1268 
1 1 1 7   25 3  o 365.4213 33.47696 26.54424       4.698006      29.51390       6.090604      22.18165       7.382074  383.1744 41.59759 325.1782 60.68813 57.99622       73.57587 
1 1 1 7   25 4  o 549.4774 24.37677 59.12300       5.201804      57.56913       6.572554      61.72813       8.510212  539.8193 31.48814 556.3160 39.64992 -16.49677      50.63219 
1 1 1 7   25 5  o 407.8779 30.42608 32.91545       4.784842      37.49606       5.947484      24.51081       8.056214  434.0532 35.59599 340.8673 63.18468 93.18588       72.52158 
1 1 1 7   25 6  o 600.4460 21.39595 70.49083       4.989230      68.40664       6.451751      73.59138       7.869161  590.0250 28.15654 609.6627 33.36268 -19.63776      43.65615 
1 1 1 7   25 7  o 462.8375 25.16618 42.12951       4.506490      35.95378       5.596923      53.51360       7.598961  425.1273 34.18932 517.8220 38.05387 -92.69467      51.15668 
1 1 1 7   25 8  o 280.6841 38.52362 15.93870       4.088506      21.86171       5.041523      4.559856       6.987788  328.9256 40.31087 177.6425 69.60362 151.2831       80.43401 
1 1 1 7   25 9  o 463.9644 26.95007 42.45930       4.835008      41.85217       5.246730      45.87859       12.45133  459.9090 29.53186 462.0439 71.71616 -2.134857      77.55862 
1 1 1 7   25 10 o 678.9260 17.98852 90.03325       4.742921      91.42278       5.088584      80.83539       13.09202  683.8749 19.15986 626.5565 54.34269 57.31836       57.62142 
1 1 1 7   25 11 o 259.3127 34.93170 13.58776       3.428298      13.09893       3.592772      18.56306       11.46192  253.7557 37.59483 284.5671 91.43031 -30.81139      98.85784 
1 1 1 7   25 12 o 295.0019 28.31552 17.33068       3.204118      18.32003       3.356626      7.179393       10.75199  303.2347 28.85112 213.1325 85.41859 90.10216       90.15943 
1 1 1 7   25 13 o 204.2778 35.57254 8.554784       2.719507      8.156463       2.814021      14.18741       10.58197  198.7271 37.84431 252.1039 87.94260 -53.37675      95.73971 
1 1 1 7   25 14 o 569.7886 20.44454 63.69407       4.523963      62.44405       4.905843      70.79843       11.69548  563.5868 22.41428 582.5861 52.24802 -18.99933      56.85293 
1 1 1 7   25 15 o 349.6658 21.91619 24.13919       2.961052      25.77968       3.121783      9.427527       9.348593  361.2753 22.36023 215.5763 81.51754 145.6990       84.52863 
1 1 1 7   25 16 o 233.4488 28.73181 10.98595       2.549870      12.09904       2.655097      -2.227626      9.147979  245.2391 28.40386 155.5208 70.42635 89.71831       75.93846 
1 1 1 7   25 17 o 436.1613 17.75000 37.29855       3.006584      37.11193       3.145339      39.27480       10.23553  434.8575 18.62484 420.3482 64.78200 14.50928       67.40617 
1 1 1 7   26 0  o 488.7840 28.15835 47.17950       5.322438      55.67295       7.317622      37.63896       7.755584  528.4387 35.86962 429.7279 47.25265 98.71082       59.32489 
1 1 1 7   26 1  o 173.1785 59.53210 5.794658       4.840654      2.710891       6.163102      10.76024       7.820664  158.2041 64.22305 226.9353 75.68965 -68.73123      99.26492 
1 1 1 7   26 2  o 547.2829 32.79594 59.43879       6.938308      59.43879       6.938308      0.000000       0.000000  547.2829 32.79594 ?        ?        0.000000       32.79594 
1 1 1 7   26 3  o 801.5651 21.27328 125.7445       6.622183      126.2666       8.276035      124.8152       11.04099  801.4655 26.58946 792.9046 35.85577 8.560852       44.63895 
1 1 1 7   26 4  o 193.9961 54.74382 7.918322       4.304063      3.779601       5.639635      13.69141       6.660732  161.1883 62.70309 251.2333 67.02757 -90.04498      91.78438 
1 1 1 7   26 5  o 351.1407 34.01822 24.65467       4.580790      24.98366       5.971129      24.18410       7.141191  349.8165 44.99611 339.6692 56.09424 10.14737       71.91116 
1 1 1 7   26 6  o 487.1577 25.14465 46.74157       4.740886      44.70033       6.113012      49.82215       7.509739  473.8098 33.43641 498.1178 39.13593 -24.30801      51.47440 
1 1 1 7   26 7  f 430.5652 27.63674 36.66925       4.596779      33.96849       5.674165      41.82640       7.840878  411.7579 35.84145 453.3505 45.13516 -41.59256      57.63499 
1 1 1 7   26 8  o 127.3458 51.29860 1.749325       3.899527      4.239116       4.688076      -3.841630      7.025160  156.8262 58.04417 132.1430 60.55637 24.68317       83.88206 
1 1 1 7   26 9  f 437.2081 31.56323 38.07840       5.323146      42.60436       6.013746      21.69788       11.44072  461.7582 33.76954 303.9699 90.31696 157.7883       96.42372 
1 1 1 7   26 10 o 171.2266 48.96845 6.159754       3.420145      5.277956       3.598335      14.40744       11.00483  160.7516 51.18443 254.3438 89.61955 -93.59218      103.2062 
1 1 1 7   26 11 o 170.1784 47.32777 6.107628       3.241480      5.150383       3.392555      16.14310       10.98461  158.2025 49.61772 263.9513 89.69746 -105.7488      102.5064 
1 1 1 7   26 12 o 356.1187 24.72765 25.12597       3.398640      25.54136       3.563905      20.95612       11.29165  358.7643 25.75061 293.9269 90.25062 64.83740       93.85237 
1 1 1 7   26 13 o 261.0700 29.58243 13.71289       2.946352      13.93941       3.079250      11.25725       10.13841  262.8861 30.74181 228.6030 85.20974 34.28314       90.58564 
1 1 1 7   26 14 o 191.6559 38.49029 7.679302       2.765355      8.071457       2.904955      3.890805       9.029084  196.2900 39.47588 181.2717 76.03848 15.01831       85.67494 
1 1 1 7   26 15 o 523.5618 20.56513 53.92682       4.181456      52.08309       4.526736      64.64825       10.91599  513.8116 22.68576 552.9323 51.42438 -39.12073      56.20596 
1 1 1 7   27 0  o 588.8367 43.74348 70.43409       9.931684      0.000000       0.000000      70.43409       9.931684  ?        ?        588.8367 43.74348 0.000000       43.74348 
1 1 1 7   27 1  o 559.3239 29.88616 62.07099       6.468245      55.14112       8.712449      70.58128       9.654944  520.8962 43.46563 590.3293 42.39645 -69.43304      60.71837 
1 1 1 7   27 2  o 229.9669 53.36532 11.28341       4.673992      9.511860       6.332290      13.40384       6.927830  211.2616 67.96667 246.2996 69.43609 -35.03807      97.16397 
1 1 1 7   27 3  o 362.0493 41.32705 26.68275       5.706602      28.07990       6.377878      21.07400       12.77877  369.8293 45.35727 297.5718 96.63290 72.25751       106.7483 
1 1 1 7   27 4  o 385.8802 31.88475 29.73849       4.735389      33.08167       6.369769      25.60808       7.080117  403.5157 41.22665 348.9803 53.98370 54.53540       67.92551 
1 1 1 7   27 5  o 667.3239 21.00484 87.31684       5.443573      86.44121       7.247367      88.45032       8.245633  661.3981 28.21560 667.4737 31.80987 -6.075623      42.52044 
1 1 1 7   27 6  o 336.2965 34.97387 22.79361       4.500845      18.19738       5.651439      30.76446       7.442353  293.8486 51.39472 383.9786 51.18325 -90.13004      72.53373 
1 1 1 7   27 7  o 230.4669 53.90017 11.41541       4.738153      17.93985       6.052780      1.090162       7.614357  289.4388 55.87164 159.2928 68.42685 130.1460       88.33954 
1 1 1 7   27 8  o 485.4123 27.10136 46.72068       5.088530      46.64658       6.625331      46.82726       7.945863  481.4044 35.69224 478.4640 43.22947 2.940369       56.06000 
1 1 1 7   27 9  o 386.5446 36.84406 30.27790       5.463941      30.15933       6.196323      30.69242       11.58556  383.2711 42.33614 360.0759 84.33218 23.19516       94.36242 
1 1 1 7   27 10 o 362.0539 26.39117 26.06961       3.685182      25.52557       3.892514      30.77229       11.44424  357.6217 28.25730 359.6847 83.52954 -2.062988      88.17970 
1 1 1 7   27 11 o 115.9905 46.28064 1.639670       3.141482      1.132828       3.315700      6.086031       9.820674  113.5186 46.71061 197.1376 80.66837 -83.61900      93.21623 
1 1 1 7   27 12 o 167.2827 46.50933 5.976399       3.130803      7.119199       3.300461      -4.289822      9.892243  182.1510 46.49817 153.6661 70.94148 28.48492       84.82201 
1 1 1 7   27 13 o 162.4996 45.04425 5.633946       2.941293      5.702991       3.097960      5.002632       9.367719  163.4073 46.56093 187.4808 77.95114 -24.07355      90.79813 
1 1 1 7   28 0  o 424.4480 40.41238 36.79034       6.580993      21.61115       11.90379      43.47190       7.897680  295.6956 92.97581 459.1376 44.86569 -163.4420      103.2348 
1 1 1 7   28 1  o 362.9435 36.14678 26.69528       5.027132      24.31421       6.863428      29.45120       7.383950  337.7303 54.15937 373.3015 52.37451 -35.57114      75.34140 
1 1 1 7   28 2  o 125.9600 53.51295 0.6956975      4.564805      -3.510816      6.209641      5.641639       6.733329  122.9377 56.55687 179.2649 68.84680 -56.32713      89.09861 
1 1 1 7   28 3  o 637.5754 24.66198 80.21239       6.106431      83.26984       9.536607      78.08769       7.949916  641.3187 38.46831 624.4180 32.89989 16.90070       50.61831 
1 1 1 7   28 4  o 182.4335 62.88975 6.844335       5.403923      6.371052       5.951380      9.067590       12.89888  180.5826 65.62868 226.0204 92.46454 -45.43785      113.3879 
1 1 1 7   28 5  o 154.1753 56.35866 4.374257       4.398048      5.680105       5.791741      2.595648       6.759321  173.9030 64.48573 159.0478 66.17934 14.85512       92.40192 
1 1 1 7   28 6  o 457.9014 30.57323 41.96644       5.405520      42.32188       7.393304      41.55822       7.923307  453.6890 42.45525 447.2447 46.28761 6.444305       62.80917 
1 1 1 7   28 7  o 168.0265 59.64027 5.600154       4.882268      4.869771       6.235497      6.757348       7.848713  169.6438 65.94909 191.2936 74.09454 -21.64977      99.19315 
1 1 1 7   28 8  o 247.9569 47.04355 13.08180       4.364333      16.27013       5.435026      7.293703       7.322985  274.3530 52.92882 192.1220 72.25925 82.23102       89.57042 
1 1 1 7   28 9  o 132.1791 54.66784 1.691843       4.572552      -0.3342749     5.030359      11.32783       10.97021  123.9529 54.39810 227.5567 87.74969 -103.6038      103.2432 
1 1 1 7   28 10 o 260.3572 35.63280 13.92457       3.508304      15.65502       3.743092      1.414546       10.06420  276.2614 35.72538 174.8692 76.83869 101.3922       84.73775 
1 1 1 7   28 11 o 194.2129 44.11057 8.074351       3.251159      7.998602       3.481795      8.589962       9.083964  192.3858 47.00299 205.2108 79.64868 -12.82492      92.48347 
1 1 1 7   29 0  o 271.0684 57.52556 16.29478       5.868331      20.35785       11.77276      14.95146       6.769262  280.0108 92.84027 254.1105 67.46539 25.90031       114.7645 
1 1 1 7   29 1  o 170.1178 62.40374 5.685184       5.398851      18.44475       11.11634      1.746515       6.176162  269.3710 90.24006 147.3634 62.40681 122.0076       109.7173 
1 1 1 7   29 2  o 621.2526 33.19772 77.86259       7.980486      0.000000       0.000000      77.86259       7.980486  ?        ?        621.2526 33.19772 0.000000       33.19772 
1 1 1 7   29 3  o 328.5237 36.98762 22.13781       4.636923      20.83747       6.505369      23.48076       6.611109  308.2824 56.41597 329.4637 53.50573 -21.18137      77.75361 
1 1 1 7   29 4  f 257.7646 64.40298 15.18445       6.428556      12.79351       7.534874      21.58069       12.32405  233.3070 74.04380 286.4313 94.99014 -53.12425      120.4392 
1 1 1 7   29 5  o 145.7607 61.57198 1.783227       5.987667      -0.3072218     6.810664      8.898685       12.56525  141.8739 62.73698 217.9056 90.41374 -76.03169      110.0481 
1 1 1 7   29 6  o 161.7976 68.24190 2.728716       7.337125      0.000000       0.000000      2.728716       7.337125  ?        ?        161.7976 68.24190 0.000000       68.24190 
1 1 1 7   29 7  o 110.6964 49.38269 -1.008211      4.313765      -1.139739      5.317672      -0.7550775     7.377098  122.1945 54.64724 144.5771 64.53199 -22.38258      84.56181 
1 1 1 7   29 8  o 380.4138 31.35084 29.24722       4.590374      33.04905       5.862238      23.22131       7.380381  400.8972 38.11172 321.5478 61.34078 79.34949       72.21631 
1 1 1 7   30 0  o 516.7079 27.06794 53.48181       5.412712      62.04468       7.720566      45.20491       7.590552  550.0178 36.34964 464.5758 42.54405 85.44202       55.95795 
1 1 1 7   30 1  o 425.6178 42.17811 37.90637       6.879848      44.23475       12.49780      35.15486       8.240867  426.0199 78.42968 400.5860 54.37781 25.43390       95.43668 
1 1 1 7   30 2  o 216.6147 67.18580 10.99120       6.239770      0.000000       0.000000      10.99120       6.239770  ?        ?        216.6147 67.18580 0.000000       67.18580 
1 1 1 7   30 3  o 141.0593 56.62445 2.856463       4.733215      0.7516341      7.336079      4.357515       6.195174  150.0177 65.76826 162.5299 64.94466 -12.51219      92.42983 
1 1 1 7   30 4  o 356.0156 36.86843 26.12197       5.023555      27.66708       7.798571      25.02610       6.567702  351.5876 59.22007 339.5589 51.41349 12.02866       78.42426 
1 1 1 8   0  0  o 46.60862 33.20439 -3.797521      2.640159      -3.797521      2.640159      -3.797521      2.640159  46.60862 33.20439 46.60862 33.20439 0.000000       0.000000 
1 1 1 8   0  1  o 462.2869 20.65233 41.79928       3.690890      41.79928       3.690890      41.79928       3.690890  462.2869 20.65233 462.2869 20.65233 0.000000       0.000000 
1 1 1 8   0  2  o 707.2519 18.43682 97.43179       5.056157      97.43179       5.056157      97.43179       5.056157  707.2519 18.43682 707.2519 18.43682 0.000000       0.000000 
1 1 1 8   0  3  o 230.2764 44.73112 11.44367       3.566787      11.44367       3.566787      11.44367       3.566787  230.2764 44.73112 230.2764 44.73112 0.000000       0.000000 
1 1 1 8   0  4  o 421.9384 25.10933 35.01376       4.081092      35.01376       4.081092      35.01376       4.081092  421.9384 25.10933 421.9384 25.10933 0.000000       0.000000 
1 1 1 8   0  5  f 402.2307 30.45122 32.06678       4.694038      32.06678       4.694038      32.06678       4.694038  402.2307 30.45122 402.2307 30.45122 0.000000       0.000000 
1 1 1 8   0  6  o 1231.710 20.73045 295.4107       9.909866      295.4107       9.909866      295.4107       9.909866  1231.710 20.73045 1231.710 20.73045 0.000000       0.000000 
1 1 1 8   0  7  f 798.1204 21.06307 124.2305       6.518294      124.2305       6.518294      124.2305       6.518294  798.1204 21.06307 798.1204 21.06307 0.000000       0.000000 
1 1 1 8   0  8  o 730.5811 21.39676 104.1823       6.058999      104.1823       6.058999      104.1823       6.058999  730.5811 21.39676 730.5811 21.39676 0.000000       0.000000 
1 1 1 8   0  9  o 372.4846 31.31886 27.67118       4.456772      27.67118       4.456772      27.67118       4.456772  372.4846 31.31886 372.4846 31.31886 0.000000       0.000000 
1 1 1 8   0  10 o 463.5302 26.58817 42.32650       4.750212      42.32650       4.750212      42.32650       4.750212  463.5302 26.58817 463.5302 26.58817 0.000000       0.000000 
1 1 1 8   0  11 o 65.38136 46.76358 -8.246615      5.440936      -8.246615      5.440936      -8.246615      5.440936  65.38136 46.76358 65.38136 46.76358 0.000000       0.000000 
1 1 1 8   0  12 o 821.0021 30.35920 132.1874       9.649678      132.1874       9.649678      132.1874       9.649678  821.0021 30.35920 821.0021 30.35920 0.000000       0.000000 
1 1 1 8   0  13 o 1000.525 21.06157 195.1400       8.175454      195.1400       8.175454      195.1400       8.175454  1000.525 21.06157 1000.525 21.06157 0.000000       0.000000 
1 1 1 8   0  14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 8   0  15 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 8   0  16 o 193.5589 67.84197 9.646188       4.620692      9.646188       4.620692      9.646188       4.620692  193.5589 67.84197 193.5589 67.84197 0.000000       0.000000 
1 1 1 8   0  17 o 746.7572 33.15378 109.3703       9.571668      109.3703       9.571668      109.3703       9.571668  746.7572 33.15378 746.7572 33.15378 0.000000       0.000000 
1 1 1 8   0  18 o 187.3116 93.02148 10.33961       8.181279      10.33961       8.181279      10.33961       8.181279  187.3116 93.02148 187.3116 93.02148 0.000000       0.000000 
1 1 1 8   0  19 o 550.1221 29.58809 59.47694       6.279486      59.47694       6.279486      59.47694       6.279486  550.1221 29.58809 550.1221 29.58809 0.000000       0.000000 
1 1 1 8   0  20 o 144.1787 75.22902 6.040397       5.508382      6.040397       5.508382      6.040397       5.508382  144.1787 75.22902 144.1787 75.22902 0.000000       0.000000 
1 1 1 8   0  21 o 664.7123 27.79213 86.59963       7.145850      86.59963       7.145850      86.59963       7.145850  664.7123 27.79213 664.7123 27.79213 0.000000       0.000000 
1 1 1 8   0  22 o 682.9996 28.48910 91.49036       7.526722      91.49036       7.526722      91.49036       7.526722  682.9996 28.48910 682.9996 28.48910 0.000000       0.000000 
1 1 1 8   0  23 o 595.7644 44.48750 70.94997       10.16102      70.94997       10.16102      70.94997       10.16102  595.7644 44.48750 595.7644 44.48750 0.000000       0.000000 
1 1 1 8   0  24 o 1208.270 25.24597 285.2688       11.83466      285.2688       11.83466      285.2688       11.83466  1208.270 25.24597 1208.270 25.24597 0.000000       0.000000 
1 1 1 8   0  25 o 495.9413 38.38082 49.28883       7.290359      49.28883       7.290359      49.28883       7.290359  495.9413 38.38082 495.9413 38.38082 0.000000       0.000000 
1 1 1 8   0  26 o 110.3512 70.14230 1.333159       6.567868      1.333159       6.567868      1.333159       6.567868  110.3512 70.14230 110.3512 70.14230 0.000000       0.000000 
1 1 1 8   0  27 o 164.3276 84.27937 8.606116       6.832525      8.606116       6.832525      8.606116       6.832525  164.3276 84.27937 164.3276 84.27937 0.000000       0.000000 
1 1 1 8   0  28 o 357.0310 56.56119 27.87641       7.253292      27.87641       7.253292      27.87641       7.253292  357.0310 56.56119 357.0310 56.56119 0.000000       0.000000 
1 1 1 8   0  29 o 293.8611 73.69046 21.32148       7.274342      21.32148       7.274342      21.32148       7.274342  293.8611 73.69046 293.8611 73.69046 0.000000       0.000000 
1 1 1 8   0  30 o 163.4220 83.52653 9.373489       6.697792      9.373489       6.697792      9.373489       6.697792  163.4220 83.52653 163.4220 83.52653 0.000000       0.000000 
1 1 1 8   1  0  o 441.1303 15.14523 37.84338       2.594603      37.45201       3.585598      38.27356       3.759201  438.5340 21.05379 443.2686 21.83738 -4.734680      30.33370 
1 1 1 8   1  1  o 343.4591 17.65154 23.01351       2.346472      23.02737       3.335279      22.99993       3.301798  342.7274 25.23605 342.5531 24.99204 0.1742249      35.51704 
1 1 1 8   1  2  o 451.8622 14.79296 39.70552       2.595906      37.43855       3.657756      42.00605       3.684725  438.4148 21.48332 464.4579 20.42823 -26.04306      29.64533 
1 1 1 8   1  3  o 736.2572 13.46379 105.3914       3.849682      105.7753       4.529377      104.3924       7.306486  737.4203 15.81596 731.5387 25.71836 5.881653       30.19236 
1 1 1 8   1  4  o 964.9592 19.58558 181.3127       7.339616      181.3127       7.339616      0.000000       0.000000  964.9592 19.58558 ?        ?        0.000000       19.58558 
1 1 1 8   1  5  o 405.8842 19.70808 32.08626       3.106521      33.31018       6.632731      31.74233       3.516008  409.2270 42.34770 402.8899 22.56239 6.337128       47.98322 
1 1 1 8   1  6  o 297.8015 26.71105 17.46267       3.056359      20.56808       4.450155      14.69005       4.204948  321.6851 36.25398 270.0954 41.40884 51.58966       55.03674 
1 1 1 8   1  7  o 464.0869 18.80506 41.96096       3.389238      41.90231       4.915416      42.01411       4.679494  462.0837 27.51582 462.9403 26.13515 -0.8565674     37.94952 
1 1 1 8   1  8  o 806.3481 14.71974 126.5360       4.609468      126.2741       6.460818      126.8074       6.578313  804.6395 20.67560 806.2795 21.00879 -1.639954      29.47626 
1 1 1 8   1  9  o 512.0968 18.07660 51.10416       3.594983      49.24268       4.987496      53.11713       5.186488  501.1247 25.71424 521.1461 25.62630 -20.02136      36.30330 
1 1 1 8   1  10 o 583.8290 18.74962 66.44693       4.251148      63.24955       5.202208      72.87399       7.375593  568.9664 23.54361 608.5037 31.31705 -39.53729      39.17983 
1 1 1 8   1  11 o 447.7040 21.91230 39.12267       3.809841      35.94831       4.742148      44.90153       6.398364  427.4258 28.73541 476.5405 34.81426 -49.11469      45.14151 
1 1 1 8   1  12 o 225.3306 40.66420 10.31463       3.427514      11.31924       6.198825      9.872231       4.113537  233.0885 65.67057 218.6440 49.58605 14.44456       82.28852 
1 1 1 8   1  13 o 93.38239 42.16389 -1.681793      3.251339      4.288176       5.564958      -4.775778      4.006222  167.4035 62.98561 90.02194 42.68791 77.38152       76.08840 
1 1 1 8   1  14 o 222.5582 42.55855 10.06361       3.544337      10.56677       6.263320      9.826576       4.298864  227.2437 66.64304 218.5228 51.49915 8.720932       84.22266 
1 1 1 8   1  15 o 582.9237 17.61148 66.11408       3.986901      62.47014       5.605054      69.84586       5.672204  566.0094 25.49930 598.5972 24.39997 -32.58777      35.29267 
1 1 1 8   1  16 o 150.3125 51.94095 4.040992       3.687183      9.260391       6.455510      1.513793       4.492002  216.6938 68.51050 135.1112 54.83587 81.58260       87.75341 
1 1 1 8   1  17 o 238.9409 46.35900 11.57882       4.146632      3.606934       7.532477      15.04520       4.967009  180.8449 71.81919 272.7765 48.67317 -91.93163      86.75871 
1 1 1 8   1  18 o 299.8241 36.44459 17.81973       4.156269      18.15317       5.053384      17.12258       7.307014  301.1811 44.54835 288.3395 66.59721 12.84152       80.12331 
1 1 1 8   1  19 o 720.1985 18.26449 100.8829       5.108434      101.6643       7.044613      100.0163       7.418729  722.4536 25.10841 716.4320 26.66408 6.021545       36.62520 
1 1 1 8   1  20 o 466.3267 27.99673 42.56036       5.046729      40.68740       5.979456      47.19876       9.409827  455.0337 34.08448 487.0864 50.47756 -32.05264      60.90760 
1 1 1 8   1  21 o 645.8692 20.06681 81.20144       5.033278      74.76157       6.982348      88.16779       7.262156  618.8901 29.05092 672.2375 27.81729 -53.34741      40.22136 
1 1 1 8   1  22 o 253.5098 51.41766 13.13658       4.889004      13.50377       6.052177      12.44695       8.294261  255.5622 61.68380 248.4461 77.52701 7.116043       99.07233 
1 1 1 8   1  23 o 1507.819 17.40735 442.4044       10.19318      442.6858       14.39308      442.1211       14.43770  1506.704 24.59788 1505.719 24.69028 0.9853516      34.85206 
1 1 1 8   1  24 o 1192.166 17.72348 276.6684       8.205662      270.5851       11.42344      283.1533       11.79457  1177.534 24.98019 1204.514 25.21403 -26.98059      35.49306 
1 1 1 8   1  25 o 256.4843 54.58595 13.60951       5.270205      13.21692       8.418324      13.86254       6.758484  252.6093 77.98660 256.9551 67.02641 -4.345764      102.8321 
1 1 1 8   1  26 o 329.3182 39.10505 21.71916       4.903483      23.94227       6.892667      19.44114       6.977252  341.7088 53.71229 304.9600 61.04333 36.74881       81.30989 
1 1 1 8   1  27 o 498.0880 27.42491 48.82706       5.284485      47.23293       7.419817      50.46806       7.528141  486.3400 39.62945 503.0887 38.83193 -16.74869      55.48344 
1 1 1 8   1  28 o 184.5987 59.20261 6.941269       4.807394      5.685817       6.779528      8.211010       6.817997  183.9156 69.44929 203.6459 70.61549 -19.73026      99.04419 
1 1 1 8   1  29 o 684.7587 23.16798 92.05831       6.161036      92.13619       8.750992      91.98177       8.675541  681.1790 33.08019 680.7273 32.81674 0.4517212      46.59654 
1 1 1 8   1  30 o 157.2323 61.76567 3.662765       5.515072      4.531186       6.596702      1.646508       10.05159  171.4545 67.48801 180.2421 78.02415 -8.787552      103.1620 
1 1 1 8   2  0  o 383.6757 16.55601 28.63730       2.466879      26.19247       3.330225      31.60999       3.672176  365.8349 23.56553 402.0252 23.62408 -36.19028      33.36812 
1 1 1 8   2  1  o 513.9533 14.08368 51.36061       2.811044      49.16811       3.894179      53.74611       4.061961  502.5233 19.95408 525.4007 19.90752 -22.87741      28.18642 
1 1 1 8   2  2  o 976.0558 13.36872 185.2180       5.067486      179.6837       5.806107      202.9132       10.38198  961.1532 15.55480 1019.830 26.21348 -58.67639      30.48111 
1 1 1 8   2  3  f 1183.844 15.38665 272.5955       7.074025      272.1731       8.712821      273.4125       12.11756  1182.409 18.97419 1183.691 26.36021 -1.282227      32.47893 
1 1 1 8   2  4  o 944.4553 14.20605 173.4666       5.210538      167.2656       10.89901      175.3038       5.932397  924.9409 30.34205 949.2408 16.09259 -24.29987      34.34547 
1 1 1 8   2  5  o 358.9812 21.57217 25.20641       2.993458      26.13520       6.568698      24.96297       3.362962  360.5286 48.11588 356.8718 24.41166 3.656799       53.95430 
1 1 1 8   2  6  f 472.2245 19.03845 43.43898       3.491468      43.26744       4.977281      43.60517       4.899012  469.7065 27.40484 471.6340 26.85815 -1.927521      38.37168 
1 1 1 8   2  7  o 426.0105 20.28121 35.38054       3.355383      34.87791       4.668092      35.91781       4.826319  421.1827 28.71034 427.3429 29.25720 -6.160187      40.99107 
1 1 1 8   2  8  o 501.4058 20.56138 49.03475       4.003775      46.06316       4.954596      54.62716       6.796947  484.5722 26.42805 526.2932 33.42849 -41.72101      42.61345 
1 1 1 8   2  9  o 644.2569 17.99952 80.88590       4.503476      77.53608       5.567725      87.22451       7.658846  630.1016 22.75303 667.0009 29.56711 -36.89935      37.30837 
1 1 1 8   2  10 o 795.0158 16.88804 123.1217       5.214144      127.2645       6.628047      116.3949       8.445837  807.5530 21.13424 770.7976 28.21463 36.75543       35.25225 
1 1 1 8   2  11 o 460.7715 18.92164 41.38457       3.385887      43.46865       4.943425      39.54291       4.647040  470.5084 27.16968 448.7582 26.78684 21.75018       38.15398 
1 1 1 8   2  12 o 572.5528 16.76520 63.83111       3.727796      62.79815       5.312602      64.83301       5.232119  567.0620 24.12397 576.2762 23.37862 -9.214172      33.59354 
1 1 1 8   2  13 o 460.9041 19.63153 41.38666       3.513926      45.36007       5.047551      37.65002       4.894849  481.0474 27.12944 437.8181 28.95185 43.22925       39.67639 
1 1 1 8   2  14 f 421.1104 29.48441 34.82234       4.791458      0.000000       0.000000      34.82234       4.791458  ?        ?        421.1104 29.48441 0.000000       29.48441 
1 1 1 8   2  15 o 1086.821 21.18348 230.0143       8.940939      0.000000       0.000000      230.0143       8.940939  ?        ?        1086.821 21.18348 0.000000       21.18348 
1 1 1 8   2  16 o 1183.031 15.41357 272.1247       7.081535      273.2934       10.08561      270.9882       9.945471  1184.765 21.92007 1179.788 21.70668 4.976685       30.84914 
1 1 1 8   2  17 o 424.3245 22.77255 35.15210       3.738937      35.84360       5.211592      34.41871       5.367149  427.4283 31.62076 418.5624 33.29353 8.865845       45.91657 
1 1 1 8   2  18 o 733.5309 17.08465 104.6258       4.866900      107.3835       6.904293      101.9021       6.861579  742.6380 23.93944 723.3955 24.42420 19.24249       34.19997 
1 1 1 8   2  19 o 466.6911 26.19717 42.56900       4.728813      43.18964       5.810993      41.35224       8.136480  469.3383 32.07342 456.7326 46.52134 12.60568       56.50610 
1 1 1 8   2  20 f 235.7432 49.13206 11.33381       4.352271      12.78143       5.335545      8.455183       7.523924  249.5381 56.38543 214.7353 74.19704 34.80286       93.19077 
1 1 1 8   2  21 o 732.6552 22.28469 104.5526       6.340655      108.1028       7.571101      96.21437       11.60302  744.5549 26.18390 698.6454 42.97315 45.90955       50.32185 
1 1 1 8   2  22 o 358.6148 32.63239 25.35062       4.494976      21.88530       6.248588      29.06697       6.470954  329.3633 50.45936 381.9422 44.45755 -52.57889      67.25043 
1 1 1 8   2  23 o 1205.703 24.16805 283.4464       11.31644      283.4464       11.31644      0.000000       0.000000  1205.703 24.16805 ?        ?        0.000000       24.16805 
1 1 1 8   2  24 o 680.6535 21.30400 90.29044       5.631386      100.9278       7.948067      79.56750       7.979993  718.5981 28.48049 636.6328 32.38324 81.96533       43.12555 
1 1 1 8   2  25 o 199.4117 57.43474 8.162248       4.689723      4.504048       6.351039      12.54867       6.954505  175.0840 66.95307 245.0246 69.74255 -69.94057      96.67852 
1 1 1 8   2  26 o 633.8867 26.21998 78.65949       6.454639      76.90321       10.17350      79.84277       8.350562  621.3696 42.41258 636.0372 33.92945 -14.66760      54.31422 
1 1 1 8   2  27 o 519.8527 38.99120 53.89321       7.814472      0.000000       0.000000      53.89321       7.814472  ?        ?        519.8527 38.99120 0.000000       38.99120 
1 1 1 8   2  28 o 410.7101 32.76550 33.55746       5.182635      33.78213       7.197306      33.31552       7.468945  407.3390 46.32111 403.5510 48.63772 3.788025       67.16601 
1 1 1 8   2  29 o 323.5180 50.06424 21.80111       6.086895      18.61472       7.145561      30.22846       11.62070  292.2433 64.67126 362.8137 84.11306 -70.57040      106.1008 
1 1 1 8   2  30 o 348.6419 45.80896 25.17138       6.052237      15.78794       7.349265      44.94522       10.66862  264.6200 70.31564 457.2565 61.65020 -192.6365      93.51490 
1 1 1 8   3  0  o 1176.141 13.47052 268.9503       6.152786      264.8962       8.552499      273.2993       8.858262  1166.526 18.87864 1184.825 19.25158 -18.29871      26.96342 
1 1 1 8   3  1  o 578.2741 13.65583 65.01857       3.066760      67.50949       4.312340      62.46972       4.362197  588.8960 18.85586 566.4130 19.83098 22.48297       27.36442 
1 1 1 8   3  2  o 580.9769 14.34666 65.63836       3.236962      67.16737       3.873085      62.09618       5.895055  587.5313 16.97454 564.0351 26.91248 23.49615       31.81849 
1 1 1 8   3  3  o 743.6547 14.67970 107.5558       4.239519      107.1185       5.249034      108.3763       7.190176  741.8218 18.22014 745.3795 24.83900 -3.557678      30.80503 
1 1 1 8   3  4  o 535.2908 14.00057 55.72423       2.910472      57.03346       4.470350      54.76096       3.834488  540.9996 21.27731 530.3317 18.61795 10.66797       28.27281 
1 1 1 8   3  5  o 467.5187 19.14215 42.57325       3.475504      58.64003       7.372470      37.98244       3.940879  545.6432 34.97593 440.6859 23.10745 104.9574       41.91980 
1 1 1 8   3  6  o 323.1037 24.58337 20.50092       3.061547      13.55493       6.257123      22.68724       3.510460  254.6286 63.49358 339.6446 26.83258 -85.01598      68.93056 
1 1 1 8   3  7  o 535.0572 20.29950 55.81977       4.218067      49.03379       5.293956      67.61752       6.980290  499.9091 27.37250 586.5516 30.75067 -86.64249      41.16864 
1 1 1 8   3  8  o 589.9649 19.13629 67.85169       4.384418      70.32652       5.566345      63.80666       7.116370  599.9696 23.88982 569.1525 32.32938 30.81714       40.19841 
1 1 1 8   3  9  o 274.4374 28.05872 14.90338       2.948412      20.43502       4.314833      10.05815       4.038263  320.3225 35.26999 220.6077 48.46006 99.71486       59.93621 
1 1 1 8   3  10 o 353.0204 22.45295 24.43207       3.062234      20.43716       4.378195      28.25806       4.284627  320.2272 35.81891 378.5517 29.37475 -58.32446      46.32354 
1 1 1 8   3  11 o 304.8777 25.75169 18.30274       3.020488      19.67396       4.433004      17.11448       4.126659  313.9403 37.07549 292.5032 37.16700 21.43713       52.49741 
1 1 1 8   3  12 o 719.3286 15.34129 100.7023       4.285655      100.9927       6.133968      100.4254       5.990250  719.5099 21.95214 717.5547 21.49621 1.955139       30.72431 
1 1 1 8   3  13 o 448.6215 22.79107 39.35155       3.957707      49.78936       7.197734      34.82819       4.738292  502.1218 37.17542 421.0182 29.15918 81.10358       47.24690 
1 1 1 8   3  14 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 8   3  15 o 518.7114 22.23471 52.40702       4.479044      44.35906       7.940990      56.16204       5.424235  473.2024 43.70535 536.6674 26.02588 -63.46497      50.86751 
1 1 1 8   3  16 o 997.3295 18.04722 193.4862       6.989996      195.1948       12.42564      192.6951       8.454627  999.8151 32.00155 994.8719 21.88262 4.943115       38.76788 
1 1 1 8   3  17 o 1116.511 15.47837 242.3464       6.711452      253.3418       9.772903      232.5324       9.232950  1140.866 22.05773 1093.043 21.75080 47.82300       30.97807 
1 1 1 8   3  18 o 498.8178 20.88515 48.41581       4.045828      46.19369       5.588388      50.86330       5.864955  485.8147 29.76369 509.8669 29.74882 -24.05215      42.08170 
1 1 1 8   3  19 o 820.7839 19.54607 131.0675       6.230405      129.2618       7.526231      134.9996       11.10617  814.7321 23.78673 831.3232 34.40064 -16.59113      41.82359 
1 1 1 8   3  20 o 93.10888 43.97754 -4.746420      4.173321      0.1183357      5.038033      -15.38367      7.449809  131.9964 56.15114 105.4489 51.87695 26.54756       76.44717 
1 1 1 8   3  21 f 1089.117 16.69790 230.7321       7.062598      229.2098       9.843167      232.3476       10.13946  1084.609 23.36865 1091.920 23.91092 -7.311035      33.43391 
1 1 1 8   3  22 o 594.3129 22.02640 68.80616       5.083779      79.88114       7.141825      57.43013       7.238243  639.6357 28.75071 540.6000 34.65957 99.03571       45.03209 
1 1 1 8   3  23 f 399.6791 35.62112 31.54192       5.471052      32.03259       6.534905      30.39206       10.00394  401.3929 42.57177 383.6030 69.72050 17.78992       81.69029 
1 1 1 8   3  24 o 149.8270 56.28968 3.383392       4.441467      1.683872       6.018991      5.415057       6.580922  152.8714 62.92273 184.2871 68.65908 -31.41576      93.13076 
1 1 1 8   3  25 o 283.2616 44.06490 16.23558       4.689830      29.07000       6.391519      1.265721       6.902792  380.8537 44.02470 158.7173 66.52653 222.1365       79.77439 
1 1 1 8   3  26 o 770.6881 20.65313 115.9303       6.181481      115.9978       8.506828      115.8549       8.997677  769.1295 28.48002 768.2011 30.15973 0.9283447      41.48157 
1 1 1 8   3  27 o 439.1773 30.83414 38.14824       5.225626      33.97541       7.046371      43.24792       7.789716  410.0694 44.98537 463.6302 43.78181 -53.56085      62.77364 
1 1 1 8   3  28 o 509.7680 38.49573 52.03837       7.564822      60.35610       9.815758      39.87161       11.87159  545.3819 46.79747 428.5901 73.99945 116.7917       87.55526 
1 1 1 8   3  29 o 162.0128 63.46629 3.862965       5.808882      2.307167       6.871747      7.758072       10.87302  160.5260 66.75530 216.4327 86.18147 -55.90666      109.0115 
1 1 1 8   3  30 o 151.9994 65.43690 0.8275916      6.991974      0.8275916      6.991974      0.000000       0.000000  151.9994 65.43690 ?        ?        0.000000       65.43690 
1 1 1 8   4  0  o 431.2844 18.45076 36.20975       3.090339      38.52456       5.072671      34.84361       3.896991  442.9968 29.65676 422.0450 23.87409 20.95181       38.07224 
1 1 1 8   4  1  o 820.6632 18.83972 131.1223       6.004369      0.000000       0.000000      131.1223       6.004369  ?        ?        820.6632 18.83972 0.000000       18.83972 
1 1 1 8   4  2  o 818.6487 15.34032 130.3674       4.877079      126.5162       6.071705      137.3707       8.187884  806.0358 19.39672 839.0909 25.12666 -33.05518      31.74243 
1 1 1 8   4  3  o 546.3478 16.50390 58.08597       3.501740      60.53439       4.532944      54.46236       5.514518  557.3782 20.94124 527.4007 27.01463 29.97754       34.18077 
1 1 1 8   4  4  o 776.4749 15.12022 117.2955       4.559462      115.4829       5.773568      120.2992       7.432171  769.9893 19.30775 785.1584 24.37420 -15.16913      31.09487 
1 1 1 8   4  5  o 284.9389 27.69289 16.02064       3.025706      5.816716       6.420333      18.93389       3.430547  185.9463 68.07563 309.7946 28.84577 -123.8483      73.93490 
1 1 1 8   4  6  o 334.0376 24.18792 21.90192       3.116535      31.14466       7.287877      19.83344       3.447675  393.1716 48.77761 317.1315 28.29068 76.04016       56.38810 
1 1 1 8   4  7  o 161.5741 44.22660 5.338667       2.856102      1.472424       4.361144      8.242131       3.779323  132.2547 53.89595 199.6445 49.08837 -67.38985      72.90022 
1 1 1 8   4  8  o 405.1542 20.62504 32.10651       3.234484      39.44125       4.808074      26.04321       4.371529  447.9342 27.77640 362.9494 31.32087 84.98480       41.86318 
1 1 1 8   4  9  o 764.8157 15.02170 113.8737       4.461735      117.2526       6.489387      110.8445       6.144427  775.0301 21.56042 753.6567 20.99326 21.37335       30.09266 
1 1 1 8   4  10 o 609.3367 16.05382 72.30266       3.798950      75.47105       5.530428      69.47195       5.227422  621.6257 22.90877 596.4592 22.56726 25.16644       32.15732 
1 1 1 8   4  11 o 594.5546 16.25235 68.82952       3.752631      68.46997       5.414138      69.16196       5.206021  592.1077 23.54510 595.2378 22.52099 -3.130066      32.58170 
1 1 1 8   4  12 o 1069.443 20.44946 222.9507       8.493128      0.000000       0.000000      222.9507       8.493128  ?        ?        1069.443 20.44946 0.000000       20.44946 
1 1 1 8   4  13 o 890.5016 16.83374 154.3356       5.821613      159.5808       10.10997      151.7337       7.120629  903.5071 28.81311 882.4328 20.77824 21.07434       35.52366 
1 1 1 8   4  14 o 560.0662 17.60589 61.03964       3.829352      64.88184       5.453318      57.30214       5.378500  576.8589 24.34239 542.0042 25.55233 34.85468       35.29127 
1 1 1 8   4  15 o 889.3326 15.23721 153.7932       5.262566      153.0629       7.430289      154.5283       7.454554  886.5921 21.58012 890.8299 21.54760 -4.237793      30.49591 
1 1 1 8   4  16 o 515.7347 22.94755 51.79335       4.596112      50.45529       8.330679      52.37885       5.510684  505.5101 42.83772 517.6006 27.51346 -12.09045      50.91228 
1 1 1 8   4  17 o 201.3360 60.75901 8.082568       5.148074      11.52007       7.328025      4.732859       7.233841  239.4807 72.54007 185.8436 71.36298 53.63707       101.7582 
1 1 1 8   4  18 o 387.6503 29.13674 29.46241       4.354322      37.74012       5.335279      12.95056       7.535286  438.6955 31.52621 252.1712 72.85342 186.5243       79.38213 
1 1 1 8   4  19 o 440.4691 23.53601 37.88805       4.011450      33.25320       5.500488      43.15384       5.862936  411.0963 34.77944 469.0492 32.38449 -57.95297      47.52225 
1 1 1 8   4  20 o 745.1993 18.09780 108.0374       5.237527      108.5289       7.183587      107.4796       7.652606  746.2679 24.78669 742.4570 26.54056 3.810974       36.31503 
1 1 1 8   4  21 f 785.0297 37.90720 120.7637       11.55675      0.000000       0.000000      120.7637       11.55675  ?        ?        785.0297 37.90720 0.000000       37.90720 
1 1 1 8   4  22 o 1571.585 17.33270 480.5630       10.57869      503.9610       15.46132      459.9686       14.50544  1607.702 24.76355 1536.042 24.31643 71.66003       34.70623 
1 1 1 8   4  23 o 1392.380 17.22820 377.2748       9.315919      378.3312       13.08134      376.1876       13.27008  1392.862 24.18333 1388.807 24.60390 4.055542       34.49906 
1 1 1 8   4  24 o 1135.854 20.32685 251.4019       8.966454      252.0382       10.81460      250.0025       16.03756  1136.388 24.50506 1128.263 36.60159 8.125488       44.04741 
1 1 1 8   4  25 o 648.2853 22.20544 82.02431       5.590538      84.13991       7.609037      79.54259       8.241173  655.2400 29.90207 635.4914 33.51116 19.74860       44.91249 
1 1 1 8   4  26 o 612.1580 23.40216 73.26398       5.563492      73.78768       7.514057      72.62852       8.277105  611.8094 31.73396 605.8853 35.33038 5.924072       47.48978 
1 1 1 8   4  27 f 944.2278 19.89803 174.1443       7.296504      180.3609       9.858087      166.6126       10.85084  958.7672 26.47594 919.9988 30.37022 38.76843       40.29052 
1 1 1 8   4  28 o 184.8552 65.00459 6.570768       5.787242      5.617791       6.789993      9.101509       11.06501  183.0374 69.41020 227.2279 87.98618 -44.19055      112.0685 
1 1 1 8   4  29 o 342.2587 45.00785 24.09738       5.837264      32.24267       9.020267      18.22869       7.656615  387.9418 61.95674 286.5044 69.52068 101.4374       93.12229 
1 1 1 8   4  30 o 122.3542 53.93643 -0.7370718     4.995475      0.5484650      7.013292      -2.060980      7.117190  150.6060 65.18444 139.1438 62.64506 11.46223       90.40694 
1 1 1 8   5  0  o 624.7318 16.12941 75.94326       3.913272      76.78728       6.471172      75.45667       4.913484  627.0770 26.57260 622.3463 20.32963 4.730713       33.45739 
1 1 1 8   5  1  o 399.7698 20.86827 31.22535       3.228610      32.24906       4.060446      29.46540       5.323960  405.6231 25.91174 385.9271 35.93539 19.69601       44.30317 
1 1 1 8   5  2  o 320.9893 23.32740 20.20120       2.888058      18.12014       3.660870      23.63088       4.699677  302.6306 31.61570 345.2892 35.55592 -42.65860      47.57915 
1 1 1 8   5  3  o 293.1143 24.21913 16.87966       2.732221      14.96701       3.516876      19.79152       4.339352  274.2942 33.72556 315.5180 36.06157 -41.22385      49.37459 
1 1 1 8   5  4  f 1136.696 15.50266 251.4400       6.843503      254.4079       8.709177      246.6496       11.06458  1142.634 19.62646 1123.766 25.35311 18.86816       32.06210 
1 1 1 8   5  5  o 882.5154 13.97281 151.5191       4.788881      144.6629       10.40755      153.3607       5.393803  859.0759 31.19528 887.6484 15.64682 -28.57245      34.89940 
1 1 1 8   5  6  o 207.7186 32.24854 8.661977       2.517081      9.280052       6.093686      8.534824       2.763890  213.5696 66.41992 205.3916 35.96080 8.177994       75.53003 
1 1 1 8   5  7  o 303.0413 22.62766 18.03082       2.643781      21.15034       6.677532      17.45091       2.879045  320.4397 55.67955 297.7116 25.13647 22.72812       61.09055 
1 1 1 8   5  8  o 361.7971 22.86864 25.66908       3.196634      29.34146       4.758600      22.64907       4.315289  385.1764 32.10449 337.8160 33.32720 47.36044       46.27527 
1 1 1 8   5  9  o 467.0526 18.63526 42.52526       3.380097      37.54223       4.944700      46.89619       4.631059  436.6104 29.33233 489.7857 24.34704 -53.17532      38.12039 
1 1 1 8   5  10 o 632.4734 21.81182 78.07934       5.357498      0.000000       0.000000      78.07934       5.357498  ?        ?        632.4734 21.81182 0.000000       21.81182 
1 1 1 8   5  11 o 692.1571 21.53596 93.46177       5.788912      0.000000       0.000000      93.46177       5.788912  ?        ?        692.1571 21.53596 0.000000       21.53596 
1 1 1 8   5  12 o 517.2226 20.05639 52.13203       4.028637      50.13920       6.835035      53.19290       4.986961  504.2036 35.12595 521.9894 24.60064 -17.78574      42.88384 
1 1 1 8   5  13 o 972.6251 14.76050 184.0006       5.575383      176.2066       7.751757      192.3535       8.024899  950.9865 20.98929 993.6349 20.79624 -42.64844      29.54715 
1 1 1 8   5  14 f 598.9274 17.03022 69.78920       3.961161      73.11443       5.670797      66.62074       5.535510  612.4609 23.84173 584.5798 24.38293 27.88110       34.10213 
1 1 1 8   5  15 o 441.8704 20.70446 38.00862       3.552932      38.82087       5.066149      37.22248       4.984066  445.0311 29.47991 435.7110 29.63092 9.320068       41.79781 
1 1 1 8   5  16 o 231.6354 43.86195 10.86178       3.801202      12.20748       4.472013      7.358180       7.215834  245.0464 48.70807 204.7708 72.52460 40.27560       87.36300 
1 1 1 8   5  17 o 887.3395 18.88659 153.1537       6.508357      159.5278       11.84566      150.3975       7.789401  903.9084 33.74480 878.9704 22.81927 24.93805       40.73611 
1 1 1 8   5  18 o 526.6761 24.69459 54.02309       5.050954      51.41651       9.235082      55.13560       6.033313  509.7024 47.19022 530.9427 29.37459 -21.24026      55.58582 
1 1 1 8   5  19 o 1118.238 16.03827 243.1465       6.964978      234.5682       9.589140      252.7260       10.13330  1097.601 22.49610 1139.235 22.90392 -41.63391      32.10395 
1 1 1 8   5  20 o 769.1210 17.92498 115.0869       5.354035      115.6170       7.464438      114.5252       7.683826  770.1936 24.95567 766.4483 25.81468 3.745300       35.90520 
1 1 1 8   5  21 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 8   5  22 o 577.7613 25.49850 65.10611       5.721251      69.29440       6.945405      56.26470       10.09113  594.7794 30.16738 531.6915 49.43734 63.08789       57.91478 
1 1 1 8   5  23 o 629.6748 21.87545 77.26713       5.349353      74.35993       7.305872      80.62701       7.854098  616.6689 30.50647 641.9814 31.50256 -25.31250      43.85266 
1 1 1 8   5  24 f 505.3974 26.05232 50.02707       5.095976      51.48459       6.960907      48.34372       7.480737  510.9227 35.29831 494.0883 39.31140 16.83441       52.83329 
1 1 1 8   5  25 o 702.0175 24.52656 96.31700       6.686712      101.5330       7.865399      82.72005       12.69904  720.0444 28.12765 641.7326 51.38628 78.31183       58.58084 
1 1 1 8   5  26 o 402.0027 33.27217 32.03768       5.147740      32.04565       6.711102      32.02629       8.023420  399.0247 44.04171 395.6440 53.59860 3.380646       69.37205 
1 1 1 8   5  27 o 431.2716 36.62584 37.11151       6.076294      35.24977       7.032936      42.59262       12.06736  417.7625 44.01116 446.4801 72.04847 -28.71759      84.42727 
1 1 1 8   5  28 o 347.7938 39.65571 24.45824       5.260418      27.24514       7.082536      21.02925       7.856176  362.5428 51.77450 311.3083 66.96899 51.23450       84.64895 
1 1 1 8   5  29 o 511.4680 29.22282 51.93210       5.780467      45.73212       7.759953      59.66124       8.664225  474.0267 42.60816 542.5074 41.43747 -68.48071      59.43500 
1 1 1 8   5  30 o 136.5894 58.95560 0.3543442      5.705373      -8.666368      8.917299      6.606309       7.423713  133.4991 63.41557 189.9909 72.45008 -56.49182      96.28369 
1 1 1 8   6  0  o 446.1050 17.97233 38.75360       3.113647      40.02174       3.732254      35.85051       5.647005  453.0915 21.21081 426.1100 34.41847 26.98154       40.42931 
1 1 1 8   6  1  o 633.2822 14.62478 78.02238       3.596787      78.20013       4.243553      77.56892       6.778024  633.7683 17.24134 629.8904 27.70832 3.877930       32.63456 
1 1 1 8   6  2  o 234.1460 27.04269 10.85626       2.413806      8.702738       2.799695      17.09307       4.764496  207.5944 36.03391 291.1745 43.46532 -83.58009      56.45951 
1 1 1 8   6  3  f 987.3424 13.77525 189.6351       5.281963      182.6311       7.244400      197.5841       7.717691  968.1016 19.26875 1006.867 19.73729 -38.76501      27.58342 
1 1 1 8   6  4  o 547.9669 15.21881 58.44025       3.238642      56.88168       4.485964      60.13693       4.680490  540.0017 21.39108 555.2008 21.70767 -15.19910      30.47624 
1 1 1 8   6  5  o 287.2984 19.81570 16.16936       2.197390      16.90078       3.379325      15.63356       2.892353  292.1024 30.22709 281.4390 26.78612 10.66339       40.38779 
1 1 1 8   6  6  o 501.1392 16.58064 48.91481       3.226917      57.04855       8.078896      47.37082       3.519893  536.1473 39.06958 492.9942 18.38483 43.15311       43.17910 
1 1 1 8   6  7  o 206.5140 32.19477 8.571860       2.497848      12.84728       7.070786      7.962233       2.669999  246.7952 70.34982 198.0721 36.03803 48.72307       79.04327 
1 1 1 8   6  8  o 468.7852 18.76489 42.84673       3.416237      38.20502       4.946986      47.07824       4.723346  440.4787 29.08298 490.0118 24.90267 -49.53308      38.28789 
1 1 1 8   6  9  o 452.4832 25.15768 40.16140       4.403344      0.000000       0.000000      40.16140       4.403344  ?        ?        452.4832 25.15768 0.000000       25.15768 
1 1 1 8   6  10 o 180.3062 43.72165 6.692442       3.029897      0.1863006      5.282401      9.882456       3.698843  134.3907 57.34092 219.4487 44.91429 -85.05798      72.83732 
1 1 1 8   6  11 o 975.7932 14.51135 185.2653       5.499124      196.4520       8.148896      175.9110       7.451662  1003.729 20.90520 949.9382 20.19900 53.79089       29.06935 
1 1 1 8   6  12 o 206.7222 36.78107 8.636472       2.844615      5.352463       4.112448      11.64922       3.938944  167.0127 54.84748 239.3755 43.99247 -72.36276      70.31062 
1 1 1 8   6  13 o 549.7020 17.37460 58.80391       3.709113      58.03349       5.288234      59.54990       5.203744  545.4528 24.96465 552.6039 24.24789 -7.151062      34.80221 
1 1 1 8   6  14 o 737.8545 18.68934 105.9508       5.355411      107.2876       6.389744      102.7946       9.817855  742.1600 22.16960 724.7878 34.88010 17.37219       41.32932 
1 1 1 8   6  15 o 1404.488 21.89952 384.0624       11.94484      384.0624       11.94484      0.000000       0.000000  1404.488 21.89952 ?        ?        0.000000       21.89952 
1 1 1 8   6  16 o 1128.361 15.26486 247.5158       6.689119      248.7439       9.509309      246.3129       9.411141  1130.486 21.65987 1124.963 21.54151 5.523193       30.54810 
1 1 1 8   6  17 o 807.4551 16.18638 126.7608       5.075703      123.9553       7.029924      129.8160       7.336119  797.9830 22.68449 816.5891 23.13315 -18.60608      32.39952 
1 1 1 8   6  18 o 1209.921 18.54816 284.7487       8.715371      286.1223       15.53585      284.1179       10.52802  1210.569 33.04590 1208.097 22.43969 2.471436       39.94460 
1 1 1 8   6  19 o 1267.914 18.89957 312.7858       9.306142      322.7504       16.90742      308.4548       11.14656  1285.110 33.87732 1258.531 22.80599 26.57910       40.83853 
1 1 1 8   6  20 o 587.4958 20.22151 67.19043       4.613668      66.13003       6.386080      68.34818       6.672782  582.1415 28.24736 591.7416 29.03667 -9.600098      40.50977 
1 1 1 8   6  21 o 300.6281 36.54190 17.95767       4.178544      19.14580       5.752911      16.63091       6.079295  307.7572 49.83803 284.8195 56.95129 22.93768       75.67879 
1 1 1 8   6  22 o 475.9222 29.17216 44.40664       5.365768      44.51991       6.427236      44.14611       9.747440  475.5268 35.05044 468.9990 54.53506 6.527832       64.82751 
1 1 1 8   6  23 o 934.2188 20.54743 170.0309       7.454767      170.4860       8.954921      169.0033       13.45482  934.7895 24.66720 927.8809 37.33856 6.908569       44.75086 
1 1 1 8   6  24 o 528.6552 24.94704 54.58357       5.121764      58.50657       6.929747      49.86052       7.603597  545.2023 32.88281 501.6418 39.34543 43.56046       51.27711 
1 1 1 8   6  25 o 247.4268 50.37815 12.64085       4.676279      11.46621       6.168927      14.22760       7.169887  233.8438 65.38168 259.1412 69.71752 -25.29736      95.57875 
1 1 1 8   6  26 o 918.2382 22.21182 164.8143       7.920774      161.7649       9.378848      172.3989       14.79139  908.4036 26.58537 931.7935 40.87534 -23.38989      48.76038 
1 1 1 8   6  27 o 215.3562 64.56814 9.785996       5.827739      2.718199       6.564651      36.07133       12.65979  162.2228 66.11823 403.1709 83.59875 -240.9481      106.5850 
1 1 1 8   6  28 o 379.1127 36.92960 28.89747       5.368114      24.28653       7.066669      35.18841       8.254252  340.0132 55.42663 411.8426 52.82583 -71.82941      76.56814 
1 1 1 8   6  29 o 165.1388 61.10939 4.886408       5.195807      4.809289       6.932331      4.985262       7.848648  176.0335 69.21758 183.0837 73.12009 -7.050186      100.6858 
1 1 1 8   6  30 o 224.1541 63.64215 11.14105       5.798596      4.665667       8.923702      15.87333       7.628651  186.2936 76.64017 263.4361 72.35151 -77.14249      105.3967 
1 1 1 8   7  0  o 789.2701 14.07769 121.2013       4.315044      120.3867       5.057042      123.3826       8.274890  786.3154 16.56044 794.2807 26.82627 -7.965332      31.52612 
1 1 1 8   7  1  o 274.4416 25.09977 14.83873       2.645525      14.30689       3.157028      16.09285       4.847938  268.4391 30.84372 281.4904 45.93138 -13.05130      55.32655 
1 1 1 8   7  2  o 164.7171 38.98665 5.561349       2.455170      6.831541       3.299858      3.986317       3.674559  182.1166 46.49637 148.7233 51.82576 33.39337       69.62630 
1 1 1 8   7  3  o 237.8531 27.55982 11.21818       2.498567      8.597771       3.340145      14.54737       3.764874  204.6824 43.36818 269.3734 36.96338 -64.69099      56.98325 
1 1 1 8   7  4  o 684.9530 14.15388 91.30026       3.764995      95.96690       5.273019      86.44679       5.377532  701.5718 19.35349 665.6531 20.80210 35.91870       28.41276 
1 1 1 8   7  5  o 927.6232 13.52802 167.4351       4.873420      171.9262       6.943826      163.0755       6.841428  939.0228 19.04122 914.4888 19.26373 24.53394       27.08614 
1 1 1 8   7  6  o 661.1155 14.73488 85.08546       3.783136      88.37117       9.136506      84.40554       4.156169  668.8616 35.29852 658.2874 16.25735 10.57428       38.86241 
1 1 1 8   7  7  o 610.4630 16.25812 72.58895       3.854408      0.000000       0.000000      72.58895       3.854408  ?        ?        610.4630 16.25812 0.000000       16.25812 
1 1 1 8   7  8  o 639.5574 22.11724 79.87476       5.493365      0.000000       0.000000      79.87476       5.493365  ?        ?        639.5574 22.11724 0.000000       22.11724 
1 1 1 8   7  9  o 187.0419 42.84698 7.198152       3.045502      6.400131       5.916869      7.485772       3.552181  186.7480 65.72334 190.3104 48.05323 -3.562439      81.41665 
1 1 1 8   7  10 o 541.7000 16.83689 57.14234       3.542001      55.17110       5.242444      58.79796       4.804456  531.3061 25.40745 548.8708 22.53959 -17.56470      33.96427 
1 1 1 8   7  11 o 837.9253 14.57304 136.5956       4.742240      131.9637       6.679599      141.3031       6.733810  822.7670 20.90478 851.4691 20.36404 -28.70203      29.18397 
1 1 1 8   7  12 o 637.4352 15.90116 79.05547       3.936343      76.98342       5.630333      81.03661       5.505427  628.3379 23.07347 644.7904 21.98591 -16.45251      31.87107 
1 1 1 8   7  13 o 417.3832 24.36750 34.07920       3.932624      34.39772       4.617856      33.23846       7.502550  418.7622 28.56571 407.7798 48.31527 10.98242       56.12811 
1 1 1 8   7  14 o 254.6317 31.09764 12.84871       3.011265      15.79015       4.321655      10.07296       4.198171  280.9143 40.80769 221.8110 49.93901 59.10327       64.49164 
1 1 1 8   7  15 o 979.6846 14.95222 186.5913       5.688789      198.0238       8.283337      176.3853       7.826420  1008.647 21.14648 951.9418 21.17019 56.70508       29.92241 
1 1 1 8   7  16 o 1141.689 15.19929 253.3895       6.739061      243.9226       9.281807      263.9434       9.800255  1119.540 21.34839 1164.539 21.66982 -44.99939      30.41932 
1 1 1 8   7  17 o 1842.800 17.40314 660.3860       12.45472      662.0282       17.64288      658.7546       17.58453  1843.720 24.64033 1839.160 24.61973 4.559448       34.83212 
1 1 1 8   7  18 o 516.0578 20.66287 51.82796       4.141112      50.69762       5.699477      53.09198       6.027080  509.0400 28.95031 520.8281 29.92352 -11.78812      41.63578 
1 1 1 8   7  19 o 712.6685 21.59889 98.89188       5.977878      91.18513       10.51784      102.5693       7.265439  680.9507 39.94738 725.3766 25.79113 -44.42584      47.54972 
1 1 1 8   7  20 o 614.7810 23.96931 73.66038       5.722739      86.47583       10.47829      68.21286       6.831604  662.5737 40.92222 590.2659 29.89967 72.30780       50.68154 
1 1 1 8   7  21 o 467.3514 25.11431 42.71338       4.541481      48.57432       6.365304      36.63647       6.481523  497.2348 33.15329 430.4188 39.20546 66.81601       51.34402 
1 1 1 8   7  22 o 655.2370 20.67168 83.62518       5.260199      87.17728       7.255191      79.68872       7.637622  668.1537 27.96047 638.4280 30.80479 29.72577       41.60196 
1 1 1 8   7  23 o 584.3658 25.64034 66.66788       5.818842      69.20963       6.950710      60.71356       10.63849  594.0259 30.22961 551.3209 50.23902 42.70502       58.63266 
1 1 1 8   7  24 o 350.6097 39.62353 24.53462       5.300494      23.42386       6.258650      27.35231       9.968184  340.1194 48.77936 359.9131 73.79412 -19.79373      88.45902 
1 1 1 8   7  25 o 202.3305 62.42891 8.362431       5.395443      7.090261       6.116900      12.82130       11.45173  193.4008 66.89634 256.0316 91.29117 -62.63075      113.1777 
1 1 1 8   7  26 o 343.1443 38.77775 23.62900       5.076912      29.25899       6.683979      15.95129       7.805442  379.8972 46.25953 271.7375 72.58791 108.1598       86.07526 
1 1 1 8   7  27 o 576.4472 25.56559 65.24011       5.723259      75.34945       7.752586      53.13130       8.484692  616.6146 32.48928 513.4803 42.94272 103.1343       53.84822 
1 1 1 8   7  28 o 267.3679 59.47928 15.38990       6.016525      12.39658       6.809826      26.03876       12.84432  237.7818 69.42020 330.5178 95.00889 -92.73601      117.6684 
1 1 1 8   7  29 o 463.8764 36.80130 43.39885       6.575258      58.39007       10.12230      32.45568       8.648331  530.7772 49.68459 389.4196 59.03668 141.3577       77.16144 
1 1 1 8   8  0  o 558.5641 16.21739 60.76226       3.517889      62.58648       4.240578      56.73589       6.300043  566.5404 19.27375 536.9249 30.33774 29.61554       35.94240 
1 1 1 8   8  1  f 737.8132 14.31031 105.9485       4.100375      107.5336       4.921565      102.3515       7.414041  742.9508 17.05749 723.1763 26.39871 19.77448       31.43008 
1 1 1 8   8  2  o 313.8969 23.81426 19.36502       2.881401      23.21474       3.998364      15.20570       4.156041  342.6639 30.36029 274.5886 40.16071 68.07529       50.34511 
1 1 1 8   8  3  o 239.7866 28.44844 11.42368       2.597505      10.48968       3.485741      12.58994       3.895109  226.8924 41.07122 248.9296 41.77135 -22.03716      58.58063 
1 1 1 8   8  4  o 545.0428 15.22800 57.84377       3.223306      58.54597       4.404304      57.03387       4.729988  547.7014 20.70644 540.3283 22.54106 7.373108       30.60810 
1 1 1 8   8  5  o 532.0347 16.47317 55.14381       3.403652      52.50092       4.990288      57.44274       4.654243  518.0593 24.80380 542.3049 22.09925 -24.24561      33.22055 
1 1 1 8   8  6  f 435.6776 20.08736 37.03715       3.398725      0.000000       0.000000      37.03715       3.398725  ?        ?        435.6776 20.08736 0.000000       20.08736 
1 1 1 8   8  7  o 290.5807 25.16761 16.63922       2.812074      0.000000       0.000000      16.63922       2.812074  ?        ?        290.5807 25.16761 0.000000       25.16761 
1 1 1 8   8  8  o 524.6662 15.92839 53.60486       3.245510      43.85184       8.487206      55.27532       3.512469  467.1135 47.44429 532.6749 16.97940 -65.56140      50.39107 
1 1 1 8   8  9  o 212.3654 27.40205 8.968760       2.207211      2.219613       4.297593      11.38688       2.572404  137.6269 54.37687 239.5568 28.18984 -101.9299      61.24958 
1 1 1 8   8  10 o 99.33299 41.36815 0.4487321      2.644411      2.467558       4.161862      -0.9181553     3.424559  138.4929 53.86768 101.3320 44.66412 37.16091       69.97578 
1 1 1 8   8  11 o 281.1807 34.72296 15.73364       3.711129      13.80537       4.289853      21.46907       7.398457  261.1747 43.84842 322.5890 61.29695 -61.41428      75.36577 
1 1 1 8   8  12 o 980.8748 20.37688 187.3845       7.762102      0.000000       0.000000      187.3845       7.762102  ?        ?        980.8748 20.37688 0.000000       20.37688 
1 1 1 8   8  13 o 848.9949 14.82263 140.1583       4.887181      135.3113       6.920881      144.9791       6.902191  833.5534 21.37962 862.9084 20.59654 -29.35504      29.68679 
1 1 1 8   8  14 o 1599.812 16.02896 497.7032       9.958689      507.7901       14.35208      488.3370       13.82985  1614.717 22.88708 1583.567 22.48812 31.15015       32.08635 
1 1 1 8   8  15 o 316.7023 26.74581 19.68529       3.258771      22.17309       4.561498      17.09201       4.657187  334.9810 35.60986 292.4218 42.23357 42.55930       55.24252 
1 1 1 8   8  16 o 626.8563 17.29572 76.41374       4.210509      71.24108       5.794231      82.20133       6.128978  604.8091 24.66888 649.6990 24.29114 -44.88983      34.62099 
1 1 1 8   8  17 o 251.7047 35.51732 12.61996       3.375353      10.17258       4.622367      15.41573       4.940432  222.8758 53.97705 276.3675 47.75832 -53.49171      72.07203 
1 1 1 8   8  18 o 854.6749 16.37210 142.0517       5.434172      141.2878       7.503780      142.8942       7.880188  851.7910 22.68397 856.5087 23.69064 -4.717712      32.79953 
1 1 1 8   8  19 o 1391.628 23.22562 377.2965       12.55216      0.000000       0.000000      377.2965       12.55216  ?        ?        1391.628 23.22562 0.000000       23.22562 
1 1 1 8   8  20 o 1208.238 19.30525 284.1646       9.058491      284.8587       16.13334      283.8450       10.94691  1206.488 34.43287 1206.872 23.35622 -0.3836670     41.60692 
1 1 1 8   8  21 o 1597.856 17.22457 496.7798       10.68843      492.4061       14.88592      501.4343       15.35650  1589.243 24.11889 1603.601 24.65858 -14.35779      34.49299 
1 1 1 8   8  22 o 544.0466 31.34368 58.08937       6.594355      58.08937       6.594355      0.000000       0.000000  544.0466 31.34368 ?        ?        0.000000       31.34368 
1 1 1 8   8  23 o 480.1856 26.11662 45.17276       4.851967      37.30091       6.372341      56.03209       7.484483  433.8943 38.20676 532.8846 36.38347 -98.99030      52.75901 
1 1 1 8   8  24 o 537.3076 33.15548 56.92144       6.884609      56.92144       6.884609      0.000000       0.000000  537.3076 33.15548 ?        ?        0.000000       33.15548 
1 1 1 8   8  25 o 465.9722 32.56220 42.92968       5.855487      48.97700       6.858677      26.67352       11.24522  496.9688 35.77656 348.9737 83.98928 147.9951       91.29163 
1 1 1 8   8  26 o 477.8626 28.31545 45.02762       5.231354      48.48196       7.001622      40.66224       7.870952  493.3819 36.80650 448.4584 45.83791 44.92349       58.78633 
1 1 1 8   8  27 o 539.4651 26.73670 57.23925       5.601432      61.36625       7.515883      52.08287       8.401067  555.0146 35.04969 507.8624 42.99897 47.15219       55.47425 
1 1 1 8   8  28 o 444.9359 36.50481 39.79423       6.252192      54.73236       9.291032      27.43157       8.452240  516.9412 46.78718 356.5700 63.35912 160.3712       78.76178 
1 1 1 8   8  29 o 338.3978 46.82838 23.82739       5.989171      22.45763       8.970259      24.92915       8.045012  313.3703 74.75461 337.2875 63.75438 -23.91721      98.24903 
1 1 1 8   9  0  o 329.7735 22.88674 21.35663       2.912936      24.73075       3.589190      14.84549       4.985914  354.3892 26.26579 268.4398 49.65559 85.94940       56.17445 
1 1 1 8   9  1  o 102.6259 41.10412 1.050613       2.488022      -1.616505      3.005366      6.860018       4.435494  89.13125 40.36407 183.8384 56.58368 -94.70719      69.50519 
1 1 1 8   9  2  o 513.7281 18.53202 51.46672       3.697294      48.18491       5.629182      53.95663       4.903199  494.6231 29.43814 525.2420 24.03766 -30.61893      38.00544 
1 1 1 8   9  3  o 126.7551 44.14428 2.883205       2.665827      2.534052       3.830363      3.211201       3.712496  134.8984 51.89830 140.3763 51.70946 -5.477875      73.26186 
1 1 1 8   9  4  o 634.9896 21.45987 78.74495       5.292022      0.000000       0.000000      78.74495       5.292022  ?        ?        634.9896 21.45987 0.000000       21.45987 
1 1 1 8   9  5  o 232.4840 29.28100 10.76773       2.585025      10.28010       3.530766      11.33110       3.795082  224.2092 42.09562 235.4231 43.09739 -11.21388      60.24471 
1 1 1 8   9  6  o 824.9456 11.99334 132.3722       3.842319      125.3481       5.928348      137.4601       5.045508  801.7112 19.04091 840.1710 15.46355 -38.45978      24.52912 
1 1 1 8   9  7  o 371.6413 19.45722 27.00820       2.798466      36.10953       7.822026      25.67225       2.996823  423.0464 48.48597 362.0352 21.41005 61.01117       53.00263 
1 1 1 8   9  8  o 704.5057 17.88179 96.70457       4.892418      100.4183       10.06053      95.55430       5.599059  713.1986 36.44477 699.9141 20.59882 13.28448       41.86326 
1 1 1 8   9  9  o 482.8250 15.95178 45.37804       2.991071      62.43185       8.597733      43.02985       3.190357  561.4248 39.68917 470.0509 17.47698 91.37387       43.36675 
1 1 1 8   9  10 o 782.5392 18.28993 119.2519       5.558354      118.2458       6.560513      121.8112       10.46368  778.7745 21.69193 788.0607 34.18983 -9.286194      40.49054 
1 1 1 8   9  11 o 439.9337 18.64820 37.68073       3.186047      31.52706       4.689433      42.95657       4.342089  400.4110 30.38339 468.7202 23.93354 -68.30923      38.67771 
1 1 1 8   9  12 o 234.6664 43.97824 11.17216       3.860634      0.000000       0.000000      11.17216       3.860634  ?        ?        234.6664 43.97824 0.000000       43.97824 
1 1 1 8   9  13 o 678.0394 15.65939 89.40180       4.123422      86.97475       5.884250      91.74358       5.779948  668.2346 22.67432 686.4000 21.68296 -18.16547      31.37317 
1 1 1 8   9  14 o 701.1016 15.69900 95.57290       4.274457      99.42638       6.114587      91.88998       5.977726  714.6379 22.03196 686.9894 22.40568 27.64856       31.42326 
1 1 1 8   9  15 o 686.4438 16.02737 91.61478       4.272630      95.45533       6.030015      87.74250       6.054886  700.2736 22.17290 671.3066 23.22507 28.96698       32.10984 
1 1 1 8   9  16 o 596.0184 24.62832 69.18731       5.700625      69.18731       5.700625      0.000000       0.000000  596.0184 24.62832 ?        ?        0.000000       24.62832 
1 1 1 8   9  17 o 1774.581 17.10134 612.4382       11.78566      614.6500       16.68477      610.2356       16.65018  1776.409 24.18518 1770.010 24.22229 6.399048       34.22926 
1 1 1 8   9  18 o 1308.005 15.86393 332.7073       8.058391      344.7113       11.61140      321.5534       11.19270  1330.398 22.47372 1284.940 22.42972 45.45789       31.75155 
1 1 1 8   9  19 o 485.3419 22.61016 45.89006       4.261667      54.20106       5.904060      36.84949       6.157755  526.1202 29.00809 432.1807 37.04654 93.93951       47.05226 
1 1 1 8   9  20 o 416.4272 26.49747 33.96761       4.262922      30.25751       5.680750      38.74983       6.449527  391.0724 37.87897 443.0056 37.85119 -51.93317      53.54932 
1 1 1 8   9  21 o 308.0037 47.00974 19.11979       5.444870      24.19911       9.961325      16.95564       6.502167  339.5039 77.28602 286.6813 60.31300 52.82254       98.03461 
1 1 1 8   9  22 o 737.4412 19.60828 105.9234       5.615582      109.5921       7.630707      101.5891       8.293950  749.1945 26.22662 720.7736 29.63020 28.42084       39.56999 
1 1 1 8   9  23 o 134.5877 55.57504 1.194506       4.714680      5.535412       5.619261      -9.127684      8.665127  177.9938 63.89744 134.3795 63.43953 43.61435       90.04141 
1 1 1 8   9  24 o 426.0784 33.40706 35.91146       5.483550      34.39640       6.513443      39.59857       10.16109  415.0216 40.94582 438.5735 61.33638 -23.55188      73.74762 
1 1 1 8   9  25 o 554.3568 27.95654 60.45464       5.999286      70.22137       7.248448      39.21302       10.68967  596.5844 31.39614 432.8787 65.64673 163.7057       72.76820 
1 1 1 8   9  26 o 1244.629 18.24246 302.4115       8.817617      314.2126       12.25515      289.7451       12.69654  1265.758 24.93103 1214.480 26.91952 51.27795       36.69083 
1 1 1 8   9  27 o 120.3616 54.17587 -2.058465      5.319118      -5.251752      7.587894      1.026853       7.458511  132.9765 61.65003 159.2623 68.04891 -26.28577      91.82255 
1 1 1 8   9  28 o 284.7977 53.68010 17.24126       5.719381      19.55338       8.221692      15.07321       7.961438  294.7674 72.35689 258.2160 74.96777 36.55136       104.1906 
1 1 1 8   9  29 o 640.9894 25.04125 81.09460       6.233541      88.45129       8.654325      73.16296       8.986152  664.3372 33.65396 601.0204 38.70545 63.31677       51.29036 
1 1 1 8   10 0  o 478.5336 19.19070 44.68701       3.566409      47.43084       4.505877      40.08506       5.835410  492.3867 23.56378 449.7177 33.65611 42.66910       41.08509 
1 1 1 8   10 1  o 502.6510 19.32405 49.30424       3.772183      42.39251       5.817552      54.31835       4.955003  462.8937 32.56921 526.8486 24.21754 -63.95490      40.58624 
1 1 1 8   10 2  o 648.0449 17.22987 81.86436       4.336257      74.88964       6.848571      86.53154       5.602260  617.7382 28.54746 665.5105 21.67606 -47.77228      35.84423 
1 1 1 8   10 3  o 659.8984 21.71903 85.07082       5.566029      0.000000       0.000000      85.07082       5.566029  ?        ?        659.8984 21.71903 0.000000       21.71903 
1 1 1 8   10 4  o 419.7709 17.97007 34.35409       2.929478      31.53119       3.918867      37.92947       4.410362  400.5801 25.32118 439.3637 25.96301 -38.78357      36.26624 
1 1 1 8   10 5  o 729.5620 13.92753 103.5950       3.946065      99.91890       5.286311      108.2212       5.930182  715.7777 19.01720 744.6580 20.50611 -28.88025      27.96702 
1 1 1 8   10 6  o 324.8014 19.85687 20.65351       2.492675      21.37621       3.281685      19.66789       3.832389  329.5405 25.84984 314.8959 31.77261 14.64459       40.95990 
1 1 1 8   10 7  o 705.9648 14.50214 96.99305       3.975970      106.7484       10.28276      95.27815       4.311299  736.3722 35.95707 699.5410 15.86964 36.83124       39.30338 
1 1 1 8   10 8  o 672.1764 26.46344 88.33244       6.908082      90.15079       9.783160      86.52421       9.755901  675.7811 37.42331 661.8029 38.11988 13.97821       53.41937 
1 1 1 8   10 9  o 586.2443 14.35438 66.85625       3.268067      79.85081       9.157665      64.95982       3.498420  636.3528 37.21814 577.7758 15.59138 58.57703       40.35197 
1 1 1 8   10 10 o 1069.211 13.84591 222.3186       5.749273      212.1920       13.33033      224.6327       6.372419  1040.939 32.97521 1074.587 15.26985 -33.64807      36.33914 
1 1 1 8   10 11 o 219.3335 32.57542 9.610628       2.690453      7.657368       4.175794      10.99695       3.517966  193.7141 53.66182 233.4579 40.25602 -39.74374      67.08307 
1 1 1 8   10 12 o 682.2869 15.15868 90.52194       4.016581      86.76178       5.674254      94.29818       5.686372  667.4478 21.89089 695.9116 21.04036 -28.46375      30.36294 
1 1 1 8   10 13 o 664.6675 15.50063 85.89914       4.001122      87.54424       5.676490      84.27480       5.640565  670.5633 21.79777 657.9002 22.07672 12.66309       31.02458 
1 1 1 8   10 14 o 234.1841 32.98213 10.91583       2.916509      11.60481       3.994545      10.12923       4.268172  239.5002 44.58783 222.6105 50.52696 16.88976       67.38730 
1 1 1 8   10 15 o 1320.302 15.20673 338.8801       7.797168      330.7829       10.77320      347.7875       11.29932  1303.711 21.27823 1336.732 21.76608 -33.02014      30.43887 
1 1 1 8   10 16 o 700.2553 16.33994 95.34788       4.443599      96.05128       6.165948      94.58780       6.409523  702.3904 22.60441 696.9291 23.68149 5.461304       32.73794 
1 1 1 8   10 17 o 1092.551 21.97630 232.4218       9.324472      0.000000       0.000000      232.4218       9.324472  ?        ?        1092.551 21.97630 0.000000       21.97630 
1 1 1 8   10 18 f 440.6096 23.21113 37.92824       3.957706      39.06017       5.335268      36.54327       5.901560  446.1087 30.98777 430.6702 35.60462 15.43854       47.20096 
1 1 1 8   10 19 o 942.6160 16.56620 172.8480       6.064371      168.9304       8.312991      177.3045       8.866361  931.0828 22.99011 953.7398 23.93798 -22.65698      33.18994 
1 1 1 8   10 20 o 151.8185 53.19864 4.066684       3.874379      4.230362       5.139522      3.851236       5.896559  163.9150 60.75346 167.3850 64.39329 -3.469940      88.52954 
1 1 1 8   10 21 o 192.8353 53.61187 7.597806       4.160114      10.79676       5.557478      3.520716       6.274062  228.6152 61.32689 168.1014 65.92883 60.51387       90.04220 
1 1 1 8   10 22 o 307.1886 57.59775 19.41588       6.618854      15.52070       10.15660      22.29123       8.726313  273.7430 85.85078 325.9489 70.95078 -52.20596      111.3749 
1 1 1 8   10 23 o 1015.617 20.04007 201.1279       7.904184      200.6664       9.566744      202.1205       14.03055  1013.456 24.30700 1013.558 35.64495 -0.1021729     43.14386 
1 1 1 8   10 24 o 106.1518 48.17617 -2.336010      4.309251      -6.017219      5.712706      2.524068       6.563995  109.4367 51.61712 162.3016 66.12862 -52.86497      83.88875 
1 1 1 8   10 25 f 353.6086 35.86861 24.97536       4.857502      28.27367       6.372544      20.40120       7.504517  373.7015 44.80283 309.8255 64.46873 63.87601       78.50803 
1 1 1 8   10 26 o 594.7369 32.13733 70.10729       7.395162      68.93720       9.329107      72.08574       12.13088  585.9088 41.26339 592.8218 53.25976 -6.913086      67.37411 
1 1 1 8   10 27 o 738.9967 24.39905 107.3607       7.002344      121.2569       10.54296      96.39238       9.366688  780.4385 34.78532 695.8983 34.65870 84.54016       49.10442 
1 1 1 8   10 28 o 175.3585 60.85057 6.137821       5.063186      2.419105       6.564262      11.59984       7.955477  157.4584 65.34254 229.2097 76.33404 -71.75127      100.4815 
1 1 1 8   10 29 o 166.3688 60.30816 5.273265       5.020883      6.405515       6.806591      3.921815       7.436327  184.8886 69.64026 172.1944 70.29822 12.69417       98.95255 
1 1 1 8   11 0  o 450.5682 20.31396 39.64345       3.554538      40.84997       4.517653      37.68265       5.759190  455.9160 25.61909 435.7353 34.31141 20.18069       42.82069 
1 1 1 8   11 1  o 595.1032 21.08861 69.17646       4.873806      67.97232       10.87287      69.47925       5.452257  580.6841 48.66305 595.9676 23.55731 -15.28345      54.06514 
1 1 1 8   11 2  f 911.4115 14.64780 161.7472       5.184595      153.4518       7.122195      171.0983       7.561783  886.5067 20.68730 936.0641 20.80131 -49.55743      29.33699 
1 1 1 8   11 3  o 279.1412 26.59026 15.39882       2.847692      17.72300       4.046671      13.11873       4.008095  297.7155 35.71276 253.9646 42.11393 43.75093       55.21761 
1 1 1 8   11 4  o 393.9222 19.21367 30.26482       2.939333      25.14840       4.087012      35.74651       4.230383  356.7864 29.76827 426.6261 25.65237 -69.83969      39.29623 
1 1 1 8   11 5  o 241.8370 25.36184 11.56198       2.346491      11.39299       3.144982      11.77418       3.524176  238.1338 35.05599 241.2797 38.93605 -3.145889      52.39215 
1 1 1 8   11 6  o 622.4711 14.34565 75.40207       3.467908      78.07212       4.726591      72.28880       5.103829  632.8470 19.23186 608.6468 21.59249 24.20026       28.91540 
1 1 1 8   11 7  o 174.5979 61.51155 5.485184       5.184127      12.69195       7.360881      -1.607519      7.302395  246.7358 72.21442 147.9186 65.20849 98.81720       97.29887 
1 1 1 8   11 8  f 123.7869 39.21522 2.969381       2.114259      17.08962       7.602166      1.785671       2.201095  285.2722 69.30462 107.5460 39.77873 177.7262       79.90919 
1 1 1 8   11 9  o 473.8473 15.21324 43.67801       2.799549      55.74862       8.722355      42.29172       2.955942  530.3943 42.70736 466.2029 16.32649 64.19141       45.72169 
1 1 1 8   11 10 o 580.5018 14.25318 65.52808       3.213241      68.01653       9.230796      65.18497       3.427613  587.0544 40.74079 578.9203 15.24561 8.134094       43.49989 
1 1 1 8   11 11 f 1155.905 12.34264 259.6951       5.540618      256.2566       9.153712      261.6833       6.960508  1147.242 20.54538 1160.002 15.45091 -12.76001      25.70687 
1 1 1 8   11 12 o 659.6294 15.08600 84.59898       3.864579      91.77746       5.800492      78.86910       5.182288  686.5618 21.75491 636.5128 20.96459 50.04907       30.21242 
1 1 1 8   11 13 o 760.4382 14.90167 112.4171       4.400753      110.0242       6.256863      114.7598       6.190871  751.8333 21.42926 767.8998 20.75961 -16.06653      29.83579 
1 1 1 8   11 14 o 381.6607 21.54332 28.44109       3.180091      29.55327       4.410535      27.23685       4.589456  388.1663 29.47826 372.1980 32.06406 15.96826       43.55539 
1 1 1 8   11 15 o 1025.032 14.77709 204.2498       5.882399      205.6224       8.254765      202.8337       8.384694  1027.917 20.67849 1020.871 21.14893 7.045715       29.57832 
1 1 1 8   11 16 o 646.3556 16.86942 81.25136       4.234476      86.91322       5.866109      75.09125       6.118785  668.0745 22.60983 620.7487 25.38174 47.32581       33.99172 
1 1 1 8   11 17 o 680.5451 16.95535 90.09042       4.481174      90.15636       6.101321      90.01321       6.603049  680.2811 23.09444 679.5479 25.02053 0.7332153      34.04967 
1 1 1 8   11 18 o 88.88603 41.08379 -2.703093      3.332255      -4.737273      4.383202      0.8253674E-01  5.129305  96.35158 45.37461 132.7334 56.56561 -36.38185      72.51568 
1 1 1 8   11 19 o 394.5806 26.69847 30.51800       4.067118      30.02594       5.356009      31.18818       6.250612  389.9178 35.76917 396.3918 41.20634 -6.474060      54.56552 
1 1 1 8   11 20 o 120.8843 49.93554 0.8711849      3.808473      -2.024861      5.001950      4.865996       5.874687  118.5130 53.00053 175.0599 64.93969 -56.54686      83.82255 
1 1 1 8   11 21 f 1166.905 18.62294 265.1518       8.439398      265.5297       10.42139      264.4319       14.38488  1166.873 22.99716 1162.164 31.87212 4.708862       39.30268 
1 1 1 8   11 22 o 511.0350 37.37111 51.65355       7.365331      76.63253       11.40290      33.77156       9.647967  619.7448 47.74549 405.0040 63.42225 214.7408       79.38522 
1 1 1 8   11 23 o 725.5102 24.93613 102.9346       7.025876      86.02895       12.38129      110.9640       8.532745  654.9913 49.03029 752.2886 29.20628 -97.29730      57.06992 
1 1 1 8   11 24 o 303.1863 39.74784 18.51880       4.567314      23.40545       5.974119      11.64495       7.085456  339.3787 46.55418 235.1199 71.35403 104.2587       85.19795 
1 1 1 8   11 25 o 568.1079 26.69574 63.37868       5.889803      55.48156       8.406924      70.99123       8.254059  525.8944 41.50058 597.6229 35.72781 -71.72852      54.76107 
1 1 1 8   11 26 o 596.3541 30.98588 70.48727       7.151501      76.65303       9.085854      60.44737       11.59411  618.8489 37.98904 539.7295 56.13507 79.11938       67.78137 
1 1 1 8   11 27 o 575.8293 28.35589 65.55132       6.341106      71.71486       7.622210      51.69692       11.42772  599.6404 32.85628 492.9622 60.99397 106.6782       69.28059 
1 1 1 8   11 28 o 413.9657 33.31944 34.42998       5.311250      30.81003       7.140055      38.91447       7.947072  384.1038 48.98063 432.7443 48.10159 -48.64047      68.65031 
1 1 1 8   12 0  o 388.3807 26.31051 29.68717       3.944983      36.60155       5.563626      22.69559       5.594601  429.7362 33.60462 334.9863 44.07450 94.74991       55.42411 
1 1 1 8   12 1  o 946.7724 14.90808 174.5478       5.481448      167.0920       7.592804      182.6631       7.921515  925.0161 21.13610 967.1686 21.09007 -42.15253      29.85843 
1 1 1 8   12 2  o 287.0259 28.00741 16.29898       3.082142      17.52072       4.224607      14.90865       4.506666  295.5819 37.65818 270.5663 44.43260 25.01559       58.24427 
1 1 1 8   12 3  o 796.4609 14.79724 123.4898       4.576919      116.8238       6.368836      130.6092       6.581902  773.6336 21.19809 818.1017 20.71648 -44.46814      29.64004 
1 1 1 8   12 4  o 752.1130 20.28165 110.3383       5.923990      0.000000       0.000000      110.3383       5.923990  ?        ?        752.1130 20.28165 0.000000       20.28165 
1 1 1 8   12 5  o 563.4896 19.37218 61.89089       4.239284      66.95238       4.808342      44.22355       8.983427  585.8662 21.13338 468.8126 50.11830 117.0536       54.39176 
1 1 1 8   12 6  f 581.8535 14.20381 65.86451       3.209568      67.55770       4.406248      63.95068       4.684554  588.8150 19.26913 572.6857 21.06318 16.12933       28.54745 
1 1 1 8   12 7  o 216.5233 27.42272 9.305257       2.254230      23.87679       8.067980      8.071377       2.347732  339.8651 63.46047 200.7471 31.12162 139.1180       70.68089 
1 1 1 8   12 8  o 905.1641 24.24549 159.8186       8.522880      150.9335       11.79448      169.5283       12.32966  877.5806 34.60700 930.1861 34.13135 -52.60547      48.60651 
1 1 1 8   12 9  o 310.7589 47.10375 19.45323       5.506496      25.79100       8.043375      13.86271       7.554335  355.3309 60.45277 258.6136 72.36758 96.71725       94.29530 
1 1 1 8   12 10 o 1177.912 23.53821 270.3765       10.76749      263.6202       14.97161      277.6153       15.49702  1161.063 33.20358 1191.410 33.49339 -30.34717      47.16233 
1 1 1 8   12 11 o 770.2881 13.33129 115.3331       3.987984      126.1225       11.43132      113.8381       4.255332  802.7897 36.66628 765.2183 14.31925 37.57141       39.36314 
1 1 1 8   12 12 o 318.9197 23.19854 19.91060       2.853540      25.36050       4.440689      16.07741       3.724224  358.9798 32.19532 284.8232 34.36338 74.15665       47.08907 
1 1 1 8   12 13 o 763.0461 14.73346 113.1840       4.365998      118.2119       6.313754      108.5766       6.043985  779.3727 20.86001 746.9370 20.83586 32.43567       29.48343 
1 1 1 8   12 14 f 911.4747 14.68838 161.5004       5.199321      156.9545       7.153146      166.5922       7.570492  898.0780 20.50950 925.1843 21.07016 -27.10632      29.40393 
1 1 1 8   12 15 o 1056.747 20.67563 217.3528       8.485120      217.3528       8.485120      0.000000       0.000000  1056.747 20.67563 ?        ?        0.000000       20.67563 
1 1 1 8   12 16 o 268.4103 30.67666 14.24938       3.140248      13.90799       4.175997      14.69363       4.763791  262.9988 42.32201 269.4714 47.24342 -6.472626      63.42786 
1 1 1 8   12 17 o 466.5706 20.89393 42.39100       3.785869      41.51255       5.014996      43.55492       5.772649  460.3231 28.18883 471.0084 31.74378 -10.68527      42.45324 
1 1 1 8   12 18 o 796.0908 16.65782 123.2972       5.150019      126.4348       7.068614      119.7474       7.518653  805.5106 22.59618 783.6500 24.70529 21.86066       33.48042 
1 1 1 8   12 19 o 595.7032 19.83705 69.10131       4.589178      76.52462       6.220453      60.23529       6.798105  626.2988 25.57481 554.0714 31.72511 72.22736       40.74990 
1 1 1 8   12 20 o 1076.506 18.33971 225.6189       7.667203      226.4711       9.453560      223.9810       13.10650  1077.805 22.58537 1069.838 31.54574 7.967163       38.79733 
1 1 1 8   12 21 o 315.8272 38.43744 19.90282       4.617241      16.21945       5.395115      29.98525       8.926075  281.6212 51.21628 381.9265 62.33036 -100.3054      80.67329 
1 1 1 8   12 22 o 640.3511 21.09485 80.00094       5.245932      86.70174       7.077293      71.82997       7.815208  665.5515 27.38152 603.7125 33.46454 61.83899       43.23914 
1 1 1 8   12 23 o 603.9009 28.17625 71.52411       6.608105      90.85632       12.40017      63.85651       7.809380  672.8840 47.76283 567.8841 35.59005 104.9999       59.56458 
1 1 1 8   12 24 o 866.8499 27.72927 147.5686       9.334914      0.000000       0.000000      147.5686       9.334914  ?        ?        866.8499 27.72927 0.000000       27.72927 
1 1 1 8   12 25 o 439.4344 31.84945 38.34580       5.398416      38.02635       7.621833      38.66739       7.647255  432.4430 46.09440 436.2211 45.82589 -3.778137      64.99774 
1 1 1 8   12 26 o 239.4086 51.99493 12.15296       4.695819      14.71128       6.102461      8.438984       7.352707  260.5620 61.32649 205.5821 73.16663 54.97993       95.46882 
1 1 1 8   12 27 o 120.9528 54.17063 -1.588530      5.245608      -4.464045      6.244410      5.306041       9.669126  119.9004 55.70493 195.2978 79.99426 -75.39743      97.47882 
1 1 1 8   12 28 o 181.6280 59.45955 6.944902       4.834557      9.037916       6.607121      4.532809       7.092887  204.9826 69.56596 173.7059 69.46240 31.27664       98.30792 
1 1 1 8   13 0  o 505.2679 21.07092 49.83451       4.134596      49.86213       5.320708      49.79243       6.569041  503.7921 27.29693 501.8677 33.90307 1.924408       43.52632 
1 1 1 8   13 1  o 518.0829 18.95852 52.33299       3.814447      55.04189       5.406578      49.64827       5.382390  530.3290 26.25120 502.7162 27.67581 27.61282       38.14546 
1 1 1 8   13 2  o 381.5528 22.29745 28.51713       3.289606      30.68652       4.673690      26.38717       4.631015  394.3506 30.76081 365.0377 33.02469 29.31284       45.13155 
1 1 1 8   13 3  o 911.7532 17.79109 161.9451       6.299525      160.8901       7.262845      165.1497       12.65790  908.2771 20.59019 916.2725 35.57205 -7.995361      41.10142 
1 1 1 8   13 4  o 347.4058 28.75906 23.78038       3.845180      25.10981       4.272923      18.11980       8.817039  356.6104 31.16648 291.9673 76.74920 64.64316       82.83591 
1 1 1 8   13 5  o 248.1622 26.98987 12.17537       2.559203      13.88677       3.738977      10.66687       3.510351  263.2037 37.65199 229.3706 40.90832 33.83310       55.59823 
1 1 1 8   13 6  o 756.7443 13.62143 111.3674       4.003132      111.6828       5.614950      111.0414       5.708784  757.2590 19.09297 755.0364 19.46918 2.222656       27.26886 
1 1 1 8   13 7  o 1312.390 23.63091 335.8600       12.04402      339.0181       17.24061      332.8498       16.83236  1315.669 33.74256 1303.808 33.24324 11.86011       47.36742 
1 1 1 8   13 8  f 462.7381 35.77736 42.19108       6.379464      37.19329       8.765032      47.82096       9.302814  430.2710 53.61797 489.7245 49.59818 -59.45358      73.04017 
1 1 1 8   13 9  o 1028.868 24.03255 206.3065       9.602570      200.0835       13.30886      213.0639       13.86860  1011.401 33.88358 1043.618 34.21866 -32.21661      48.15614 
1 1 1 8   13 10 o 1600.978 24.54687 499.4535       15.26193      500.0212       21.55557      498.8829       21.61179  1599.086 34.71040 1597.223 34.84154 1.863403       49.18074 
1 1 1 8   13 11 o 316.9942 49.74962 20.23055       5.922843      16.86904       8.254566      23.79769       8.503303  285.2636 73.91148 340.4549 66.69892 -55.19128      99.55729 
1 1 1 8   13 12 o 836.6437 25.32465 136.3756       8.228335      128.7878       11.43378      144.5267       11.85066  811.6070 36.27571 859.8970 35.48691 -48.29004      50.74691 
1 1 1 8   13 13 o 900.2477 14.17648 157.5368       4.956310      159.5147       7.123148      155.6805       6.900704  905.3823 20.25872 894.4719 19.86546 10.91034       28.37345 
1 1 1 8   13 14 o 768.6811 14.95478 114.8763       4.464308      126.0640       6.493178      104.8467       6.147931  804.7772 20.77560 733.8661 21.57169 70.91107       29.94935 
1 1 1 8   13 15 o 840.8564 15.03160 137.4797       4.908571      141.2898       6.856876      133.4748       7.029893  851.9017 20.72568 827.8845 21.86508 24.01715       30.12699 
1 1 1 8   13 16 o 502.1715 18.83432 49.08070       3.673076      48.60514       4.899505      49.69095       5.550156  498.6223 25.38582 503.7403 28.48747 -5.117981      38.15725 
1 1 1 8   13 17 o 225.5798 38.49118 10.25328       3.251010      13.08155       4.194144      5.996207       5.145627  254.3514 44.05591 180.0125 61.39025 74.33897       75.56247 
1 1 1 8   13 18 o 947.4811 15.85011 174.6306       5.832181      182.5784       8.151601      166.2956       8.347797  968.0445 21.68301 923.6345 23.27254 44.40997       31.80824 
1 1 1 8   13 19 o 552.3489 22.73196 59.47655       4.876164      69.44334       6.034419      40.72401       8.277282  596.4680 26.05076 451.5900 47.92976 144.8780       54.55185 
1 1 1 8   13 20 o 477.2988 23.52318 44.44739       4.360281      46.85584       5.632771      40.84646       6.887477  488.4647 29.83654 453.9637 39.45961 34.50098       49.46999 
1 1 1 8   13 21 o 258.3267 42.00735 13.50929       4.069470      8.079342       5.214931      21.96476       6.507578  199.6614 61.33771 327.9233 52.89999 -128.2619      80.99829 
1 1 1 8   13 22 o 367.9046 31.21423 26.77126       4.417725      27.97495       5.731892      25.01006       6.933405  373.9875 40.09007 349.6550 52.69593 24.33246       66.21235 
1 1 1 8   13 23 o 318.7763 41.34316 20.51143       4.997666      23.45816       6.950213      17.35653       7.191495  336.7248 55.05183 285.1745 66.20744 51.55029       86.10534 
1 1 1 8   13 24 o 148.5131 64.23957 -0.2311835E-01 6.803148      0.000000       0.000000      -0.2311835E-01 6.803148  ?        ?        148.5131 64.23957 0.000000       64.23957 
1 1 1 8   13 25 o 267.4086 46.29592 14.81673       4.633698      12.45378       6.020227      18.25130       7.258072  239.7663 63.60736 289.6739 65.99180 -49.90756      91.65595 
1 1 1 8   13 26 o 388.3858 32.51514 30.18781       4.859175      36.45404       6.522342      22.37160       7.284472  423.9227 40.09374 322.1809 60.43990 101.7418       72.52923 
1 1 1 8   13 27 o 438.1652 29.93521 38.31142       5.063386      44.74229       7.009476      31.29398       7.322173  469.5193 38.78917 386.5647 49.94196 82.95456       63.23606 
1 1 1 8   14 0  o 569.8856 18.53731 63.28627       4.102630      63.85157       5.795176      62.71830       5.808837  571.4329 26.11400 566.2936 26.41311 5.139282       37.14288 
1 1 1 8   14 1  o 1116.490 15.13078 242.6020       6.560612      240.8033       9.162492      244.4945       9.398211  1111.122 21.23361 1119.515 21.61660 -8.392822      30.30088 
1 1 1 8   14 2  o 597.5427 21.74170 69.64155       5.045341      66.83236       5.578971      82.25461       11.82154  585.0089 24.55634 642.3258 47.73151 -57.31696      53.67785 
1 1 1 8   14 3  o 566.0002 17.40393 62.37447       3.825533      64.32777       5.363426      60.35163       5.458058  574.0880 24.05669 555.9131 25.28152 18.17487       34.89813 
1 1 1 8   14 4  o 138.6629 43.75213 3.746971       2.633800      6.113211       3.886497      1.737365       3.581661  174.6333 52.81239 125.2444 49.59159 49.38895       72.44636 
1 1 1 8   14 5  o 489.0511 17.06455 46.54758       3.240986      48.10866       4.779111      45.21832       4.410002  496.5572 24.78277 481.5188 23.58292 15.03842       34.21023 
1 1 1 8   14 6  o 1317.221 14.52748 337.4277       7.431505      317.4603       9.903968      363.1558       11.24225  1276.783 19.97396 1365.335 21.20245 -88.55225      29.12908 
1 1 1 8   14 7  o 138.7089 59.67683 -0.2905084     5.807635      6.279568       8.142418      -7.094233      8.285935  202.0602 76.15627 137.6039 64.00905 64.45624       99.48335 
1 1 1 8   14 8  o 1144.795 23.85006 255.3839       10.60340      245.8876       14.62371      265.9111       15.39711  1121.362 33.58026 1166.023 34.00196 -44.66150      47.78878 
1 1 1 8   14 9  o 422.0476 38.29243 35.16086       6.207957      35.43824       8.628901      34.86326       8.938009  420.3665 54.11309 416.2327 56.77480 4.133850       78.43217 
1 1 1 8   14 10 o 268.2082 59.78797 14.78242       6.068549      20.12044       8.351051      8.809525       8.833722  311.7589 70.61366 224.3370 80.15961 87.42184       106.8263 
1 1 1 8   14 11 o 810.7955 26.40551 128.1250       8.314457      122.3178       11.26875      135.0639       12.31802  790.8448 36.69073 830.7836 38.17905 -39.93878      52.95139 
1 1 1 8   14 12 o 1314.676 24.15193 336.6664       12.33101      316.8435       16.62424      360.9131       18.38588  1273.514 33.61321 1358.892 34.83946 -85.37769      48.41111 
1 1 1 8   14 13 o 213.9505 66.20191 9.106937       6.062432      12.33903       8.280263      5.372552       8.900440  248.1790 77.46449 202.3103 78.75153 45.86873       110.4652 
1 1 1 8   14 14 o 968.3781 14.32896 182.3216       5.388744      193.7334       7.856996      172.1857       7.404765  997.5909 20.28038 940.4789 20.27376 57.11194       28.67610 
1 1 1 8   14 15 o 116.7020 44.45030 1.876733       2.792375      3.872454       3.647485      -0.9491136     4.340282  147.9453 51.62998 115.5448 50.62305 32.40046       72.30732 
1 1 1 8   14 16 o 850.7604 15.29192 140.7731       5.052394      142.2330       6.993022      139.1788       7.307689  854.5360 21.07204 845.1597 22.26452 9.376282       30.65517 
1 1 1 8   14 17 o 296.3666 28.98803 17.31923       3.293665      16.79309       4.211059      18.14827       5.285981  290.1183 38.31287 299.9336 46.91837 -9.815338      60.57401 
1 1 1 8   14 18 f 931.5203 17.46710 168.8855       6.318893      181.2642       8.046603      148.9712       10.20605  964.4813 21.48279 872.8823 30.10746 91.59906       36.98608 
1 1 1 8   14 19 o 277.1403 35.29733 15.30532       3.712769      16.02370       4.711076      14.12778       6.031577  281.6540 44.55223 260.7276 60.70287 20.92639       75.29767 
1 1 1 8   14 20 o 199.2099 49.47452 8.193997       3.810178      7.201925       4.799462      9.884933       6.265916  189.4820 58.94888 219.8612 67.18378 -30.37920      89.37914 
1 1 1 8   14 21 o 293.2869 36.89024 17.21597       4.108803      13.52242       5.164418      23.58596       6.782168  255.2186 53.80067 339.3871 53.20612 -84.16841      75.66640 
1 1 1 8   14 22 o 414.0226 31.15981 33.89861       4.973370      30.74859       6.851758      37.40632       7.230313  389.9594 46.13766 431.3877 43.76384 -41.42831      63.59212 
1 1 1 8   14 23 o 854.5800 20.72995 142.7519       6.879849      153.0576       10.32783      134.5305       9.224531  881.6424 30.16399 827.0991 28.71830 54.54327       41.64861 
1 1 1 8   14 24 o 454.2946 27.91938 40.78715       4.901881      43.56121       6.407096      36.87135       7.612249  467.0488 35.59203 425.1104 46.88888 41.93845       58.86730 
1 1 1 8   14 25 o 472.5169 36.27998 44.81442       6.606698      50.47934       12.33383      42.53496       7.823800  483.5306 67.52442 456.4567 44.70974 27.07394       80.98461 
1 1 1 8   14 26 o 220.5740 52.77262 10.46509       4.459959      15.50153       5.880482      3.644870       6.843057  267.0944 58.32601 167.1838 67.74129 99.91060       89.39131 
1 1 1 8   14 27 o 302.6240 40.24068 18.84917       4.612044      19.42990       6.331209      18.19257       6.732062  299.6623 56.47496 286.7575 62.23788 12.90475       84.04150 
1 1 1 8   15 0  o 679.6535 21.24768 90.05615       5.608247      95.91013       6.444960      71.79930       11.38172  701.0577 23.67219 599.7397 49.30370 101.3180       54.69211 
1 1 1 8   15 1  o 1343.985 15.66262 351.4808       8.174983      342.1853       11.18709      362.1327       11.97548  1324.803 21.74393 1362.641 22.62994 -37.83789      31.38332 
1 1 1 8   15 2  o 811.2348 15.74142 128.0479       4.959277      126.6046       6.903366      129.5871       7.129029  805.8632 22.05828 815.2318 22.51756 -9.368652      31.52155 
1 1 1 8   15 3  o 136.3757 45.73660 3.455992       2.855589      0.3181146      4.144028      6.293187       3.940481  121.1808 51.20788 177.0569 53.09559 -55.87609      73.76577 
1 1 1 8   15 4  o 905.4114 14.75477 159.4357       5.188078      152.5243       7.187677      166.9529       7.496141  884.8553 20.91647 925.7722 20.84998 -40.91693      29.53337 
1 1 1 8   15 5  o 567.5648 16.19590 62.66419       3.569838      60.26502       5.189969      64.81853       4.918027  555.9861 24.03659 576.7993 21.95524 -20.81323      32.55442 
1 1 1 8   15 6  o 903.3649 14.01356 158.6638       4.916316      160.9522       7.071299      156.5227       6.839913  909.2530 20.02564 896.6983 19.64157 12.55469       28.05027 
1 1 1 8   15 7  o 670.3641 29.45352 87.72153       7.667891      92.88035       10.92786      82.71803       10.76211  686.8868 41.15549 647.6624 43.03277 39.22449       59.54488 
1 1 1 8   15 8  o 1080.584 24.71040 227.5279       10.36971      220.8662       14.02650      235.5576       15.39942  1062.996 33.97739 1097.307 36.13668 -34.31116      49.60163 
1 1 1 8   15 9  o 141.2575 60.56475 -0.1907069     5.944957      -4.680277      8.042589      5.217226       8.826919  144.1283 65.56701 200.9144 78.36510 -56.78612      102.1769 
1 1 1 8   15 10 o 1058.354 24.79782 218.2317       10.19230      205.5312       13.85545      233.2092       15.04626  1025.432 34.79250 1092.155 35.47449 -66.72290      49.68861 
1 1 1 8   15 11 f 469.2140 37.91568 43.36676       6.850009      43.52110       9.365919      43.18925       10.04438  467.0367 52.55107 464.1673 56.91362 2.869446       77.46467 
1 1 1 8   15 12 o 395.6287 43.77886 31.09871       6.613627      33.18230       8.984575      28.63442       9.770998  405.3244 58.79362 373.0349 70.01842 32.28952       91.42903 
1 1 1 8   15 13 o 672.2811 30.04669 88.26375       7.844686      106.5436       11.31011      71.31683       10.88994  736.0206 39.71543 600.0497 47.11024 135.9709       61.61729 
1 1 1 8   15 14 o 202.6778 42.69755 8.371756       3.254668      8.547235       3.487407      7.187145       9.061034  204.5025 45.12128 213.9903 80.39891 -9.487808      92.19498 
1 1 1 8   15 15 o 216.2079 36.47117 9.407207       2.953345      12.83272       3.896817      4.784211       4.526988  252.4208 41.17124 164.1436 57.50551 88.27722       70.72449 
1 1 1 8   15 16 o 422.5052 22.14242 34.88085       3.620524      40.80347       4.481207      23.74724       6.144068  456.6395 25.36929 343.8717 47.25696 112.7678       53.63600 
1 1 1 8   15 17 o 514.2993 20.78661 51.53066       4.151715      54.66609       4.985996      44.44138       7.497297  529.3993 24.25161 473.6182 41.17092 55.78107       47.78269 
1 1 1 8   15 18 o 749.3820 17.04825 109.3097       4.961479      119.5688       6.687742      96.75146       7.399266  783.1298 21.98962 703.7249 27.07434 79.40497       34.87926 
1 1 1 8   15 19 o 480.5340 22.22526 45.05024       4.147620      44.64348       5.280463      45.70538       6.701536  476.7787 28.65151 480.8501 36.15154 -4.071350      46.12855 
1 1 1 8   15 20 o 134.7143 51.57962 2.554080       3.772215      11.08925       4.690441      -13.07554      6.347195  230.9352 53.36988 96.86476 47.69831 134.0704       71.57845 
1 1 1 8   15 21 o 532.2960 24.81346 55.45602       5.129422      63.29980       7.086277      46.82256       7.434438  566.2469 32.35863 484.5637 39.86003 81.68329       51.34105 
1 1 1 8   15 22 o 718.4996 21.43010 100.9303       5.979691      105.7721       8.699555      96.59409       8.232852  732.9530 30.56279 700.5262 30.26202 32.42682       43.01016 
1 1 1 8   15 23 o 100.8560 45.94095 -2.244747      3.964684      -5.456686      4.967721      3.390319       6.579957  100.7751 47.71402 166.3004 66.76099 -65.52531      82.05886 
1 1 1 8   15 24 o 221.7635 50.38563 10.40380       4.240703      12.67740       5.426003      6.835320       6.797738  242.7706 58.28786 191.1225 70.03619 51.64807       91.11829 
1 1 1 8   15 25 o 436.2698 36.82427 38.39011       6.180727      36.10590       12.34157      39.15479       7.140727  395.0115 83.08478 437.9527 42.52023 -42.94116      93.33301 
1 1 1 8   15 26 o 159.7984 62.46352 3.990174       5.617462      9.542425       11.36083      2.193421       6.462786  223.1977 88.33970 154.4663 64.52892 68.73134       109.3978 
1 1 1 8   16 0  o 894.8342 16.19160 155.8025       5.626784      156.6636       7.829749      154.8828       8.091663  896.4501 22.49022 891.1986 23.37951 5.251526       32.44089 
1 1 1 8   16 1  o 136.3210 49.31830 3.073021       3.355314      -0.8524045     4.613539      7.480591       4.888666  119.8638 52.36193 193.3855 59.38435 -73.52172      79.17242 
1 1 1 8   16 2  o 974.7953 21.59206 185.1352       8.174016      185.1352       8.174016      0.000000       0.000000  974.7953 21.59206 ?        ?        0.000000       21.59206 
1 1 1 8   16 3  o 1090.661 15.03431 231.3419       6.367976      224.6043       8.823543      238.6660       9.199578  1073.842 21.15800 1106.907 21.40073 -33.06531      30.09406 
1 1 1 8   16 4  o 515.6437 18.03949 51.73981       3.612451      54.90576       5.189231      48.76287       5.031953  530.6490 25.18069 499.3426 26.03856 31.30649       36.22256 
1 1 1 8   16 5  o 627.7747 15.70916 76.64308       3.829877      75.74017       5.522766      77.47956       5.315694  623.5359 22.80695 630.7515 21.70070 -7.215637      31.48138 
1 1 1 8   16 6  f 1339.129 21.09230 349.1328       10.96918      0.000000       0.000000      349.1328       10.96918  ?        ?        1339.129 21.09230 0.000000       21.09230 
1 1 1 8   16 7  o 553.4440 33.73904 60.08416       7.216978      54.92038       9.765494      66.29845       10.71286  526.1696 48.33063 578.5611 48.11555 -52.39148      68.19792 
1 1 1 8   16 8  o 731.8287 28.23404 104.4647       8.024362      102.7492       10.93474      106.4666       11.81233  723.2847 39.07376 735.7580 41.50972 -12.47333      57.00716 
1 1 1 8   16 9  o 440.8547 39.35793 38.36472       6.667528      34.01734       8.886729      43.96374       10.08518  411.0335 57.22430 468.3785 56.59195 -57.34497      80.48148 
1 1 1 8   16 10 o 893.3813 26.44786 155.6131       9.176042      149.9516       12.48252      162.2697       13.53505  875.3251 36.72020 910.2574 38.28844 -34.93231      53.05070 
1 1 1 8   16 11 o 1106.232 25.10887 238.5560       10.78702      229.4817       14.65411      249.2883       15.93678  1083.032 34.84096 1128.425 36.36634 -45.39307      50.36272 
1 1 1 8   16 12 o 881.5298 27.04494 151.6236       9.258720      148.7252       12.74458      154.8629       13.47341  871.0953 37.67315 888.5821 39.04380 -17.48682      54.25573 
1 1 1 8   16 13 o 892.8600 26.29618 155.5431       9.118094      145.7222       12.46289      166.8545       13.37527  862.1426 37.22301 922.5137 37.33376 -60.37109      52.71966 
1 1 1 8   16 14 f 384.6787 47.03161 29.60499       6.879795      26.08634       9.252656      33.95566       10.28858  354.7280 69.65095 406.6382 67.51894 -51.91022      97.00547 
1 1 1 8   16 15 o 516.0935 22.56288 51.91502       4.522211      51.91502       4.522211      0.000000       0.000000  516.0935 22.56288 ?        ?        0.000000       22.56288 
1 1 1 8   16 16 o 574.2945 18.48403 64.21267       4.122486      79.41114       5.151165      37.13645       6.875423  638.4301 20.77610 432.5388 41.43758 205.8912       46.35428 
1 1 1 8   16 17 o 361.3820 24.20802 25.59691       3.377814      29.28087       4.153354      18.40045       5.804990  386.0731 27.88904 300.5144 51.59899 85.55872       58.65368 
1 1 1 8   16 18 o 80.67337 38.07190 -3.475985      3.115807      -5.865561      3.727089      2.070023       5.678055  80.98113 39.12559 151.5298 61.59529 -70.54865      72.97118 
1 1 1 8   16 19 o 503.9738 21.35620 49.56760       4.179843      52.10740       5.302097      45.39766       6.793812  515.3455 26.58294 478.5949 36.83553 36.75058       45.42586 
1 1 1 8   16 20 o 448.8228 26.03599 39.58179       4.518630      39.83471       6.026759      39.25708       6.828732  448.1768 34.90154 443.4255 40.08789 4.751373       53.15220 
1 1 1 8   16 21 o 1077.409 18.37669 226.5149       7.689104      233.4986       11.75100      221.2861       10.16803  1090.470 27.74809 1062.823 24.63474 27.64697       37.10562 
1 1 1 8   16 22 o 445.2609 25.89790 39.05866       4.458893      41.23887       5.637516      35.41607       7.286918  455.8528 32.04835 417.5826 45.67878 38.27020       55.80006 
1 1 1 8   16 23 o 257.2022 43.22951 13.63581       4.164825      13.04102       5.242301      14.65369       6.857826  247.2613 55.90500 258.6304 67.54330 -11.36911      87.67820 
1 1 1 8   16 24 o 506.6246 24.41253 50.52008       4.803160      60.04773       6.402909      38.25883       7.263599  549.6388 30.11116 432.5316 43.84806 117.1072       53.19149 
1 1 1 8   16 25 o 212.0278 52.34120 9.692945       4.283902      3.820735       5.527017      18.52903       6.779845  158.0344 61.90747 290.2427 62.03058 -132.2083      87.63748 
1 1 1 8   17 0  o 932.7298 16.19232 169.2394       5.865335      172.7566       8.232218      165.6130       8.358907  941.5725 22.51309 921.7769 23.35047 19.79559       32.43584 
1 1 1 8   17 1  o 636.9385 18.07188 78.94899       4.470219      75.29277       6.130880      83.09908       6.531843  621.3499 25.40730 652.7260 25.76777 -31.37604      36.18714 
1 1 1 8   17 2  o 223.7725 40.70632 10.12507       3.407183      11.57786       4.750641      8.586218       4.889318  237.5116 52.86454 205.3726 58.48491 32.13902       78.83618 
1 1 1 8   17 3  o 200.7130 42.61702 8.206243       3.219242      5.240599       4.567818      11.13294       4.537722  169.1717 57.84013 233.0768 51.50341 -63.90509      77.44728 
1 1 1 8   17 4  o 985.4296 15.03443 188.8208       5.753611      189.8867       8.180060      187.7772       8.094286  987.5161 21.32968 982.0291 21.22395 5.487000       30.09006 
1 1 1 8   17 5  o 840.6439 14.92267 137.4043       4.871768      138.1122       7.008078      136.7423       6.777165  842.2118 21.42642 838.0884 20.82238 4.123413       29.87746 
1 1 1 8   17 6  o 335.8462 21.66585 22.05304       2.810744      23.93746       4.304160      20.65193       3.711375  348.5913 32.15640 323.9214 29.83852 24.66989       43.86766 
1 1 1 8   17 7  f 982.4183 17.90752 187.7640       6.832190      184.2507       7.667039      201.3123       15.05605  972.9225 20.29184 1013.840 38.23963 -40.91742      43.29005 
1 1 1 8   17 8  o 568.7443 33.47745 63.44881       7.361695      61.85748       9.954985      65.36926       10.93605  558.9808 46.27419 573.9478 49.54946 -14.96698      67.79712 
1 1 1 8   17 9  o 661.2249 31.53237 85.42912       8.097178      79.28908       10.90483      92.97473       12.08874  633.5447 44.60615 686.0251 45.63497 -52.48047      63.81425 
1 1 1 8   17 10 o 548.3229 35.09672 59.09199       7.434400      65.91369       10.23231      51.46426       10.81994  576.8200 46.06197 506.7130 55.91512 70.10696       72.44450 
1 1 1 8   17 11 o 266.7618 64.81138 14.76969       6.648085      16.88997       8.953196      12.16394       9.925412  284.3522 78.49907 251.1831 85.26376 33.16911       115.8966 
1 1 1 8   17 12 o 910.5165 27.29726 161.8490       9.652390      173.3064       13.62153      150.2935       13.67974  940.0059 37.31362 874.6542 40.27295 65.35168       54.90188 
1 1 1 8   17 13 o 810.6119 28.87687 128.3843       9.090569      122.1563       12.38450      135.6601       13.38583  787.3179 40.64284 830.5396 41.50085 -43.22162      58.08753 
1 1 1 8   17 14 o 683.8430 43.13241 92.44036       11.39612      92.44036       11.39612      0.000000       0.000000  683.8430 43.13241 ?        ?        0.000000       43.13241 
1 1 1 8   17 15 o 1200.398 35.88502 282.6798       16.72886      282.6798       16.72886      0.000000       0.000000  1200.398 35.88502 ?        ?        0.000000       35.88502 
1 1 1 8   17 16 o 412.5791 24.14489 33.33137       3.851796      31.67234       4.124724      44.63763       10.76779  401.7817 26.58509 468.5879 60.58987 -66.80618      66.16570 
1 1 1 8   17 17 o 537.6398 18.16440 56.30805       3.792630      61.27015       4.923788      49.06894       5.947153  560.3357 22.62680 499.4726 30.81023 60.86313       38.22620 
1 1 1 8   17 18 o 322.3938 28.20389 20.51225       3.495682      30.02091       4.233237      0.1291772      6.197948  390.5015 28.10188 144.4608 61.88643 246.0406       67.96797 
1 1 1 8   17 19 o 398.8074 26.52170 31.29359       4.084221      31.08345       5.226977      31.62302       6.544558  395.7110 34.35386 396.7006 43.17777 -0.9895630     55.17706 
1 1 1 8   17 20 o 613.1197 20.78056 73.45271       4.948009      76.99616       6.796168      69.45576       7.217946  626.1559 27.94819 593.0242 31.45347 33.13171       42.07639 
1 1 1 8   17 21 o 167.0917 51.54290 5.688620       3.678109      6.603685       4.465971      3.759278       6.484768  180.0272 56.99061 168.2741 66.69733 11.75317       87.72948 
1 1 1 8   17 22 o 423.3586 32.72351 35.71682       5.338399      35.71682       5.338399      0.000000       0.000000  423.3586 32.72351 ?        ?        0.000000       32.72351 
1 1 1 8   17 23 o 301.9772 35.84079 18.44651       4.121138      18.96557       5.228663      17.59518       6.696219  302.5291 45.94864 284.2143 62.37896 18.31479       77.47523 
1 1 1 8   17 24 o 108.5282 47.99931 -0.8427112     3.988283      -2.358532      5.075161      1.604917       6.449094  114.6852 52.13881 151.2365 63.89356 -36.55136      82.46722 
1 1 1 8   17 25 o 448.2238 26.23315 39.88934       4.546486      42.33400       6.071225      36.76796       6.860235  458.2549 34.36493 422.8831 42.34146 35.37180       54.53207 
1 1 1 8   18 0  o 1299.743 16.41174 328.6188       8.284000      319.3886       11.27099      339.4631       12.21677  1280.318 22.66817 1319.702 23.83705 -39.38440      32.89454 
1 1 1 8   18 1  o 1097.949 16.11370 234.4755       6.870767      234.3304       9.641442      234.6252       9.793813  1096.706 22.63725 1097.340 22.98172 -0.6336670     32.25840 
1 1 1 8   18 2  o 706.7598 24.66943 97.37130       6.771095      0.000000       0.000000      97.37130       6.771095  ?        ?        706.7598 24.66943 0.000000       24.66943 
1 1 1 8   18 3  f 1551.914 16.36318 468.4537       9.861960      457.4666       13.50632      481.0014       14.43366  1532.413 22.69515 1571.116 23.65594 -38.70374      32.78221 
1 1 1 8   18 4  o 819.6966 15.66556 130.6687       4.986858      131.6372       7.127092      129.7397       6.980166  822.0783 22.32396 816.1660 22.02213 5.912354       31.35814 
1 1 1 8   18 5  o 116.3168 44.48976 1.824697       2.804672      4.111710       4.168156      -0.6753333E-01 3.791374  154.8427 55.09068 113.5324 48.51349 41.31023       73.40669 
1 1 1 8   18 6  o 535.0233 16.90672 55.68460       3.512852      57.96763       5.219802      53.79458       4.749309  545.3224 24.64749 525.4371 23.27457 19.88531       33.89992 
1 1 1 8   18 7  o 379.7065 19.94796 28.14641       2.931233      19.88987       4.306660      35.27247       4.000978  316.7773 35.62535 424.6822 24.36092 -107.9049      43.15808 
1 1 1 8   18 8  o 1142.424 25.85646 254.5891       11.47161      251.7387       15.63311      257.9147       16.88584  1133.721 35.50678 1146.855 37.91283 -13.13403      51.94337 
1 1 1 8   18 9  o 1060.805 26.57998 219.6085       10.95011      218.2753       14.94612      221.1533       16.08848  1055.251 36.47075 1061.463 39.02855 -6.211182      53.41669 
1 1 1 8   18 10 o 586.2408 34.69346 67.55463       7.863473      67.67944       10.83337      67.41563       11.43203  583.5102 48.23910 581.5421 51.13892 1.968140       70.30078 
1 1 1 8   18 11 o 655.9910 32.64626 84.23257       8.316858      87.59012       11.34898      80.33779       12.22325  665.3362 44.17366 635.4079 49.93661 29.92834       66.67066 
1 1 1 8   18 12 o 909.4205 28.16844 161.5733       9.948453      154.9040       13.13538      170.5459       15.23556  888.2272 38.07944 930.8404 42.14588 -42.61322      56.80069 
1 1 1 8   18 13 o 158.2361 70.29020 -2.559387      8.644027      -2.559387      8.644027      0.000000       0.000000  158.2361 70.29020 ?        ?        0.000000       70.29020 
1 1 1 8   18 14 o 521.0262 53.30612 54.47385       10.63422      54.47385       10.63422      0.000000       0.000000  521.0262 53.30612 ?        ?        0.000000       53.30612 
1 1 1 8   18 15 o 876.3942 27.85848 150.1794       9.481672      150.8451       13.31921      149.4955       13.50086  875.3798 39.17905 871.2346 39.90233 4.145203       55.92132 
1 1 1 8   18 16 o 267.2813 67.30579 15.04688       6.982132      13.28080       9.387284      17.23369       10.44576  254.7926 82.82690 285.0401 86.66706 -30.24751      119.8811 
1 1 1 8   18 17 o 453.3857 21.70578 40.12970       3.821830      40.06099       4.080146      40.62134       10.91448  452.2226 23.31178 442.6212 65.47094 9.601410       69.49736 
1 1 1 8   18 18 o 655.7935 24.37785 84.15182       6.208554      84.15182       6.208554      0.000000       0.000000  655.7935 24.37785 ?        ?        0.000000       24.37785 
1 1 1 8   18 19 o 729.6572 18.57215 103.9035       5.262705      131.4406       7.875481      81.68581       7.074038  819.0673 24.75879 644.8286 28.24848 174.2387       37.56294 
1 1 1 8   18 20 o 273.1930 33.61301 14.97326       3.490969      17.19180       4.244567      10.33528       6.137112  291.6672 38.40698 220.6655 66.28239 71.00175       76.60582 
1 1 1 8   18 21 o 258.8781 36.94459 13.59788       3.608914      10.37912       4.506850      19.35050       6.025072  221.1376 53.13952 303.8957 52.97772 -82.75813      75.03632 
1 1 1 8   18 22 o 365.2531 28.15883 26.50697       3.963444      28.78643       5.105382      23.04930       6.287879  378.4032 35.14256 332.2629 50.30356 46.14029       61.36324 
1 1 1 8   18 23 o 104.8993 46.29849 -0.7479973     3.691909      2.254165       4.680872      -5.689809      6.005550  138.8448 56.10752 112.2502 52.93788 26.59457       77.13931 
1 1 1 8   18 24 o 403.0101 27.45782 32.33710       4.271834      36.43579       5.665975      26.93856       6.502650  424.8833 34.63964 358.6840 47.87738 66.19928       59.09440 
1 1 1 8   19 0  o 412.4628 26.95966 33.34379       4.294684      29.88324       5.880450      37.29953       6.287127  388.2104 39.55723 434.5319 37.62796 -46.32141      54.59522 
1 1 1 8   19 1  o 805.2479 17.45033 126.1768       5.457091      126.2283       7.632883      126.1229       7.804978  804.5937 24.42778 804.1799 24.99140 0.4138184      34.94691 
1 1 1 8   19 2  o 959.4630 16.37775 179.0862       6.102539      172.7939       8.369477      186.2289       8.917116  941.6236 22.88722 977.4501 23.49102 -35.82654      32.79715 
1 1 1 8   19 3  o 687.0967 17.65569 91.87060       4.711190      85.48142       6.557373      98.68713       6.773122  661.9941 25.50632 711.4153 24.51533 -49.42120      35.37758 
1 1 1 8   19 4  o 625.6599 17.90754 76.18277       4.351131      71.92371       6.156399      80.43362       6.150464  607.1477 26.10985 642.2283 24.65985 -35.08063      35.91424 
1 1 1 8   19 5  o 735.3475 16.01260 105.1919       4.572803      101.9916       6.410558      108.5072       6.524794  723.3903 22.81893 746.1756 22.51634 -22.78534      32.05759 
1 1 1 8   19 6  f 642.2311 22.84152 80.39674       5.696975      0.000000       0.000000      80.39674       5.696975  ?        ?        642.2311 22.84152 0.000000       22.84152 
1 1 1 8   19 7  o 1203.412 14.95606 281.6792       6.989719      275.4963       9.666730      288.4537       10.11866  1189.177 20.93172 1216.729 21.41418 -27.55115      29.94501 
1 1 1 8   19 8  o 595.9022 20.81653 69.18113       4.817385      68.68298       5.234228      71.94025       12.31857  593.5664 22.70677 599.9318 53.43186 -6.365356      58.05653 
1 1 1 8   19 9  o 282.0255 66.07829 16.57796       7.110660      8.626449       9.268211      27.95487       11.08621  223.7790 81.81238 363.8185 80.58728 -140.0395      114.8372 
1 1 1 8   19 10 o 998.8246 27.34224 194.8659       10.60599      203.1890       14.91114      186.3434       15.08872  1017.229 37.74540 973.5101 39.91021 43.71887       54.93214 
1 1 1 8   19 11 o 425.8799 63.22347 37.05066       10.13925      37.05066       10.13925      0.000000       0.000000  425.8799 63.22347 ?        ?        0.000000       63.22347 
1 1 1 8   19 12 f 864.1541 39.79661 146.9053       13.35565      146.9053       13.35565      0.000000       0.000000  864.1541 39.79661 ?        ?        0.000000       39.79661 
1 1 1 8   19 13 o 255.4720 70.08052 13.64430       7.162261      26.61855       9.681177      -2.042629      10.64525  356.3832 72.41862 178.5682 78.72527 177.8150       106.9679 
1 1 1 8   19 14 o 564.6949 36.59174 62.95755       7.981446      69.15334       10.89230      55.77330       11.72903  588.5211 48.07722 524.5377 58.57851 63.98340       75.78167 
1 1 1 8   19 15 o 752.2874 30.40179 110.9676       8.882004      119.9971       12.49559      101.7464       12.62755  778.0015 41.50689 714.6304 45.73982 63.37115       61.76531 
1 1 1 8   19 16 f 449.9023 44.44022 40.58902       7.663172      40.91630       10.76299      40.25254       10.91330  444.3599 64.23333 439.9800 65.89787 4.379852       92.02418 
1 1 1 8   19 17 o 627.0505 47.15775 79.02210       11.39965      0.000000       0.000000      79.02210       11.39965  ?        ?        627.0505 47.15775 0.000000       47.15775 
1 1 1 8   19 18 o 179.9099 45.73836 6.726725       3.202700      7.310500       3.422795      2.620437       9.077849  187.3588 47.09433 182.8746 76.44418 4.484253       89.78635 
1 1 1 8   19 19 o 153.8350 44.65341 4.856674       2.824832      6.336819       3.546941      2.289667       4.671060  174.6552 49.83986 140.8363 56.35151 33.81897       75.22968 
1 1 1 8   19 20 f 154.8772 47.03790 4.908045       3.078264      3.709238       3.868686      6.976794       5.082095  145.5625 52.91167 185.1471 60.97981 -39.58458      80.73526 
1 1 1 8   19 21 o 460.6899 20.64086 41.60044       3.692873      53.13545       5.082814      28.70401       5.374400  519.4680 25.19518 377.0865 37.18361 142.3815       44.91567 
1 1 1 8   19 22 o 490.7313 21.22142 47.29163       4.044327      55.39526       5.393473      36.88181       6.112937  529.5506 26.22606 426.9757 37.23812 102.5749       45.54650 
1 1 1 8   19 23 o 157.6902 50.87340 5.126325       3.545855      7.159649       4.584610      2.099275       5.593826  183.1112 57.71873 145.8577 60.40668 37.25348       83.54890 
1 1 1 8   20 0  o 382.1476 29.67807 28.72911       4.369932      32.44888       6.213273      25.08792       6.147291  404.2369 40.10769 353.6312 45.84013 50.60571       60.90931 
1 1 1 8   20 1  o 463.6042 24.82297 42.05989       4.452977      47.27531       6.229782      36.61152       6.367393  490.2067 32.91489 429.9882 38.53991 60.21851       50.68249 
1 1 1 8   20 2  o 415.2738 26.17509 33.80151       4.199744      29.85892       5.814456      38.10199       6.072620  387.8649 39.13627 439.2841 35.91013 -51.41916      53.11483 
1 1 1 8   20 3  o 336.2380 29.73252 22.27747       3.842438      25.91156       5.483089      18.77059       5.386261  360.9122 39.78053 304.8630 47.00503 56.04919       61.57892 
1 1 1 8   20 4  o 688.3660 17.67625 92.24171       4.725389      88.38803       6.563659      96.38824       6.808481  672.9742 25.11421 702.7946 24.94559 -29.82031      35.39783 
1 1 1 8   20 5  o 643.0897 17.61294 80.50637       4.398772      73.73946       6.164104      87.52812       6.279095  614.5845 25.82619 669.8121 24.13882 -55.22754      35.35074 
1 1 1 8   20 6  o 472.3082 20.27752 43.46135       3.719361      41.06426       5.245738      45.88464       5.274320  457.2815 29.69982 483.7361 28.19792 -26.45459      40.95366 
1 1 1 8   20 7  o 690.7246 22.83912 93.03879       6.126498      93.03879       6.126498      0.000000       0.000000  690.7246 22.83912 ?        ?        0.000000       22.83912 
1 1 1 8   20 8  o 761.8420 15.19044 112.9153       4.494313      106.7774       6.175128      119.8286       6.553578  740.1442 21.48333 784.0681 21.52270 -43.92383      30.40987 
1 1 1 8   20 9  o 450.6865 20.77511 39.58241       3.636185      39.46541       3.816130      40.73602       11.98265  449.9354 21.83962 443.6157 72.02354 6.319733       75.26193 
1 1 1 8   20 10 o 375.8579 72.55512 29.50825       10.20701      29.50825       10.20701      0.000000       0.000000  375.8579 72.55512 ?        ?        0.000000       72.55512 
1 1 1 8   20 11 o 389.2487 69.16330 31.46162       10.07212      31.46162       10.07212      0.000000       0.000000  389.2487 69.16330 ?        ?        0.000000       69.16330 
1 1 1 8   20 12 o 755.3132 31.28056 111.7944       9.175495      110.9640       12.47589      112.7727       13.54177  748.2734 43.11471 753.1249 46.52782 -4.851501      63.43277 
1 1 1 8   20 13 o 970.4847 28.02020 184.3512       10.56059      180.4987       14.24170      189.0572       15.74035  956.9817 38.32041 978.1846 41.43483 -21.20288      56.43845 
1 1 1 8   20 14 o 291.2704 64.62762 17.86799       7.119323      12.89604       9.541018      24.11397       10.69379  251.3330 83.59035 333.4129 82.93184 -82.07994      117.7499 
1 1 1 8   20 15 o 487.9772 41.83360 47.58322       7.851152      41.54138       10.89191      54.11775       11.32730  447.0148 64.61663 514.3948 57.69692 -67.37994      86.62704 
1 1 1 8   20 16 o 295.5437 82.63295 19.19221       9.853789      0.000000       0.000000      19.19221       9.853789  ?        ?        295.5437 82.63295 0.000000       82.63295 
1 1 1 8   20 17 o 336.9929 78.99744 25.02244       10.15873      0.000000       0.000000      25.02244       10.15873  ?        ?        336.9929 78.99744 0.000000       78.99744 
1 1 1 8   20 18 o 564.1496 19.22146 62.19957       4.211227      65.40388       4.587698      45.04459       10.61506  578.2578 20.42892 463.9581 60.34184 114.2997       63.70619 
1 1 1 8   20 19 o 233.3282 28.66754 10.89603       2.543036      9.989805       3.453676      11.96923       3.758409  219.6666 42.01563 241.0696 41.65153 -21.40295      59.16218 
1 1 1 8   20 20 o 261.8937 30.15082 13.75853       3.010587      14.57339       3.915050      12.57946       4.709376  266.9336 38.91068 243.3199 51.44608 23.61369       64.50380 
1 1 1 8   20 21 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 8   20 22 o 518.2362 26.90790 53.34000       5.396829      53.34000       5.396829      0.000000       0.000000  518.2362 26.90790 ?        ?        0.000000       26.90790 
1 1 1 8   21 0  o 1191.506 24.86228 277.2369       11.50443      0.000000       0.000000      277.2369       11.50443  ?        ?        1191.506 24.86228 0.000000       24.86228 
1 1 1 8   21 1  o 828.9699 26.59882 134.2910       8.563062      0.000000       0.000000      134.2910       8.563062  ?        ?        828.9699 26.59882 0.000000       26.59882 
1 1 1 8   21 2  o 611.2957 20.76051 72.84022       4.928530      68.33687       6.818628      77.76688       7.131908  590.1530 29.84819 630.4592 29.12868 -40.30621      41.70605 
1 1 1 8   21 3  o 477.3242 23.31281 44.45419       4.321516      45.64471       6.100608      43.25508       6.122545  481.4566 32.82359 468.4113 33.88585 13.04532       47.17667 
1 1 1 8   21 4  o 784.1240 17.35452 119.7065       5.284760      122.9875       7.490256      116.4541       7.457411  793.7903 24.29757 772.3244 24.86339 21.46588       34.76435 
1 1 1 8   21 5  o 1070.964 15.90318 223.2069       6.614345      220.2858       9.252047      226.2604       9.459598  1062.776 22.41652 1077.050 22.61564 -14.27368      31.84285 
1 1 1 8   21 6  o 658.7806 17.87053 84.50625       4.572001      80.56425       6.303066      88.88333       6.641796  642.3402 25.26729 674.6777 25.34902 -32.33746      35.79119 
1 1 1 8   21 7  o 167.8915 47.65717 5.727727       3.251925      7.885660       4.499564      3.368092       4.705156  196.3435 56.17201 152.0721 57.75292 44.27147       80.56484 
1 1 1 8   21 8  o 264.5856 33.03943 13.93258       3.320901      16.36942       4.206362      9.900476       5.410775  285.9053 38.89348 218.9215 61.24046 66.98384       72.54720 
1 1 1 8   21 9  o 710.0345 15.57348 98.11308       4.294308      98.11308       4.294308      0.000000       0.000000  710.0345 15.57348 ?        ?        0.000000       15.57348 
1 1 1 8   21 10 o 546.1846 41.10358 59.18534       8.654685      65.07628       11.54689      51.63315       13.07402  569.0496 52.85383 500.2101 69.15154 68.83951       87.03713 
1 1 1 8   21 11 o 806.1874 30.45529 127.4143       9.535132      121.8271       13.03539      133.8442       13.98395  783.5119 43.00457 820.9344 44.02298 -37.42255      61.54198 
1 1 1 8   21 12 o 311.5125 65.31393 20.40442       7.649006      19.23430       10.05725      22.00994       11.78069  298.3992 83.49950 317.3566 90.92155 -18.95743      123.4459 
1 1 1 8   21 13 o 648.6409 34.31832 83.10904       8.614113      88.10465       12.06112      77.90768       12.30700  662.9984 47.15063 621.3937 51.46162 41.60468       69.79599 
1 1 1 8   21 14 o 254.1635 87.62688 13.23647       10.49132      0.000000       0.000000      13.23647       10.49132  ?        ?        254.1635 87.62688 0.000000       87.62688 
1 1 1 8   21 15 f 496.2158 57.73417 50.76223       10.91782      0.000000       0.000000      50.76223       10.91782  ?        ?        496.2158 57.73417 0.000000       57.73417 
1 1 1 8   21 16 o 865.1985 29.74904 147.4853       9.995782      137.8574       13.84382      157.9717       14.44786  828.8812 43.15582 889.1696 41.83994 -60.28845      60.10828 
1 1 1 8   21 17 o 422.2485 47.05500 36.41162       7.584936      35.57076       10.81482      37.22562       10.64074  405.0521 71.35809 416.3864 68.16241 -11.33429      98.68177 
1 1 1 8   21 18 o 653.2389 33.94923 85.04005       8.582829      85.63556       12.36537      84.48643       11.92264  646.2492 49.64917 642.9150 48.10047 3.334167       69.12811 
1 1 1 8   21 19 o 532.5720 19.84549 55.58154       4.104573      56.86498       4.459914      48.47650       10.49352  538.3041 21.33393 478.8385 57.58387 59.46558       61.40878 
1 1 1 8   21 20 o 188.5786 34.79239 7.328263       2.454159      7.700114       3.411378      6.929371       3.533237  190.2393 46.55378 180.2417 49.13042 9.997635       67.68347 
1 1 1 8   21 21 o 106.2672 43.20995 1.104337       2.795395      1.884444       3.622686      -0.4375648E-01 4.394831  124.0095 49.62373 118.6453 51.47578 5.364189       71.50014 
1 1 1 8   22 0  o 589.0424 22.89645 67.72324       5.237724      64.68446       7.303489      70.94106       7.515585  573.1784 32.94910 600.4896 32.34700 -27.31116      46.17327 
1 1 1 8   22 1  o 1218.200 17.36953 289.0063       8.217403      297.1024       11.56672      280.7560       11.67638  1233.464 24.14660 1198.785 25.08066 34.67871       34.81519 
1 1 1 8   22 2  o 824.8719 18.18730 132.5402       5.826165      124.1902       7.990283      142.0194       8.513463  797.1882 25.80913 852.5133 25.71444 -55.32507      36.43272 
1 1 1 8   22 3  o 270.8407 39.25212 14.73820       4.008296      12.14333       5.685881      17.30173       5.651449  241.2843 60.72557 290.7208 51.96306 -49.43648      79.92343 
1 1 1 8   22 4  o 754.1852 18.05938 110.7889       5.289429      107.4044       7.452920      114.2237       7.508150  741.3710 25.88588 764.6553 25.28362 -23.28436      36.18480 
1 1 1 8   22 5  o 714.6483 17.92876 99.47477       4.975890      103.0154       7.054598      95.96932       7.019475  726.2051 25.01411 700.7983 25.79191 25.40674       35.92949 
1 1 1 8   22 6  o 491.2831 22.52524 47.09659       4.297633      43.48732       5.645458      52.07079       6.627519  470.0444 31.10239 514.0293 33.38052 -43.98486      45.62475 
1 1 1 8   22 7  o 570.0136 20.59870 63.35641       4.559876      60.06148       5.773096      68.82138       7.434975  554.1870 26.82406 591.3842 32.49757 -37.19714      42.13813 
1 1 1 8   22 8  o 256.8550 36.81714 13.24204       3.567502      9.954425       4.432481      19.28868       6.011233  219.0502 52.73734 306.9427 52.30398 -87.89249      74.27606 
1 1 1 8   22 9  o 253.0214 42.93753 13.01050       4.068297      13.91270       4.360450      6.946554       11.30466  261.4475 44.54235 223.0530 88.17216 38.39447       98.78437 
1 1 1 8   22 10 o 293.8224 33.96008 17.20566       3.803692      16.00181       4.058307      25.90659       10.91043  282.2971 37.98164 345.4951 82.46044 -63.19806      90.78728 
1 1 1 8   22 11 o 525.0370 42.03071 55.04651       8.498228      52.27945       11.46261      58.42376       12.66355  504.6446 59.64156 532.4910 62.42147 -27.84634      86.33398 
1 1 1 8   22 12 f 511.2266 42.89680 52.36067       8.437869      38.83678       11.31448      69.30667       12.66536  428.4281 70.45271 582.3700 56.72019 -153.9419      90.44757 
1 1 1 8   22 13 o 285.7294 88.18220 18.00582       10.76437      0.000000       0.000000      18.00582       10.76437  ?        ?        285.7294 88.18220 0.000000       88.18220 
1 1 1 8   22 14 o 282.0534 84.27796 17.65395       9.941165      0.000000       0.000000      17.65395       9.941165  ?        ?        282.0534 84.27796 0.000000       84.27796 
1 1 1 8   22 15 o 181.6586 70.23260 5.172916       7.041735      8.948284       10.12403      1.634728       9.800862  222.4862 84.66272 182.1634 77.92434 40.32278       115.0651 
1 1 1 8   22 16 o 147.8077 64.61259 -0.4101460     7.035378      6.974640       9.791342      -8.292207      10.11563  208.1211 82.12552 147.6314 69.33698 60.48969       107.4812 
1 1 1 8   22 17 o 248.4946 72.14034 13.74451       7.372456      5.363727       10.78651      21.09215       10.09979  203.5085 84.04979 301.8812 83.38898 -98.37267      118.3980 
1 1 1 8   22 18 o 141.9019 62.73940 -0.8524306     6.808539      5.935943       10.29969      -6.121089      9.073843  201.8835 82.61156 143.0823 66.69934 58.80119       106.1766 
1 1 1 8   22 19 o 93.11770 46.23447 -14.33744      6.422598      -8.651897      8.988194      -20.26916      9.180717  133.8731 63.61477 110.2008 54.81017 23.67229       83.97019 
1 1 1 8   22 20 o 194.7188 41.03173 7.980725       3.004935      7.015100       3.156729      17.30308       9.808351  181.3776 45.02477 267.7336 84.42683 -86.35602      95.68239 
1 1 1 8   23 0  o 888.6004 22.94260 154.2121       7.917302      151.9671       8.895402      162.7695       17.36730  881.3909 25.98777 902.0928 49.76641 -20.70184      56.14321 
1 1 1 8   23 1  o 853.9918 18.79592 142.1572       6.233692      150.2434       8.836928      134.1479       8.794765  876.4246 25.96323 827.8181 27.35655 48.60651       37.71565 
1 1 1 8   23 2  o 1039.421 17.47683 210.4799       7.054758      207.0933       9.711969      214.2631       10.26484  1029.450 24.29261 1046.853 25.24868 -17.40283      35.03751 
1 1 1 8   23 3  o 1163.946 16.81529 263.8682       7.600905      250.1329       10.20717      280.9657       11.38814  1131.686 23.22477 1199.031 24.45651 -67.34485      33.72701 
1 1 1 8   23 4  o 819.4366 19.01624 130.8994       6.051571      133.0096       7.860379      127.8283       9.482468  824.9395 24.53541 807.3463 30.24360 17.59314       38.94435 
1 1 1 8   23 5  o 456.0485 25.68071 40.80792       4.529755      42.20956       5.915009      38.82020       7.043945  462.2645 33.16910 441.0446 41.61694 21.21985       53.21803 
1 1 1 8   23 6  o 645.4581 19.86861 81.26453       4.980392      81.58736       6.431890      80.78115       7.870598  645.7676 25.64687 641.3228 31.60116 4.444763       40.69884 
1 1 1 8   23 7  f 378.4249 35.70378 28.47225       5.185113      28.47225       5.185113      0.000000       0.000000  378.4249 35.70378 ?        ?        0.000000       35.70378 
1 1 1 8   23 8  o 384.0706 26.15335 29.02172       3.877688      25.04154       4.996308      35.05072       6.149238  354.2627 36.85534 419.3711 38.17471 -65.10843      53.06245 
1 1 1 8   23 9  o 572.9996 24.93870 64.28665       5.549528      64.28665       5.549528      0.000000       0.000000  572.9996 24.93870 ?        ?        0.000000       24.93870 
1 1 1 8   23 10 o 717.8068 15.59498 100.3971       4.347307      100.9772       4.574467      94.98695       13.96911  719.7516 16.36552 684.0018 53.00144 35.74982       55.47056 
1 1 1 8   23 11 o 965.2017 19.21859 181.9227       7.203898      185.7289       8.175997      168.7109       15.23268  974.5234 21.60332 919.3798 42.66320 55.14368       47.82104 
1 1 1 8   23 12 o 457.9000 66.80804 44.38702       11.53047      0.000000       0.000000      44.38702       11.53047  ?        ?        457.9000 66.80804 0.000000       66.80804 
1 1 1 8   23 13 o 242.0990 87.66701 11.89573       10.60556      0.000000       0.000000      11.89573       10.60556  ?        ?        242.0990 87.66701 0.000000       87.66701 
1 1 1 8   23 14 f 176.3863 69.60593 4.501678       7.033902      -3.250438      9.931623      12.30338       9.963333  162.4795 73.49693 241.6544 85.25991 -79.17496      112.5658 
1 1 1 8   23 15 o 487.5261 41.41772 48.13272       7.767489      45.81895       11.08547      50.36438       10.88700  463.3544 63.25727 489.1733 58.46679 -25.81891      86.13853 
1 1 1 8   23 16 o 473.6897 43.73567 45.85226       7.954738      34.84942       11.10112      57.46454       11.40441  393.8061 75.33148 521.9610 57.19762 -128.1549      94.58541 
1 1 1 8   23 17 o 336.2389 59.65741 24.49137       7.504767      25.68141       11.13690      23.50149       10.15730  327.2735 86.36621 315.6076 82.09367 11.66586       119.1574 
1 1 1 8   23 18 o 308.2776 60.12513 20.84294       6.939703      22.49988       9.864761      19.21953       9.764450  307.1254 81.39646 282.7945 83.28884 24.33093       116.4578 
1 1 1 8   23 19 o 195.8802 70.41333 8.017209       6.825909      16.06299       9.865214      0.6274689      9.454466  257.9810 84.96030 168.7697 74.30913 89.21135       112.8720 
1 1 1 8   24 0  o 598.0335 29.48174 70.24184       6.847100      68.43199       7.662997      77.40902       15.24939  588.3489 33.67775 611.6140 65.20717 -23.26514      73.39050 
1 1 1 8   24 1  o 351.9230 35.74878 24.68909       4.817988      19.37096       6.525527      31.06252       7.143682  304.9732 57.19796 391.4477 47.99722 -86.47449      74.66820 
1 1 1 8   24 2  o 822.0364 20.20027 131.9172       6.448760      140.5211       8.506009      120.2873       9.889372  846.9792 25.85980 781.6359 32.57888 65.34326       41.59462 
1 1 1 8   24 3  o 641.7375 22.02236 80.48087       5.488445      82.40546       7.176884      77.76983       8.517936  647.9672 28.52035 626.8201 35.13314 21.14703       45.25205 
1 1 1 8   24 4  o 526.5244 24.16593 54.25507       4.941400      62.69334       6.501804      42.71605       7.603115  564.0917 29.78506 461.4924 42.91443 102.5993       52.23790 
1 1 1 8   24 5  o 184.8725 55.07887 7.029383       4.250592      12.61648       5.385411      -2.201884      6.922395  244.7218 57.61946 139.7565 62.43640 104.9653       84.96062 
1 1 1 8   24 6  o 997.6603 22.92067 194.7223       8.880513      194.7223       8.880513      0.000000       0.000000  997.6603 22.92067 ?        ?        0.000000       22.92067 
1 1 1 8   24 7  o 485.3301 23.27515 46.10579       4.386901      44.23518       5.696496      48.83197       6.876915  472.9006 31.19291 495.5035 35.98256 -22.60294      47.62082 
1 1 1 8   24 8  o 597.0073 19.90306 69.63445       4.614530      73.91891       6.083565      63.82931       7.081352  613.8911 25.51754 567.8954 32.24141 45.99561       41.11755 
1 1 1 8   24 9  o 481.0177 25.51111 45.53100       4.748573      45.32080       5.112112      46.85321       12.82137  479.3693 27.57635 467.0700 73.08023 12.29932       78.11002 
1 1 1 8   24 10 o 370.8081 22.93280 27.04204       3.286227      27.45428       3.412440      21.77637       12.19594  373.4859 23.64887 307.9543 93.64927 65.53159       96.58910 
1 1 1 8   24 11 o 530.9192 18.47423 55.07804       3.809103      56.71179       4.016974      40.50688       11.99645  538.6001 19.20457 430.9196 74.37281 107.6805       76.81231 
1 1 1 8   24 12 o 246.4171 72.88561 13.36299       7.463437      4.505878       10.39060      22.80330       10.72723  198.5057 82.27933 314.8855 85.51322 -116.3798      118.6693 
1 1 1 8   24 13 o 526.7345 41.33878 56.14296       8.388329      54.75380       11.55307      57.69180       12.19905  509.4301 59.51821 521.7803 61.37498 -12.35022      85.49448 
1 1 1 8   24 14 o 158.6723 66.87357 1.866866       7.037324      -6.787317      9.760888      11.23473       10.15539  147.5482 68.91411 231.9572 85.51157 -84.40903      109.8243 
1 1 1 8   24 15 o 241.1202 70.89854 13.10604       7.080501      21.81367       10.55971      5.993173       9.543858  302.1257 85.91945 197.4832 80.00645 104.6425       117.4018 
1 1 1 8   24 16 f 369.8872 55.39449 29.28043       7.712401      23.91929       10.99505      34.47318       10.82099  313.2833 87.17902 388.4715 74.43629 -75.18817      114.6340 
1 1 1 8   24 17 o 418.3925 46.96700 36.56845       7.499605      37.21240       10.70902      35.94869       10.50598  405.3232 70.59865 398.3330 70.49398 6.990173       99.76758 
1 1 1 8   25 0  o 220.1920 59.27019 10.30361       5.180423      13.27647       6.676637      5.806491       8.211787  247.9966 67.51145 193.9957 75.60780 54.00092       101.3624 
1 1 1 8   25 1  o 401.3143 43.33187 32.57240       6.646188      32.57240       6.646188      0.000000       0.000000  401.3143 43.33187 ?        ?        0.000000       43.33187 
1 1 1 8   25 2  o 706.4665 22.00235 97.68102       6.036547      95.61449       7.661100      101.0651       9.803693  697.1631 28.29624 714.1737 35.34743 -17.01056      45.27823 
1 1 1 8   25 3  o 676.3344 21.83592 89.52024       5.735363      88.41923       7.360895      91.22151       9.149981  670.3962 28.27295 677.8017 34.87901 -7.405457      44.89883 
1 1 1 8   25 4  o 609.9760 21.24041 72.79203       5.031572      68.58239       6.849428      77.72649       7.415694  589.1473 30.03631 627.8506 30.41358 -38.70325      42.74536 
1 1 1 8   25 5  o 453.8027 25.51096 40.55646       4.477716      31.77802       5.950973      52.01218       6.798145  397.6352 39.04019 511.3051 34.43648 -113.6699      52.05773 
1 1 1 8   25 6  o 343.2084 50.83447 24.34792       6.570642      0.000000       0.000000      24.34792       6.570642  ?        ?        343.2084 50.83447 0.000000       50.83447 
1 1 1 8   25 7  o 245.7818 43.07063 12.44263       3.961255      17.43340       5.017108      4.181624       6.454847  290.9870 45.91982 170.3748 66.85548 120.6122       81.10663 
1 1 1 8   25 8  o 564.1072 21.14760 62.31403       4.632876      68.34350       6.040586      53.70089       7.219724  589.3902 26.39053 518.3658 36.08890 71.02441       44.70871 
1 1 1 8   25 9  o 466.8734 29.30619 43.20567       5.286621      43.46403       5.818624      41.98346       12.65544  467.2715 32.26201 435.2020 77.73087 32.06943       84.16011 
1 1 1 8   25 10 o 485.6792 20.18656 46.19466       3.807499      45.80774       4.009202      49.75237       12.15713  483.3968 21.35631 480.8417 66.91683 2.555084       70.24211 
1 1 1 8   25 11 o 251.7836 31.01106 12.75027       2.968209      14.14807       3.086137      -4.498188      10.84095  265.5563 30.47678 164.1805 75.23340 101.3759       81.17203 
1 1 1 8   25 12 o 534.8381 21.43094 56.15749       4.451348      60.10714       4.826108      33.64829       11.52120  553.0266 22.47103 382.9058 80.05418 170.1208       83.14817 
1 1 1 8   25 13 o 590.0891 36.57433 70.19950       8.340202      67.26376       11.63410      73.30328       11.96240  565.8837 53.57720 591.6872 52.60810 -25.80353      75.08747 
1 1 1 8   25 14 o 138.3340 62.21453 -1.810546      6.997985      0.4699157      10.08425      -3.928864      9.719137  173.6367 76.58326 154.5834 70.98241 19.05324       104.4198 
1 1 1 8   25 15 o 272.2920 68.29778 16.95599       7.209619      11.94423       10.05309      22.26310       10.34506  230.8383 85.08267 301.7851 84.77025 -70.94682      120.1044 
1 1 1 8   25 16 o 274.0529 66.58115 17.15314       7.016245      20.44429       9.978135      13.93443       9.867724  288.3433 83.98862 242.2835 84.89995 46.05984       119.4240 
1 1 1 8   26 0  o 324.8324 42.49596 21.56064       5.232328      23.57884       6.747333      18.51628       8.287010  335.3058 53.62277 287.8796 73.78362 47.42615       91.21088 
1 1 1 8   26 1  o 150.0085 63.23341 1.365947       6.293852      1.365947       6.293852      0.000000       0.000000  150.0085 63.23341 ?        ?        0.000000       63.23341 
1 1 1 8   26 2  o 117.0896 53.48941 -2.970793      5.423680      -2.172426      5.939979      -6.973658      13.30054  127.1740 57.24554 176.4696 81.74623 -49.29553      99.79729 
1 1 1 8   26 3  o 336.1189 35.76833 22.73710       4.597217      21.05566       6.308642      24.64104       6.713083  316.7744 53.16472 343.7833 51.89745 -27.00882      74.29558 
1 1 1 8   26 4  o 437.9698 28.06858 37.99594       4.748984      33.52673       6.295615      43.89655       7.233867  406.9786 40.36502 466.1636 40.35614 -59.18500      57.07848 
1 1 1 8   26 5  o 396.2905 28.85743 31.17990       4.410680      30.53777       5.828219      32.04060       6.747569  388.6257 39.14998 395.8576 44.67285 -7.231934      59.40020 
1 1 1 8   26 6  o 557.1181 34.84155 62.05714       7.500413      0.000000       0.000000      62.05714       7.500413  ?        ?        557.1181 34.84155 0.000000       34.84155 
1 1 1 8   26 7  o 774.1536 20.37574 117.4442       6.125882      122.7173       8.694121      112.2452       8.632814  787.9562 28.41160 753.0606 29.51851 34.89563       40.97025 
1 1 1 8   26 8  o 573.6553 22.76373 64.66587       5.071336      65.33947       6.883619      63.86628       7.499844  572.9399 31.05307 564.8883 34.35014 8.051636       46.30578 
1 1 1 8   26 9  o 549.7286 60.05450 64.35385       12.61243      0.000000       0.000000      64.35385       12.61243  ?        ?        549.7286 60.05450 0.000000       60.05450 
1 1 1 8   26 10 o 374.9731 23.33393 27.78652       3.381098      27.69521       3.544398      28.70955       11.26891  374.0105 24.53835 348.2907 84.23441 25.71976       87.73577 
1 1 1 8   26 11 o 271.7936 29.95483 14.85897       3.109288      14.96502       3.256736      13.76671       10.45178  272.3268 31.36712 244.9738 87.22868 27.35297       92.69702 
1 1 1 8   26 12 o 132.8714 44.52398 3.479501       2.706153      2.286873       2.804239      19.63866       10.32219  118.9295 44.71838 283.5623 86.13844 -164.6328      97.05444 
1 1 1 8   26 13 o 308.8093 22.63275 18.90319       2.695380      19.02270       2.793418      17.28970       10.26407  309.5715 23.40820 265.5066 86.62325 44.06491       89.73032 
1 1 1 8   26 14 o 160.7114 67.32278 2.746738       7.062247      3.920084       9.671249      1.406288       10.33701  183.8436 77.98776 176.9034 77.79950 6.940247       110.1583 
1 1 1 8   27 0  o 523.8854 26.86267 54.39269       5.446912      53.90820       7.458570      54.94636       7.973368  516.6801 37.42470 520.3832 39.75473 -3.703186      54.59896 
1 1 1 8   27 1  o 108.1269 49.16747 -2.210202      4.516166      3.371003       6.211186      -8.470579      6.578257  160.5396 64.71676 109.9097 52.81843 50.62991       83.53470 
1 1 1 8   27 2  o 366.3879 42.78242 27.56207       5.972806      24.11000       6.600148      43.17538       14.03657  338.1294 51.92213 428.0192 87.39993 -89.88977      101.6595 
1 1 1 8   27 3  f 157.9429 62.04615 3.725392       5.565385      1.102195       6.090765      16.99298       13.69785  145.0955 61.73193 269.3076 99.30753 -124.2121      116.9308 
1 1 1 8   27 4  o 375.9742 31.64790 28.32508       4.577969      21.70856       6.026823      37.35011       7.038788  321.3364 49.91447 426.8414 43.05026 -105.5050      65.91494 
1 1 1 8   27 5  o 163.5472 57.39385 5.226104       4.510334      2.992391       6.292968      7.585637       6.467773  158.3834 64.66518 193.1706 68.63607 -34.78716      94.30003 
1 1 1 8   27 6  o 362.2643 34.05621 26.47294       4.735018      29.62783       6.567849      23.05853       6.832653  378.0510 45.65956 327.9526 55.63604 50.09839       71.97336 
1 1 1 8   27 7  o 490.9155 27.29160 47.88957       5.182575      50.31209       7.047441      45.03668       7.647856  498.7286 36.64299 468.5020 42.49637 30.22665       56.11283 
1 1 1 8   27 8  o 136.8783 52.43929 2.977677       3.900445      7.403866       4.826404      -5.355471      6.622366  185.8409 59.28994 119.9905 56.27385 65.85040       81.74377 
1 1 1 8   27 9  o 450.1380 28.36284 40.43387       4.932837      39.24724       5.389472      46.55966       12.24531  442.0266 31.60414 452.8571 72.04057 -10.83051      78.66807 
1 1 1 8   27 10 o 322.8593 26.94757 20.82955       3.347908      21.67401       3.516242      12.63797       10.95150  329.0951 27.77189 235.3984 88.39941 93.69664       92.65923 
1 1 1 8   27 11 o 238.8170 34.89839 11.71861       3.141145      13.23577       3.313188      -1.762260      9.876216  254.2290 34.44466 161.5069 73.15300 92.72211       80.85664 
1 1 1 8   27 12 o 513.9611 18.50715 51.87719       3.694008      53.07638       3.926661      42.64761       10.89359  519.5583 19.46082 434.8320 66.63300 84.72629       69.41671 
1 1 1 8   28 0  o 156.8873 63.20423 3.469037       5.920162      2.145885       12.48000      3.853241       6.724977  192.5069 85.03616 165.2261 67.08216 27.28078       108.3105 
1 1 1 8   28 1  o 312.1640 44.62426 20.40963       5.255859      32.48271       8.345230      12.47254       6.766438  386.9230 57.26711 232.9602 69.51275 153.9628       90.06411 
1 1 1 8   28 2  o 206.7003 70.05025 9.442982       6.699341      0.000000       0.000000      9.442982       6.699341  ?        ?        206.7003 70.05025 0.000000       70.05025 
1 1 1 8   28 3  o 171.4095 66.11493 5.205608       6.228845      6.650605       6.990676      -0.3612084     13.72111  185.7972 70.43525 190.8940 86.36562 -5.096771      111.4457 
1 1 1 8   28 4  o 304.7543 41.77272 19.30811       4.813808      16.63048       7.024404      21.67912       6.609987  269.3013 67.34150 315.5403 55.99142 -46.23892      87.57806 
1 1 1 8   28 5  o 296.3304 42.55610 18.33003       4.756861      15.87902       6.730498      20.77626       6.723941  263.5574 65.92455 307.0423 58.52593 -43.48495      88.15515 
1 1 1 8   28 6  f 308.8009 37.43442 19.59738       4.397545      20.72636       5.671000      17.89461       6.964580  312.2660 48.32431 280.2429 65.21728 32.02313       81.16978 
1 1 1 8   28 7  o 91.29020 43.19423 -4.154451      4.058008      -3.116769      5.095832      -5.953170      6.709105  110.1486 50.87417 117.9136 55.71379 -7.765083      75.44672 
1 1 1 8   28 8  o 174.1865 53.93814 6.563288       4.023519      8.168992       5.077496      3.853366       6.596220  192.1541 60.76069 163.3711 66.39655 28.78296       90.00201 
1 1 1 8   28 9  o 204.7982 54.26774 9.290484       4.385375      13.09692       4.801148      -9.875222      10.77329  244.6589 52.12610 143.2662 68.51344 101.3927       86.08846 
1 1 1 8   28 10 o 228.0062 38.60363 10.86767       3.296256      9.469205       3.479075      23.13478       10.30407  210.4087 43.99228 302.9264 84.43013 -92.51772      95.20382 
1 1 1 8   29 0  o 247.2391 61.02098 14.01531       5.823409      2.969655       11.72948      17.62857       6.708608  186.8544 82.49446 276.1833 63.82738 -89.32892      104.3037 
1 1 1 8   29 1  o 195.5728 60.13892 8.631281       5.011721      -0.7126660     7.904952      14.91144       6.480660  148.2028 66.42825 252.7268 65.49416 -104.5240      93.28558 
1 1 1 8   29 2  o 177.6349 58.11894 6.896106       4.619254      8.894217       7.198977      5.497685       6.022542  199.9344 72.25405 170.1832 65.17016 29.75119       97.30260 
1 1 1 8   29 3  o 336.3020 38.91420 23.45245       4.988478      29.13243       7.670792      19.28985       6.566729  363.8004 56.09709 292.4290 59.83918 71.37140       82.02201 
1 1 1 8   29 4  f 147.4240 60.27028 2.854993       5.475723      4.735220       6.045784      -5.728462      12.91750  164.7108 64.68019 167.1840 78.46669 -2.473145      101.6885 
1 1 1 8   29 5  o 148.0713 54.75616 4.120846       4.170192      8.698488       5.740796      -0.9932669     6.067871  196.3824 64.81762 130.4199 58.34676 65.96252       87.21048 
1 1 1 8   29 6  o 120.4048 51.55567 0.6153648      4.297617      -1.237558      5.555496      3.376582       6.781792  123.7899 55.57282 160.4058 66.47869 -36.61584      86.64730 
1 1 1 9   0  0  o 683.1622 19.50833 90.98387       5.166187      90.98387       5.166187      90.98387       5.166187  683.1622 19.50833 683.1622 19.50833 0.000000       0.000000 
1 1 1 9   0  1  o 782.6232 18.86407 119.3162       5.725927      119.3162       5.725927      119.3162       5.725927  782.6232 18.86407 782.6232 18.86407 0.000000       0.000000 
1 1 1 9   0  2  o 116.7947 57.59395 3.950402       3.127213      3.950402       3.127213      3.950402       3.127213  116.7947 57.59395 116.7947 57.59395 0.000000       0.000000 
1 1 1 9   0  3  o 897.4289 15.98538 156.7224       5.567245      156.7224       5.567245      156.7224       5.567245  897.4289 15.98538 897.4289 15.98538 0.000000       0.000000 
1 1 1 9   0  4  o 599.3538 23.08519 70.25168       5.355244      70.25168       5.355244      70.25168       5.355244  599.3538 23.08519 599.3538 23.08519 0.000000       0.000000 
1 1 1 9   0  5  o 312.0215 34.82457 19.71984       4.085289      19.71984       4.085289      19.71984       4.085289  312.0215 34.82457 312.0215 34.82457 0.000000       0.000000 
1 1 1 9   0  6  o 324.5649 41.24525 21.61779       4.969939      21.61779       4.969939      21.61779       4.969939  324.5649 41.24525 324.5649 41.24525 0.000000       0.000000 
1 1 1 9   0  7  o 236.4689 59.30205 12.88719       4.710674      12.88719       4.710674      12.88719       4.710674  236.4689 59.30205 236.4689 59.30205 0.000000       0.000000 
1 1 1 9   0  8  o 437.3966 32.11417 37.99752       5.387478      37.99752       5.387478      37.99752       5.387478  437.3966 32.11417 437.3966 32.11417 0.000000       0.000000 
1 1 1 9   0  9  o 396.9389 46.19144 32.22747       6.868860      32.22747       6.868860      32.22747       6.868860  396.9389 46.19144 396.9389 46.19144 0.000000       0.000000 
1 1 1 9   0  10 o 189.8760 82.59513 10.35265       6.310089      10.35265       6.310089      10.35265       6.310089  189.8760 82.59513 189.8760 82.59513 0.000000       0.000000 
1 1 1 9   0  11 o 229.4570 79.47598 13.65099       6.387693      13.65099       6.387693      13.65099       6.387693  229.4570 79.47598 229.4570 79.47598 0.000000       0.000000 
1 1 1 9   0  12 o 266.4965 49.57717 15.29059       4.609603      15.29059       4.609603      15.29059       4.609603  266.4965 49.57717 266.4965 49.57717 0.000000       0.000000 
1 1 1 9   0  13 o 73.97280 50.46933 -2.639743      4.501776      -2.639743      4.501776      -2.639743      4.501776  73.97280 50.46933 73.97280 50.46933 0.000000       0.000000 
1 1 1 9   0  14 o 74.53223 50.52357 -2.200037      4.363561      -2.200037      4.363561      -2.200037      4.363561  74.53223 50.52357 74.53223 50.52357 0.000000       0.000000 
1 1 1 9   0  15 o 83.53136 55.35408 -1.154475      4.727541      -1.154475      4.727541      -1.154475      4.727541  83.53136 55.35408 83.53136 55.35408 0.000000       0.000000 
1 1 1 9   0  16 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 9   0  17 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 9   0  18 o 483.0091 32.58277 46.10856       6.047993      46.10856       6.047993      46.10856       6.047993  483.0091 32.58277 483.0091 32.58277 0.000000       0.000000 
1 1 1 9   0  19 o 1098.084 23.41961 235.0630       9.976935      235.0630       9.976935      235.0630       9.976935  1098.084 23.41961 1098.084 23.41961 0.000000       0.000000 
1 1 1 9   0  20 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 9   0  21 o 451.4524 37.13303 40.68955       6.408959      40.68955       6.408959      40.68955       6.408959  451.4524 37.13303 451.4524 37.13303 0.000000       0.000000 
1 1 1 9   0  22 o 93.88889 64.51014 -4.987295      7.650361      -4.987295      7.650361      -4.987295      7.650361  93.88889 64.51014 93.88889 64.51014 0.000000       0.000000 
1 1 1 9   0  23 o 1180.335 24.62331 272.1452       11.27594      272.1452       11.27594      272.1452       11.27594  1180.335 24.62331 1180.335 24.62331 0.000000       0.000000 
1 1 1 9   0  24 o 1239.750 24.64513 300.5479       11.85511      300.5479       11.85511      300.5479       11.85511  1239.750 24.64513 1239.750 24.64513 0.000000       0.000000 
1 1 1 9   0  25 o 812.0170 27.81535 129.6836       8.748245      129.6836       8.748245      129.6836       8.748245  812.0170 27.81535 812.0170 27.81535 0.000000       0.000000 
1 1 1 9   0  26 o 523.9662 36.70663 55.15363       7.385034      55.15363       7.385034      55.15363       7.385034  523.9662 36.70663 523.9662 36.70663 0.000000       0.000000 
1 1 1 9   0  27 o 83.99310 57.89516 -3.854758      6.279111      -3.854758      6.279111      -3.854758      6.279111  83.99310 57.89516 83.99310 57.89516 0.000000       0.000000 
1 1 1 9   0  28 o 82.76586 57.64940 -4.926004      6.655599      -4.926004      6.655599      -4.926004      6.655599  82.76586 57.64940 82.76586 57.64940 0.000000       0.000000 
1 1 1 9   0  29 o 662.8116 34.14538 88.90253       8.735970      88.90253       8.735970      88.90253       8.735970  662.8116 34.14538 662.8116 34.14538 0.000000       0.000000 
1 1 1 9   0  30 o 107.3784 73.20016 -1.689619      9.426225      -1.689619      9.426225      -1.689619      9.426225  107.3784 73.20016 107.3784 73.20016 0.000000       0.000000 
1 1 1 9   1  0  o 707.5244 13.68017 97.36908       3.758900      95.51659       5.242146      99.32960       5.392833  700.1740 19.27859 713.9913 19.44895 -13.81732      27.38477 
1 1 1 9   1  1  o 364.5255 18.10016 25.87970       2.562349      25.70988       3.562451      26.06173       3.688239  361.9106 25.50987 364.2772 26.24696 -2.366516      36.60131 
1 1 1 9   1  2  o 370.3546 17.58044 26.71134       2.528573      25.28672       3.581053      28.12784       3.570852  358.8238 25.87169 378.7661 24.40567 -19.94238      35.56657 
1 1 1 9   1  3  o 291.1615 23.05426 16.64916       2.585516      15.99758       3.076421      18.21626       4.771023  284.5571 28.21041 300.9552 41.96243 -16.39810      50.56355 
1 1 1 9   1  4  o 540.5986 16.72910 56.91167       3.512171      61.22691       5.114592      53.06106       4.831415  559.9315 23.52058 521.2126 23.86885 38.71887       33.51029 
1 1 1 9   1  5  o 505.9517 17.32437 49.86900       3.404038      44.62247       4.720622      55.55239       4.913227  477.0139 25.57558 533.2463 23.72526 -56.23239      34.88550 
1 1 1 9   1  6  o 629.0339 16.33654 77.06760       3.990820      69.35020       5.969701      83.30341       5.366163  595.3505 25.81974 653.3147 21.15015 -57.96423      33.37646 
1 1 1 9   1  7  o 455.4782 24.51397 40.68517       4.320240      42.60809       5.465960      37.48418       7.052257  464.9291 30.44079 432.8214 42.50406 32.10776       52.28037 
1 1 1 9   1  8  o 496.2101 22.42831 48.09721       4.322054      44.67466       5.398003      54.21042       7.214283  476.3538 29.32179 523.2583 35.71506 -46.90448      46.20966 
1 1 1 9   1  9  o 161.3730 50.89690 5.163617       3.564524      9.457385       4.525330      -1.855226      5.785804  213.0727 54.47696 128.7821 57.33997 84.29054       79.09242 
1 1 1 9   1  10 o 163.5651 47.31874 5.438233       3.176891      7.196356       4.605005      3.841597       4.388422  188.4874 57.59507 153.0179 56.24207 35.46953       80.50070 
1 1 1 9   1  11 o 526.5084 21.64997 54.07277       4.426807      44.37904       7.468718      59.32256       5.496315  472.5119 41.11070 550.9671 25.68727 -78.45520      48.47603 
1 1 1 9   1  12 o 870.2886 17.88506 147.4686       6.044798      169.3627       11.25898      138.6018       7.165018  930.1018 31.17027 843.1537 21.88177 86.94812       38.08408 
1 1 1 9   1  13 o 302.7030 29.43014 18.07006       3.415947      14.19865       4.834301      21.93052       4.827465  264.1051 48.93549 332.2131 38.10680 -68.10803      62.02266 
1 1 1 9   1  14 o 365.2674 28.96079 26.20542       4.074501      21.56342       6.959255      28.62656       5.025984  325.3992 57.15593 381.0287 34.33408 -55.62952      66.67556 
1 1 1 9   1  15 o 1264.132 22.01598 311.1391       10.80833      0.000000       0.000000      311.1391       10.80833  ?        ?        1264.132 22.01598 0.000000       22.01598 
1 1 1 9   1  16 f 606.3341 18.72380 71.51281       4.408939      69.90759       6.295308      73.05814       6.176745  598.9189 27.06580 612.3546 25.97339 -13.43567      37.51233 
1 1 1 9   1  17 o 505.6574 24.11580 49.78866       4.735720      46.88511       5.768948      55.78825       8.292653  489.3437 30.50861 532.4146 40.40798 -43.07086      50.63181 
1 1 1 9   1  18 o 910.9041 23.34704 161.5612       8.259093      161.5612       8.259093      0.000000       0.000000  910.9041 23.34704 ?        ?        0.000000       23.34704 
1 1 1 9   1  19 o 627.8370 19.87891 76.71138       4.846939      78.68954       6.783123      74.64758       6.928400  635.2352 27.49585 618.5737 28.84121 16.66156       39.84768 
1 1 1 9   1  20 o 211.7969 56.07093 9.195381       4.684419      12.11571       5.817673      3.810943       7.899570  242.3534 61.66208 184.6628 73.48116 57.69061       95.92545 
1 1 1 9   1  21 o 590.2676 21.84146 67.86646       5.006781      73.53877       6.971060      61.82286       7.195591  613.6796 29.25022 561.2710 33.15874 52.40863       44.21626 
1 1 1 9   1  22 o 655.4233 20.77652 83.66549       5.288380      79.24035       7.350035      88.41515       7.614787  636.8566 29.71801 672.7949 29.14386 -35.93829      41.62361 
1 1 1 9   1  23 o 880.1182 21.04666 150.9327       7.193697      147.0336       11.77178      153.2566       9.088048  866.0376 35.00075 885.9882 26.41282 -19.95062      43.84848 
1 1 1 9   1  24 o 803.2932 19.49044 125.7445       6.080283      118.9024       8.390938      133.3093       8.822958  779.7219 27.71040 825.6507 27.51629 -45.92877      39.05140 
1 1 1 9   1  25 o 461.5111 27.71724 41.86275       4.944732      34.79851       6.742490      50.08344       7.273471  417.1617 42.19905 502.5503 37.53885 -85.38861      56.47943 
1 1 1 9   1  26 o 270.8197 45.58918 15.00349       4.624475      6.447433       6.396953      24.37006       6.693085  188.9356 68.13633 344.7861 51.56997 -155.8504      85.45187 
1 1 1 9   1  27 o 197.6769 57.70765 8.176840       4.705918      6.900029       6.666486      9.445020       6.643918  192.8756 69.55701 213.8548 69.68877 -20.97920      98.46169 
1 1 1 9   1  28 o 519.9069 27.09373 53.37088       5.451508      56.43017       7.719459      50.32718       7.699771  530.5981 37.70770 499.9625 39.99103 30.63556       54.96502 
1 1 1 9   1  29 o 483.0681 28.91116 46.33791       5.398857      45.33333       7.671155      47.32384       7.599621  471.9077 42.30696 482.9419 40.90429 -11.03418      58.84760 
1 1 1 9   1  30 o 157.7297 61.95337 3.746876       5.547994      8.618811       6.855438      -5.500284      9.444711  202.7914 70.78133 147.9044 68.64503 54.88705       98.60090 
1 1 1 9   2  0  o 264.1801 27.50668 13.79246       2.780675      17.03231       4.739542      12.09190       3.433753  290.6127 43.31816 245.2928 37.21416 45.31985       57.10829 
1 1 1 9   2  1  o 433.0737 19.64606 36.55156       3.304192      31.36390       5.319850      39.80972       4.216002  398.1646 34.75230 450.9076 24.16396 -52.74295      42.32753 
1 1 1 9   2  2  o 833.8802 15.14472 135.3225       4.904480      135.0985       8.348816      135.4406       6.060425  831.4252 25.85674 833.7560 18.71699 -2.330811      31.92016 
1 1 1 9   2  3  o 434.4585 20.40074 36.80656       3.442091      41.02426       4.601789      31.44970       5.186133  457.3496 26.01651 398.7608 33.80743 58.58881       42.65913 
1 1 1 9   2  4  o 617.7454 18.97414 74.38139       4.551972      78.58144       9.205013      73.02185       5.237137  630.3417 37.77699 611.6686 22.04701 18.67316       43.73982 
1 1 1 9   2  5  o 371.5046 24.99384 27.10430       3.585024      39.29570       7.618107      23.63644       4.063038  442.8123 44.92137 345.7981 30.57013 97.01419       54.33656 
1 1 1 9   2  6  o 460.8089 21.20806 41.44780       3.795332      35.99224       7.313303      43.45867       4.440041  423.3168 45.18378 470.8473 24.36511 -47.53049      51.33452 
1 1 1 9   2  7  o 430.1158 25.58000 36.32780       4.253547      33.91889       5.417864      40.19827       6.867503  413.7635 34.01820 449.1137 39.78627 -35.35025      52.34678 
1 1 1 9   2  8  o 336.2290 26.33136 22.26487       3.410770      24.40039       4.923565      20.29445       4.729405  349.8451 36.79021 318.1511 39.10062 31.69397       53.68778 
1 1 1 9   2  9  o 844.9471 15.50004 139.0115       5.086164      146.4088       7.472445      132.6261       6.942592  865.8840 22.22158 824.2300 21.68928 41.65399       31.05195 
1 1 1 9   2  10 o 335.9484 26.30925 22.20840       3.405063      18.14092       4.891959      26.03112       4.742490  299.7904 43.27084 362.3648 34.10132 -62.57437      55.09324 
1 1 1 9   2  11 o 656.6927 16.84702 83.96444       4.296486      82.40068       6.067890      85.53674       6.084443  649.6401 24.05121 661.9441 23.66854 -12.30402      33.74404 
1 1 1 9   2  12 o 916.0346 17.67843 163.3617       6.289030      180.9479       11.64260      156.1160       7.473120  961.4513 31.18134 894.9331 21.50222 66.51819       37.87640 
1 1 1 9   2  13 o 782.2447 22.48478 119.2484       6.830607      0.000000       0.000000      119.2484       6.830607  ?        ?        782.2447 22.48478 0.000000       22.48478 
1 1 1 9   2  14 o 1009.262 21.49457 198.3617       8.424821      0.000000       0.000000      198.3617       8.424821  ?        ?        1009.262 21.49457 0.000000       21.49457 
1 1 1 9   2  15 o 983.9744 15.65709 188.2573       5.983053      184.0151       8.360035      192.7114       8.566368  972.1694 22.14309 994.8724 22.17182 -22.70294      31.33538 
1 1 1 9   2  16 o 289.9602 32.45635 16.61321       3.592135      9.912327       4.980353      23.87883       5.185977  220.1185 57.59568 347.2034 39.14394 -127.0849      69.63842 
1 1 1 9   2  17 o 269.2785 35.03900 14.39784       3.577418      11.74574       4.951286      17.29452       5.174563  239.5765 54.45149 293.3217 47.01364 -53.74525      71.93919 
1 1 1 9   2  18 o 886.4360 19.26357 152.8670       6.631505      165.2419       8.335380      131.5268       10.94594  921.2149 23.29896 820.5514 34.34940 100.6635       41.50570 
1 1 1 9   2  19 o 744.8253 25.08481 108.1095       7.255931      108.1095       7.255931      0.000000       0.000000  744.8253 25.08481 ?        ?        0.000000       25.08481 
1 1 1 9   2  20 o 671.4284 19.81571 87.75301       5.166986      81.35435       7.048768      95.18449       7.596364  645.6862 28.11019 698.4286 28.00630 -52.74243      39.68041 
1 1 1 9   2  21 o 768.6347 18.81362 114.9876       5.615913      116.6682       7.867429      113.2416       8.018938  773.3862 26.19440 761.8231 27.10408 11.56305       37.69321 
1 1 1 9   2  22 o 1139.984 17.03122 252.8595       7.540020      255.7709       10.61168      249.8909       10.71548  1145.408 23.85589 1132.067 24.37313 13.34131       34.10503 
1 1 1 9   2  23 o 375.1653 32.07545 27.74941       4.628374      27.66867       6.374076      27.83947       6.731563  371.9179 45.04974 372.4486 47.63046 -0.5306702     65.56020 
1 1 1 9   2  24 o 394.7729 31.58545 30.73817       4.801867      38.30996       6.650104      22.48955       6.940962  439.2618 39.40209 331.2777 55.94340 107.9841       68.42652 
1 1 1 9   2  25 o 487.6512 29.94027 46.81888       5.642704      52.02893       9.129492      43.59821       7.177920  509.3597 46.67133 468.0063 39.87309 41.35342       61.38466 
1 1 1 9   2  26 o 412.3541 30.85515 33.62380       4.905313      32.23082       6.794503      35.14024       7.089199  399.7962 44.51734 417.6870 44.38373 -17.89078      62.86262 
1 1 1 9   2  27 o 530.0052 26.42763 55.16425       5.439592      58.58814       7.630646      51.62659       7.756384  542.3317 36.44162 507.7610 39.64878 34.57068       53.85181 
1 1 1 9   2  28 o 454.8898 30.52167 41.08731       5.360661      35.37533       7.390207      47.43017       7.787635  415.8210 46.56301 484.3783 41.80900 -68.55731      62.57880 
1 1 1 9   2  29 o 151.0656 60.98264 2.765612       5.523444      1.245456       6.863646      5.559238       9.304542  153.6882 65.46311 195.2337 79.03131 -41.54555      102.6225 
1 1 1 9   2  30 o 164.7955 59.08339 5.193342       4.802982      2.041783       6.641992      8.647549       6.953601  155.3803 65.19937 203.2340 71.26654 -47.85374      96.59129 
1 1 1 9   3  0  o 561.4942 17.20846 61.39759       3.752453      59.51683       6.039539      62.58011       4.788973  550.7501 28.33315 566.3819 21.77234 -15.63177      35.73237 
1 1 1 9   3  1  o 628.1119 16.14511 76.80569       3.938275      73.94688       6.367528      78.57680       5.011868  614.9435 26.66292 634.8337 20.32880 -19.89020      33.52866 
1 1 1 9   3  2  o 648.8399 16.99202 81.98737       4.281643      77.53049       5.359115      89.85302       7.119429  630.3489 21.89193 677.7302 27.04957 -47.38129      34.79850 
1 1 1 9   3  3  o 824.0280 16.15286 132.2122       5.169153      126.3925       6.353884      143.6030       8.889254  805.0461 20.32313 856.7601 26.71641 -51.71393      33.56778 
1 1 1 9   3  4  f 380.2920 21.95256 28.32288       3.228344      31.27660       4.152236      23.80829       5.133411  398.8650 26.96413 345.2213 38.97174 53.64371       47.39051 
1 1 1 9   3  5  o 354.2699 25.97110 24.68724       3.548260      15.92125       7.328004      27.37190       4.055367  273.8319 68.95123 372.7173 28.22647 -98.88544      74.50507 
1 1 1 9   3  6  o 688.1553 15.75275 92.22449       4.209890      88.83739       8.995405      93.17442       4.763795  670.7794 34.64963 691.4183 17.74125 -20.63885      38.92748 
1 1 1 9   3  7  o 347.1266 22.48520 23.63693       3.014893      21.52784       4.963206      24.87026       3.795378  327.5820 39.83325 355.1901 27.73473 -27.60809      48.53765 
1 1 1 9   3  8  o 205.2365 42.66701 8.651182       3.289819      13.57753       4.982553      4.843588       4.380409  256.0851 51.87807 162.4889 56.58702 93.59615       76.76865 
1 1 1 9   3  9  o 532.4113 18.79525 55.26215       3.886184      54.23201       5.695151      56.15976       5.316186  525.4214 28.01172 535.8129 25.54813 -10.39142      37.91257 
1 1 1 9   3  10 o 319.0203 27.02093 20.05218       3.316245      18.98708       4.837294      20.99666       4.555170  307.2944 41.60369 324.5544 36.78999 -17.26001      55.53711 
1 1 1 9   3  11 o 261.8739 32.39352 13.64435       3.224149      10.46328       4.799859      16.25974       4.352208  224.6145 55.37660 284.4873 40.53971 -59.87282      68.62971 
1 1 1 9   3  12 o 629.9684 23.87829 77.41702       5.841844      0.000000       0.000000      77.41702       5.841844  ?        ?        629.9684 23.87829 0.000000       23.87829 
1 1 1 9   3  13 o 67.96392 33.81266 -8.788262      3.504260      -23.27681      6.330411      -2.387053      4.207756  78.66444 39.92231 105.0225 47.64124 -26.35806      62.15689 
1 1 1 9   3  14 o 420.0105 26.55645 34.53833       4.309395      34.63288       7.743398      34.49591       5.186851  416.5780 48.78782 418.9559 32.12388 -2.377899      58.41399 
1 1 1 9   3  15 o 452.7078 25.88548 40.06912       4.532061      43.38099       8.149975      38.58654       5.452911  467.9254 45.42107 443.4315 31.87729 24.49393       55.49086 
1 1 1 9   3  16 o 1304.279 15.79246 330.7305       7.999233      321.5392       11.09285      340.6881       11.54600  1285.252 22.22424 1322.933 22.47323 -37.68115      31.60637 
1 1 1 9   3  17 o 2175.955 22.11980 921.5775       18.69214      917.6203       22.68063      929.9561       33.00293  2170.039 26.91285 2180.373 38.97568 -10.33423      47.36460 
1 1 1 9   3  18 o 541.3826 20.81084 57.04012       4.375443      59.82006       6.126906      54.14681       6.250566  553.1354 28.62009 525.8925 30.73894 27.24292       41.99991 
1 1 1 9   3  19 o 872.9730 19.80306 148.3156       6.713686      156.6183       8.262356      132.1801       11.51826  896.6312 23.72805 821.9573 36.08359 74.67389       43.18617 
1 1 1 9   3  20 o 1036.052 19.26351 208.9196       7.750772      211.4158       9.470909      203.8575       13.48706  1041.641 23.41237 1020.894 34.01799 20.74707       41.29604 
1 1 1 9   3  21 o 177.0498 59.12712 5.909399       4.772250      1.552088       5.645542      16.81701       8.932257  148.4707 61.00525 284.0179 78.40739 -135.5472      99.34466 
1 1 1 9   3  22 o 677.2521 20.39411 89.32712       5.363930      88.63817       7.363315      90.10609       7.829628  673.7364 28.14203 679.0771 29.68889 -5.340759      40.90726 
1 1 1 9   3  23 o 1085.524 17.41014 229.3726       7.339554      229.6586       10.22661      229.0688       10.53987  1084.948 24.27139 1083.386 25.05094 1.562012       34.88051 
1 1 1 9   3  24 o 253.8222 48.70987 13.20206       4.626857      21.55229       6.446197      4.328674       6.645062  324.9149 52.90715 176.1945 68.19617 148.7203       86.31271 
1 1 1 9   3  25 o 375.8774 33.60605 28.00750       4.853854      25.74831       6.653841      30.57712       7.096272  355.9996 49.46427 388.9366 47.99947 -32.93692      68.92506 
1 1 1 9   3  26 o 509.1767 29.91552 51.13734       5.889535      49.27993       9.048479      52.50267       7.757811  493.9230 47.76896 513.1253 39.22749 -19.20227      61.81157 
1 1 1 9   3  27 o 572.2084 25.36443 64.25574       5.636472      58.10937       7.703894      71.33581       8.268355  539.7861 36.97302 598.8189 35.71714 -59.03284      51.40738 
1 1 1 9   3  28 o 167.8276 64.29000 4.523437       5.862205      5.687322       6.891558      1.476738       11.15006  183.3042 69.82774 189.7091 82.14960 -6.404984      107.8168 
1 1 1 9   3  29 o 216.1585 57.65566 10.12516       4.929099      16.80020       6.905947      3.193375       7.037512  275.6746 65.47808 166.3579 68.20517 109.3167       94.54800 
1 1 1 9   4  0  o 413.0279 18.08865 33.23877       2.901439      33.32196       3.974486      33.14386       4.245410  412.1691 24.94757 410.7521 26.76023 1.417023       36.58540 
1 1 1 9   4  1  o 177.7461 35.72064 6.433473       2.380192      5.943458       3.246902      7.002687       3.499470  170.3752 47.36194 184.2840 48.30829 -13.90886      67.65237 
1 1 1 9   4  2  o 460.4553 17.27399 41.30162       3.088930      37.45700       3.623574      51.52326       5.908414  438.1360 21.29611 511.8138 29.85521 -73.67789      36.67230 
1 1 1 9   4  3  o 573.6048 15.16498 64.05122       3.378178      60.03308       3.961792      74.75586       6.466429  554.9909 18.38137 617.9966 26.94328 -63.00568      32.61618 
1 1 1 9   4  4  o 464.8607 17.44669 42.10730       3.149662      39.97578       4.362886      44.42731       4.551700  451.4423 24.98254 476.0366 24.70591 -24.59433      35.13559 
1 1 1 9   4  5  o 223.0258 35.45218 10.03306       2.967856      6.875999       7.200975      10.67907       3.257380  197.6395 72.13515 229.7045 37.83236 -32.06493      81.45408 
1 1 1 9   4  6  f 515.0632 17.91234 51.71380       3.582951      51.80280       8.103349      51.69217       3.994648  509.6954 41.29281 514.7114 19.98420 -5.016022      45.87444 
1 1 1 9   4  7  f 430.0204 19.90003 36.07959       3.323310      23.78325       7.270275      39.32756       3.736531  339.1791 57.23117 448.7864 21.43882 -109.6074      61.11489 
1 1 1 9   4  8  o 130.8573 47.41995 2.865510       3.103839      3.939764       4.690231      2.028501       4.140054  156.2425 58.01196 133.9583 53.23013 22.28423       78.73267 
1 1 1 9   4  9  o 237.6240 36.57912 11.37399       3.267329      5.932980       4.821618      15.99399       4.442974  176.2463 59.42933 281.3639 41.94258 -105.1176      72.73943 
1 1 1 9   4  10 o 292.2263 39.55932 17.13606       4.374080      0.000000       0.000000      17.13606       4.374080  ?        ?        292.2263 39.55932 0.000000       39.55932 
1 1 1 9   4  11 o 450.4704 23.81783 39.71264       4.151934      46.75846       7.789037      36.91599       4.907231  485.2303 41.74031 433.3820 29.32932 51.84833       51.01434 
1 1 1 9   4  12 o 768.9908 18.21685 115.1229       5.440295      127.5631       9.823489      109.6196       6.533739  807.4390 31.32767 749.8860 22.43565 57.55304       38.53286 
1 1 1 9   4  13 o 603.7628 17.68949 70.93378       4.147721      69.33173       5.937145      72.46104       5.796896  596.2096 25.64193 609.6358 24.48483 -13.42621      35.45441 
1 1 1 9   4  14 o 1355.901 15.67202 357.5129       8.252408      364.7332       11.88995      350.8018       11.46308  1368.482 22.37243 1342.160 21.99223 26.32239       31.37170 
1 1 1 9   4  15 o 271.8555 39.94403 14.77258       4.091393      23.70026       7.833608      11.42375       4.797770  341.0519 61.40249 236.1876 53.54174 104.8643       81.46769 
1 1 1 9   4  16 o 297.3300 50.04677 17.83562       5.573611      9.117149       7.929305      26.35027       7.836075  222.2417 76.20501 361.1335 57.82411 -138.8918      95.65998 
1 1 1 9   4  17 o 734.2032 17.25842 104.8255       4.920908      103.7462       6.833663      105.9881       7.091953  729.9051 24.10789 737.6920 24.75499 -7.786926      34.55430 
1 1 1 9   4  18 o 828.5570 16.82160 133.5050       5.412745      132.4074       7.588964      134.6416       7.722334  824.5323 23.69992 831.4369 23.91615 -6.904541      33.67000 
1 1 1 9   4  19 o 808.6464 17.52033 127.2058       5.502105      129.2938       7.702904      125.0308       7.861834  814.5654 24.35009 800.9152 25.27606 13.65015       35.09710 
1 1 1 9   4  20 o 905.8840 19.99195 159.7556       7.033246      159.2292       8.450299      160.9424       12.68819  903.8700 24.07344 906.6371 36.03613 -2.767090      43.33743 
1 1 1 9   4  21 o 1373.796 19.45953 367.4063       10.38204      368.3962       12.59974      365.3127       18.32317  1374.825 23.59860 1366.154 34.53606 8.670776       41.82862 
1 1 1 9   4  22 o 251.3230 53.06899 12.96759       5.017155      7.844317       5.866302      26.92201       9.681592  200.8427 65.48537 359.8724 71.79079 -159.0298      97.17125 
1 1 1 9   4  23 o 770.1301 19.58771 115.5350       5.858357      115.0879       7.966341      116.0616       8.645164  767.5847 26.72419 770.4398 28.89393 -2.855103      39.35786 
1 1 1 9   4  24 o 199.0049 56.42665 8.150341       4.561422      11.10703       6.158989      4.558341       6.788511  231.0038 65.59116 178.8217 69.00798 52.18216       95.20663 
1 1 1 9   4  25 o 189.4278 57.87586 7.306741       4.650166      4.711783       6.182168      10.68806       7.056975  174.4917 66.21602 227.6345 71.58937 -53.14281      97.51717 
1 1 1 9   4  26 o 645.4183 22.96981 81.49706       5.757403      83.09676       7.825198      79.60905       8.501132  649.7249 31.01258 633.9824 34.65930 15.74255       46.50857 
1 1 1 9   4  27 o 210.8782 64.82611 9.359088       5.823878      10.17471       6.691216      6.810553       11.82786  219.8121 69.77710 219.9300 89.07857 -0.1179047     113.1540 
1 1 1 9   4  28 o 500.4027 33.32155 49.93573       6.438468      50.53973       9.860668      49.48684       8.500684  494.2620 52.15911 492.9372 44.89751 1.324829       68.82121 
1 1 1 9   4  29 o 391.4520 35.74673 30.89537       5.374331      30.26129       7.531720      31.55313       7.671099  379.5681 52.50038 387.8234 52.26342 -8.255310      74.07938 
1 1 1 9   5  0  o 98.37317 39.85707 0.8263813      2.368761      0.8588931      3.211101      0.7875689      3.508486  111.7966 45.98099 115.4525 47.82926 -3.655922      66.34674 
1 1 1 9   5  1  f 193.6176 35.79370 7.610882       2.592271      6.738554       2.974579      10.36523       5.285606  180.8662 42.98240 222.6951 59.83728 -41.82884      73.67487 
1 1 1 9   5  2  o 396.3111 20.31299 30.72199       3.115847      29.98616       3.710636      32.48143       5.737785  390.8601 24.57054 404.2241 36.95958 -13.36392      44.38155 
1 1 1 9   5  3  o 440.4106 17.48414 37.79845       2.990406      36.98177       3.559814      39.75653       5.512110  435.2752 21.05889 448.7276 31.83725 -13.45239      38.17181 
1 1 1 9   5  4  o 175.6737 37.62705 6.319904       2.489708      8.875068       3.422428      3.447673       3.628564  207.6705 43.81347 142.1632 51.30939 65.50732       67.47054 
1 1 1 9   5  5  o 491.8262 15.39127 47.10688       2.939775      43.37169       4.465301      49.96442       3.905622  470.2472 24.53605 506.0337 19.87388 -35.78656      31.57513 
1 1 1 9   5  6  o 651.3711 15.77577 82.63985       3.990680      97.79305       9.565744      79.44682       4.391048  704.3615 34.96996 638.4083 17.71094 65.95319       39.19918 
1 1 1 9   5  7  o 591.7355 16.50671 68.21638       3.793290      67.85728       8.742332      68.29967       4.210269  584.6372 38.72388 591.8707 18.31703 -7.233521      42.83752 
1 1 1 9   5  8  o 940.5336 14.56009 172.1931       5.318223      144.4690       10.65323      181.3958       6.137734  857.4710 31.99146 965.0247 16.37728 -107.5536      35.93979 
1 1 1 9   5  9  o 664.8545 22.79787 86.31414       5.886387      0.000000       0.000000      86.31414       5.886387  ?        ?        664.8545 22.79787 0.000000       22.79787 
1 1 1 9   5  10 o 1448.866 17.83491 408.8792       10.03523      433.6593       18.32512      398.2647       11.99344  1487.171 31.72912 1428.905 21.61288 58.26599       38.39080 
1 1 1 9   5  11 o 551.0739 18.11490 59.13395       3.876804      61.10114       5.682528      57.42111       5.302443  559.3148 26.16117 542.3267 25.17602 16.98810       36.30756 
1 1 1 9   5  12 o 456.8587 20.57088 40.65591       3.649747      35.64713       5.234483      45.39485       5.091529  425.6905 31.89482 481.4096 27.34646 -55.71906      42.01319 
1 1 1 9   5  13 o 937.6144 15.33551 170.9667       5.584066      161.6592       7.806753      180.7176       7.990581  910.9897 22.06627 963.2894 21.35962 -52.29968      30.71081 
1 1 1 9   5  14 o 1035.776 18.19316 208.7166       7.318159      219.7937       9.104429      188.4939       12.30156  1062.430 22.06605 982.3182 32.24631 80.11145       39.07346 
1 1 1 9   5  15 o 488.7791 20.89653 46.49431       3.966567      48.02412       5.592496      44.94566       5.626807  495.3754 29.19899 479.0187 30.40451 16.35675       42.15466 
1 1 1 9   5  16 o 1357.987 18.60583 358.6966       9.812339      350.4770       17.22866      362.6429       11.93764  1339.875 33.11000 1364.898 22.52114 -25.02283      40.04340 
1 1 1 9   5  17 f 464.5540 26.50788 42.18867       4.762503      35.10146       8.812812      45.11221       5.660186  418.4453 55.60817 479.9229 30.52772 -61.47760      63.43666 
1 1 1 9   5  18 o 339.5254 29.60735 22.66109       3.864843      25.05601       5.405217      20.15586       5.528287  355.4988 39.83634 317.1092 46.25171 38.38959       61.04224 
1 1 1 9   5  19 o 592.0897 20.22312 68.24257       4.650115      70.43146       6.517692      65.97320       6.636425  600.8320 27.93269 580.6053 29.52973 20.22668       40.64775 
1 1 1 9   5  20 o 256.5508 56.49305 13.53680       5.476286      13.53680       5.476286      0.000000       0.000000  256.5508 56.49305 ?        ?        0.000000       56.49305 
1 1 1 9   5  21 f 499.5697 27.71119 48.86256       5.355164      51.07292       6.435120      43.88428       9.657493  509.9785 32.66370 467.7993 54.16074 42.17917       63.24796 
1 1 1 9   5  22 o 436.8465 31.48664 37.51939       5.305930      35.25657       6.285830      43.12783       9.895973  422.0225 38.78708 462.6937 56.22843 -40.67123      68.30866 
1 1 1 9   5  23 o 1142.401 17.45197 254.0865       7.742678      257.6881       10.74836      250.2016       11.16301  1149.100 24.08554 1131.969 25.39327 17.13110       34.99902 
1 1 1 9   5  24 o 582.6323 26.85974 66.41299       6.077491      67.97820       7.153474      62.35207       11.52240  587.8302 31.44954 555.8500 54.06144 31.98016       62.54368 
1 1 1 9   5  25 o 838.1272 19.86407 137.0734       6.465561      145.6691       8.947700      127.6812       9.353139  862.2966 26.71940 806.4144 29.86559 55.88220       40.07343 
1 1 1 9   5  26 o 148.7604 61.01575 1.943402       5.635000      4.024881       6.535192      -4.089519      11.12592  171.1965 67.24075 171.7727 77.73747 -0.5762634     102.7834 
1 1 1 9   5  27 o 194.2354 64.87412 7.627985       5.745042      11.10684       6.564390      -3.756561      11.87502  227.6382 68.59019 177.1627 80.23206 50.47554       105.5547 
1 1 1 9   5  28 o 170.6229 61.25460 5.458368       5.164105      11.98375       6.975745      -2.454080      7.681448  233.7229 70.77029 144.3167 65.01748 89.40619       96.10258 
1 1 1 9   5  29 o 124.1606 55.50943 -1.511678      5.482296      -0.2372406     8.839293      -2.308391      6.988904  162.9318 71.78935 136.9980 61.84112 25.93381       94.75249 
1 1 1 9   6  0  o 148.4630 42.39199 4.483747       2.565245      8.520391       3.478251      -0.3303672     3.798472  203.1130 45.25396 110.9375 47.99368 92.17553       65.96449 
1 1 1 9   6  1  o 503.8910 16.85534 49.47454       3.298390      49.50140       3.847582      49.40007       6.406147  503.7115 19.66881 499.9677 33.18190 3.743774       38.57331 
1 1 1 9   6  2  o 1119.140 14.19814 243.8085       6.170832      239.8421       7.137045      255.5550       12.28207  1109.501 16.56391 1141.803 27.69825 -32.30212      32.27315 
1 1 1 9   6  3  o 288.3311 25.05163 16.38925       2.777266      18.44791       3.692112      13.70632       4.214896  304.7467 31.65869 259.3929 43.37226 45.35379       53.69754 
1 1 1 9   6  4  o 547.6129 16.35850 58.42638       3.478926      57.60297       4.770051      59.36209       5.084919  542.9075 22.62399 550.9522 23.76524 -8.044678      32.81206 
1 1 1 9   6  5  o 829.7329 20.53178 134.3945       6.615960      0.000000       0.000000      134.3945       6.615960  ?        ?        829.7329 20.53178 0.000000       20.53178 
1 1 1 9   6  6  o 576.5687 18.39681 64.82258       4.119282      0.000000       0.000000      64.82258       4.119282  ?        ?        576.5687 18.39681 0.000000       18.39681 
1 1 1 9   6  7  o 375.6546 23.31182 27.68425       3.384100      0.000000       0.000000      27.68425       3.384100  ?        ?        375.6546 23.31182 0.000000       23.31182 
1 1 1 9   6  8  o 96.50886 42.22179 -0.5991089     3.009557      0.000000       0.000000      -0.5991089     3.009557  ?        ?        96.50886 42.22179 0.000000       42.22179 
1 1 1 9   6  9  o 409.0850 35.20273 33.14513       5.538182      33.14513       5.538182      0.000000       0.000000  409.0850 35.20273 ?        ?        0.000000       35.20273 
1 1 1 9   6  10 o 695.6096 16.33759 94.18785       4.413483      91.96744       6.422429      96.17469       6.075247  686.3740 24.09409 702.1689 22.27893 -15.79492      32.81579 
1 1 1 9   6  11 o 495.0450 19.22073 47.72826       3.695238      43.60817       5.384426      51.39638       5.080518  471.3361 29.56551 513.1393 25.49440 -41.80325      39.03951 
1 1 1 9   6  12 o 656.2983 16.86103 83.80496       4.297474      86.21662       6.290889      81.69479       5.884533  664.9521 24.36092 647.3835 23.40574 17.56860       33.78289 
1 1 1 9   6  13 o 175.7558 52.95483 6.159445       3.912813      7.169225       4.643146      3.685353       7.267865  189.6580 57.80747 178.5109 70.65565 11.14702       91.29033 
1 1 1 9   6  14 o 1081.770 15.32463 227.5267       6.438027      231.2905       9.297089      224.0591       8.923866  1089.934 21.96438 1072.830 21.41875 17.10376       30.67893 
1 1 1 9   6  15 f 171.7098 47.72758 5.961284       3.297422      2.935196       4.718122      8.850604       4.610268  149.3833 57.56322 208.2882 55.84933 -58.90485      80.20395 
1 1 1 9   6  16 o 1255.753 15.72379 306.5747       7.668131      301.4598       10.71566      311.9430       10.97785  1244.483 22.17184 1265.915 22.32979 -21.43140      31.46760 
1 1 1 9   6  17 o 702.8081 20.90700 96.12851       5.706326      92.04863       10.46465      97.85502       6.807475  684.6337 39.52662 708.7722 24.73155 -24.13849      46.62621 
1 1 1 9   6  18 o 1180.819 18.84255 271.3005       8.640740      271.1038       15.50603      271.3890       10.40621  1177.710 33.90272 1180.469 22.69917 -2.759644      40.80008 
1 1 1 9   6  19 o 299.5483 34.53694 17.78116       3.944111      16.35074       5.435863      19.37140       5.731501  283.6971 51.22342 309.8468 49.28181 -26.14969      71.08118 
1 1 1 9   6  20 o 476.2234 24.38935 44.32590       4.495512      40.20140       6.130683      49.12310       6.611767  451.8153 35.21793 499.8769 34.26538 -48.06155      49.13674 
1 1 1 9   6  21 o 427.3309 27.01230 35.77995       4.459777      30.07239       5.985807      42.90159       6.686331  389.3488 40.16413 466.3446 37.22956 -76.99579      54.76493 
1 1 1 9   6  22 o 532.3287 27.56322 55.49435       5.678678      53.18726       6.686253      61.46592       10.75710  520.1013 33.27742 555.0228 50.45764 -34.92145      60.44303 
1 1 1 9   6  23 o 548.6588 27.10266 58.84628       5.774869      65.41909       6.917912      43.73795       10.48836  577.0895 30.98096 463.6803 59.62694 113.4092       67.19518 
1 1 1 9   6  24 o 868.8868 19.00280 147.1784       6.412225      153.6648       8.871562      140.0831       9.278640  886.3580 25.77288 845.6636 28.25262 40.69440       38.24202 
1 1 1 9   6  25 o 366.5713 40.02633 26.93189       5.605520      31.14410       6.538462      15.24962       10.88889  393.4354 43.52206 268.8987 89.29349 124.5367       99.33527 
1 1 1 9   6  26 o 351.7710 44.32356 25.10525       5.920691      29.56049       6.833094      11.68410       11.85979  381.1006 47.17699 247.1889 92.15563 133.9117       103.5294 
1 1 1 9   6  27 o 196.6053 59.52091 8.118381       4.934639      8.144022       6.522490      8.084059       7.546159  201.2358 69.10858 204.9046 73.98725 -3.668808      101.2428 
1 1 1 9   6  28 o 204.6437 60.14400 8.994422       5.096439      8.784763       6.894825      9.246943       7.566869  206.0536 71.03709 211.7191 74.33714 -5.665497      102.8216 
1 1 1 9   6  29 f 386.9737 40.45972 30.55777       5.990497      37.31236       9.850111      26.59308       7.546509  414.7664 63.14503 352.5130 57.07540 62.25336       85.11696 
1 1 1 9   7  0  o 486.5631 18.32934 46.17569       3.463490      43.47388       4.042406      53.63443       6.716528  471.6418 22.06986 520.6892 33.39133 -49.04736      40.02574 
1 1 1 9   7  1  o 720.9643 15.05795 101.2331       4.216067      100.7788       4.974953      102.3909       7.941938  718.9158 17.81899 722.3503 28.31071 -3.434509      33.45164 
1 1 1 9   7  2  o 131.0267 43.44823 3.264355       2.578367      2.306618       3.032758      5.761572       4.897142  123.6301 46.50106 174.3850 59.88236 -50.75483      75.81719 
1 1 1 9   7  3  o 1070.965 16.29837 223.4888       6.778718      229.6035       11.01475      219.7610       8.600275  1082.552 26.19980 1060.820 20.87578 21.73169       33.49966 
1 1 1 9   7  4  o 376.5616 22.37379 27.80880       3.257221      24.61525       4.685522      30.79540       4.531167  351.6622 34.76390 394.8920 29.76517 -43.22977      45.76564 
1 1 1 9   7  5  o 536.6118 17.81485 56.13971       3.712533      54.44516       5.597432      57.47065       4.960679  526.2950 27.48153 542.1184 23.56237 -15.82336      36.19972 
1 1 1 9   7  6  o 135.6440 47.56418 3.286772       3.097400      0.000000       0.000000      3.286772       3.097400  ?        ?        135.6440 47.56418 0.000000       47.56418 
1 1 1 9   7  7  o 561.5181 18.42052 61.46622       4.016924      0.000000       0.000000      61.46622       4.016924  ?        ?        561.5181 18.42052 0.000000       18.42052 
1 1 1 9   7  8  o 558.5175 16.70719 60.75363       3.623832      52.76350       8.504873      62.52604       4.005645  514.5159 42.95672 566.4468 18.20897 -51.93091      46.65669 
1 1 1 9   7  9  o 267.8659 28.47039 14.19648       2.916287      19.00883       7.868608      13.43019       3.139900  300.4650 68.90197 259.8459 31.77733 40.61911       75.87675 
1 1 1 9   7  10 o 998.5223 15.11839 193.9831       5.862616      189.0772       8.434309      198.5692       8.154739  984.7290 22.05489 1009.375 20.80317 -24.64612      30.31814 
1 1 1 9   7  11 o 666.2241 20.50671 86.45947       5.305720      82.55794       6.283086      96.15625       9.905342  650.5353 24.86991 699.2539 36.60321 -48.71857      44.25276 
1 1 1 9   7  12 o 368.8953 35.90884 26.89638       5.079159      26.89638       5.079159      0.000000       0.000000  368.8953 35.90884 ?        ?        0.000000       35.90884 
1 1 1 9   7  13 o 1055.410 21.08901 216.8629       8.643816      0.000000       0.000000      216.8629       8.643816  ?        ?        1055.410 21.08901 0.000000       21.08901 
1 1 1 9   7  14 o 1364.133 15.60237 361.8040       8.265615      367.4594       11.90524      356.5410       11.48479  1373.825 22.31407 1353.334 21.85194 20.49084       31.23179 
1 1 1 9   7  15 o 474.3926 20.87821 43.79462       3.846442      45.44693       5.463542      42.17085       5.416149  481.8669 29.33538 463.9910 30.22246 17.87595       42.11842 
1 1 1 9   7  16 o 661.2522 17.63020 85.03757       4.527437      79.71209       6.368270      90.48000       6.437822  639.6558 25.63582 681.6039 24.32086 -41.94806      35.33694 
1 1 1 9   7  17 o 279.4889 34.17622 15.48729       3.632227      17.67805       5.038039      13.11602       5.241490  296.8372 45.12449 253.0977 54.90509 43.73946       71.06889 
1 1 1 9   7  18 o 1161.576 18.84870 262.5547       8.502706      283.2027       16.06985      254.5267       10.02023  1203.405 34.38525 1143.151 22.57076 60.25354       41.13131 
1 1 1 9   7  19 o 212.5636 56.05602 9.272746       4.693699      14.18220       8.669527      7.236992       5.582661  263.0337 78.72792 194.2253 63.90966 68.80840       101.4028 
1 1 1 9   7  20 o 982.0106 16.80097 187.6116       6.407352      190.4180       8.952738      184.6647       9.174043  988.4543 23.32229 973.2589 24.27194 15.19550       33.66090 
1 1 1 9   7  21 o 581.8027 21.41364 65.94600       4.838316      59.82525       6.489738      73.60513       7.259633  552.4041 30.36777 613.6225 30.46389 -61.21844      43.01454 
1 1 1 9   7  22 o 385.9300 30.56209 29.31986       4.543106      31.23881       6.129083      26.97985       6.768199  396.4955 40.36726 366.1723 48.81042 30.32321       63.34013 
1 1 1 9   7  23 o 325.3983 41.37630 21.21956       5.110469      24.78090       6.114295      12.96490       9.308705  350.8489 45.98124 252.5868 82.49757 98.26204       94.44641 
1 1 1 9   7  24 o 362.0728 39.56684 26.20719       5.473031      29.01489       6.381785      18.40051       10.64142  379.9323 44.07071 291.9318 87.18801 88.00043       97.69328 
1 1 1 9   7  25 o 401.2570 37.21007 32.11177       5.732467      33.46241       6.617208      28.04968       11.47573  408.1126 42.36846 356.8551 84.17052 51.25751       94.23249 
1 1 1 9   7  26 o 329.8545 40.17656 21.97229       5.040313      23.94549       6.778603      19.53231       7.537856  339.9949 53.07190 301.4861 66.19362 38.50876       84.84233 
1 1 1 9   7  27 f 538.3469 31.52232 57.54673       6.561604      70.54375       7.807782      26.29704       12.10678  595.2181 33.91763 335.8313 90.69708 259.3868       96.83164 
1 1 1 9   7  28 o 569.5457 30.20064 64.47779       6.656075      59.97587       10.12581      67.90308       8.832412  539.2878 48.87943 579.8543 39.45689 -40.56647      62.81755 
1 1 1 9   7  29 o 687.7678 26.70183 93.54037       7.131992      81.91109       11.31519      101.2058       9.186574  630.6832 46.52644 711.8743 33.22939 -81.19104      57.17431 
1 1 1 9   8  0  o 187.8890 43.35159 7.305333       3.098898      11.24168       3.800549      -0.5032717     5.352862  234.0521 43.41089 130.2977 56.67081 103.7544       71.38687 
1 1 1 9   8  1  o 135.0348 46.71767 3.334003       2.983322      2.300904       3.590241      5.638683       5.362382  129.8133 50.15987 175.7834 62.49218 -45.97006      80.13292 
1 1 1 9   8  2  o 505.8337 18.48974 49.91497       3.632174      48.23925       4.403503      53.48172       6.424417  496.6671 22.82995 520.2674 31.95110 -23.60031      39.26932 
1 1 1 9   8  3  o 464.2680 20.07573 42.07945       3.619662      41.63568       5.193772      42.49855       5.047319  459.5346 29.25513 464.5578 28.10882 -5.023224      40.57054 
1 1 1 9   8  4  o 309.4067 38.29487 19.21332       4.503208      0.000000       0.000000      19.21332       4.503208  ?        ?        309.4067 38.29487 0.000000       38.29487 
1 1 1 9   8  5  o 371.2445 21.08432 26.99602       3.027280      28.99742       4.110640      24.62414       4.474967  383.6169 27.78012 352.2133 33.10413 31.40359       43.21595 
1 1 1 9   8  6  o 742.7367 13.14747 107.3387       3.792321      106.4187       5.895504      107.9880       4.953069  738.4574 20.55737 744.4490 17.13213 -5.991638      26.76033 
1 1 1 9   8  7  o 514.2039 23.32718 51.64949       4.658279      64.38441       9.303016      47.38800       5.381531  568.7251 42.42582 491.0430 28.34053 77.68207       51.02094 
1 1 1 9   8  8  f 869.0462 14.54774 146.9609       4.909831      149.5972       11.40474      146.3611       5.439732  872.8076 33.64644 867.0577 16.15480 5.749878       37.32372 
1 1 1 9   8  9  o 654.6133 15.50539 83.38824       3.941808      82.15087       9.673405      83.63461       4.316432  644.9727 38.80035 655.4412 16.95755 -10.46851      42.34414 
1 1 1 9   8  10 o 481.3932 48.02018 46.25020       8.857619      0.000000       0.000000      46.25020       8.857619  ?        ?        481.3932 48.02018 0.000000       48.02018 
1 1 1 9   8  11 o 656.0098 16.45975 83.72307       4.193355      85.21934       6.258289      82.50395       5.649003  661.0964 24.37602 650.6940 22.35460 10.40247       33.07444 
1 1 1 9   8  12 o 758.2271 15.86535 111.8108       4.671722      113.6431       6.792135      110.1657       6.435878  763.7606 22.89924 752.0760 22.03525 11.68451       31.77936 
1 1 1 9   8  13 o 397.6403 22.56971 30.88896       3.470971      28.95821       5.064881      32.59864       4.766119  383.3994 34.38184 407.5734 30.32853 -24.17404      45.84682 
1 1 1 9   8  14 o 268.5967 32.33804 14.28420       3.305416      11.72325       4.748644      16.69135       4.603846  239.4730 52.50720 288.8953 42.28677 -49.42236      67.41793 
1 1 1 9   8  15 o 314.3970 28.42766 19.42707       3.433400      19.03283       4.889788      19.81046       4.822042  308.9882 41.82416 315.6382 40.25459 -6.649963      58.04906 
1 1 1 9   8  16 o 872.2592 16.02073 147.9347       5.426950      150.1405       7.716436      145.7757       7.633963  878.1547 22.62652 865.2864 22.71759 12.86823       32.06319 
1 1 1 9   8  17 o 960.5522 15.97467 179.4225       5.959104      187.8995       8.491959      171.1982       8.364381  982.3041 22.26045 937.5461 22.97276 44.75793       31.98867 
1 1 1 9   8  18 o 796.9540 17.06092 123.5543       5.280361      133.1885       7.534868      114.2568       7.402021  826.7697 23.46730 765.5936 24.89568 61.17603       34.21270 
1 1 1 9   8  19 o 1208.090 19.22918 284.0972       9.021694      265.1962       15.56823      293.6535       11.06988  1164.054 34.43801 1227.549 23.22075 -63.49500      41.53529 
1 1 1 9   8  20 o 1611.397 20.20882 505.6326       12.64653      508.6366       22.57281      504.2583       15.26768  1611.193 36.07532 1608.150 24.44660 3.042847       43.57826 
1 1 1 9   8  21 o 860.5820 17.92204 144.1576       5.989737      137.2672       8.152416      152.2401       8.829584  838.7973 25.02657 883.2402 25.74148 -44.44287      35.90199 
1 1 1 9   8  22 o 238.0615 47.91480 11.60722       4.276484      9.467839       5.655198      14.46459       6.535612  215.0520 63.39860 263.1526 64.46117 -48.10059      90.41364 
1 1 1 9   8  23 o 166.3454 59.52959 4.845250       4.873677      12.18287       5.705953      -14.94863      9.371650  241.2876 60.89109 126.1943 61.22510 115.0933       86.34951 
1 1 1 9   8  24 o 161.0376 63.35219 3.341466       5.809911      3.341466       5.809911      0.000000       0.000000  161.0376 63.35219 ?        ?        0.000000       63.35219 
1 1 1 9   8  25 o 491.9182 27.19878 47.63340       5.175834      59.53873       6.933182      32.64566       7.779107  548.5535 32.69353 399.5609 51.31859 148.9926       60.84789 
1 1 1 9   8  26 o 351.2747 37.74098 24.80768       5.067854      23.86852       6.582653      26.17442       7.941001  339.6150 51.52758 352.2496 60.21245 -12.63461      79.25043 
1 1 1 9   8  27 o 142.7650 58.08698 2.139705       5.055654      6.428126       6.729280      -3.417629      7.660430  187.5288 69.51513 140.3366 63.89932 47.19221       94.42180 
1 1 1 9   8  28 o 220.5063 70.30930 10.64741       6.787888      11.90172       8.362980      8.225657       11.62048  232.3049 78.26843 219.8459 88.55669 12.45905       118.1873 
1 1 1 9   9  0  o 357.1778 25.04983 25.11543       3.452714      27.46555       4.303323      20.86881       5.784684  372.5262 29.99961 319.3505 48.13776 53.17575       56.72055 
1 1 1 9   9  1  o 292.3029 29.46815 16.95627       3.299499      18.59340       4.001844      13.48070       5.830846  305.0912 34.37454 252.3614 60.31587 52.72984       69.42343 
1 1 1 9   9  2  o 393.4512 22.29118 30.35806       3.392060      29.85772       4.768511      30.87057       4.826204  388.1857 31.91378 394.7977 31.74610 -6.612000      45.01448 
1 1 1 9   9  3  o 332.1000 32.11137 21.90036       4.089792      -0.5119504     8.647124      28.35859       4.641789  165.0102 71.89560 378.3399 31.88915 -213.3297      78.65046 
1 1 1 9   9  4  o 561.6923 16.79849 61.48091       3.664348      68.26037       5.090405      54.18956       5.279085  591.0723 22.17603 526.0597 25.84019 65.01257       34.05131 
1 1 1 9   9  5  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 9   9  6  o 532.6963 16.50897 55.26821       3.415291      55.27113       4.570275      55.26452       5.139598  532.0699 22.11799 531.6536 24.89272 0.4162598      33.29945 
1 1 1 9   9  7  o 963.1249 14.60841 180.5115       5.464037      205.4641       13.80798      175.8787       5.949693  1022.383 34.77672 950.4614 16.11878 71.92169       38.33060 
1 1 1 9   9  8  o 1064.439 23.15167 221.0940       9.570424      237.6534       14.07344      206.8483       13.05330  1100.824 32.91959 1027.063 32.72618 73.76111       46.41877 
1 1 1 9   9  9  o 1017.042 14.38054 201.1924       5.679915      210.8850       13.44062      199.0851       6.267013  1037.409 33.36118 1011.504 15.95384 25.90521       36.97963 
1 1 1 9   9  10 o 332.0406 22.69366 21.58784       2.908802      3.893236       7.397523      24.82409       3.163641  180.4806 71.33132 356.1302 22.99731 -175.6496      74.94687 
1 1 1 9   9  11 o 875.1212 15.18159 148.9317       5.159570      148.9275       7.638194      148.9352       6.997323  874.3243 22.49521 874.5792 20.60178 -0.2548828     30.50357 
1 1 1 9   9  12 o 1017.927 14.96677 201.4657       5.916603      202.2328       8.591011      200.7736       8.160276  1019.125 21.70645 1015.570 20.69032 3.555359       29.98765 
1 1 1 9   9  13 o 586.6403 17.61078 66.93592       4.012162      62.62857       5.744949      71.03702       5.605720  566.8921 26.09503 603.9250 23.90124 -37.03296      35.38671 
1 1 1 9   9  14 o 665.2828 16.76971 86.06629       4.332711      83.76210       6.131144      88.36483       6.123622  655.8188 24.07297 673.6507 23.40699 -17.83185      33.57670 
1 1 1 9   9  15 o 1399.637 15.86416 380.8827       8.623039      385.3977       12.41568      376.6752       11.98534  1406.951 22.72290 1391.024 22.18645 15.92639       31.75797 
1 1 1 9   9  16 o 715.9155 17.08810 99.68372       4.750984      92.70293       6.573531      107.3181       6.874373  689.8010 24.53844 742.2559 23.84797 -52.45490      34.21784 
1 1 1 9   9  17 o 769.6260 16.84698 115.2148       5.035351      119.8968       7.070397      110.3962       7.172833  784.5000 23.20721 752.6311 24.54034 31.86890       33.77577 
1 1 1 9   9  18 o 700.7712 17.93994 95.55772       4.882309      97.39356       6.814370      93.62129       6.998569  706.7902 24.82603 692.8310 26.01081 13.95917       35.95683 
1 1 1 9   9  19 o 472.3120 23.14388 43.47548       4.245152      41.58447       5.770821      45.70560       6.266918  459.9864 32.51408 482.1441 33.68109 -22.15771      46.81432 
1 1 1 9   9  20 o 492.7182 29.99774 47.61946       5.712711      66.25778       11.00678      40.74753       6.683381  577.0183 49.60037 454.1348 38.25130 122.8835       62.63672 
1 1 1 9   9  21 o 702.0269 24.17333 96.14733       6.590497      87.14207       11.65505      100.3802       7.990673  662.9241 45.54758 716.6270 28.71192 -53.70294      53.84196 
1 1 1 9   9  22 o 480.3806 28.05053 45.29273       5.210299      45.77263       6.228947      44.17471       9.507502  481.8427 33.49571 467.9671 53.26360 13.87561       62.92037 
1 1 1 9   9  23 f 729.4189 22.44629 103.8964       6.358427      105.3861       7.769925      100.8762       11.06319  733.6487 27.27098 713.2930 40.10054 20.35571       48.49494 
1 1 1 9   9  24 o 158.6709 56.81489 4.449633       4.439898      5.649238       5.770613      2.709223       6.950701  178.6470 64.67027 166.6516 67.99157 11.99545       93.83548 
1 1 1 9   9  25 o 524.0776 29.04475 54.18941       5.888298      53.19213       6.861962      56.97472       11.46764  517.5986 34.33202 525.9415 57.05992 -8.342957      66.59220 
1 1 1 9   9  26 o 408.1908 32.39698 33.17365       5.093441      36.73309       6.802353      28.63119       7.684467  426.3568 41.61311 370.4272 55.09497 55.92950       69.04424 
1 1 1 9   9  27 f 342.2169 44.34720 24.05857       5.755204      21.90626       8.355808      26.00121       7.938401  314.2002 70.24252 348.0870 60.94477 -33.88684      92.99610 
1 1 1 9   9  28 o 351.9727 38.93279 25.23484       5.232610      27.82019       6.932922      21.81271       7.976360  364.3531 50.34135 312.9630 67.60311 51.39011       84.28779 
1 1 1 9   10 0  o 499.3196 18.92391 48.65691       3.669589      46.34290       4.445291      53.60712       6.501734  486.6355 23.52168 520.6458 32.31537 -34.01025      39.96940 
1 1 1 9   10 1  o 218.9626 44.42073 9.883298       3.648166      5.152504       4.967679      15.42154       5.374925  168.9087 60.13763 272.5048 52.69508 -103.5961      79.95815 
1 1 1 9   10 2  o 308.7669 27.90860 18.84952       3.310373      14.91557       4.584919      23.13361       4.784612  270.1579 45.30438 340.2677 36.79330 -70.10974      58.36295 
1 1 1 9   10 3  o 953.8007 14.97426 177.1461       5.546652      176.1042       7.675663      178.2847       8.024244  949.7535 20.81024 955.4089 21.62653 -5.655457      30.01288 
1 1 1 9   10 4  o 408.6285 20.92599 32.67550       3.309658      32.14627       4.350553      33.40254       5.099221  404.0849 27.89403 411.0212 32.20323 -6.936340      42.60428 
1 1 1 9   10 5  o 466.8152 17.96800 42.46561       3.257413      41.01316       4.288680      44.44600       5.007834  457.4691 24.22613 475.7228 27.21918 -18.25375      36.43884 
1 1 1 9   10 6  o 476.3358 17.40624 44.19326       3.219928      40.43410       4.212099      49.47880       4.994565  454.3846 23.95433 502.4687 25.68112 -48.08408      35.11880 
1 1 1 9   10 7  o 200.2103 64.64799 7.923687       5.725020      11.73335       8.143697      4.201258       8.049919  240.5872 77.04330 186.7533 74.21994 53.83389       106.9779 
1 1 1 9   10 8  o 126.4656 44.33239 2.803929       2.690692      -2.461716      7.786699      3.517926       2.867318  149.6317 66.57909 137.1898 45.83132 12.44189       80.82874 
1 1 1 9   10 9  o 711.2685 18.50811 98.48577       5.112387      77.02198       9.904840      106.2806       5.968943  624.5938 41.06286 738.6314 20.80854 -114.0377      46.03427 
1 1 1 9   10 10 o 797.2849 17.86431 123.6955       5.531306      133.9241       11.38118      120.5323       6.329042  827.0067 35.43646 786.7354 20.71483 40.27130       41.04688 
1 1 1 9   10 11 o 427.3045 23.79326 35.68571       3.932725      28.72651       8.479058      37.59315       4.439086  376.1723 60.06095 438.3171 26.19812 -62.14481      65.52602 
1 1 1 9   10 12 o 831.8300 15.25231 134.5316       4.927176      132.0606       7.210673      136.6959       6.748430  823.5301 22.54594 838.0389 20.73531 -14.50885      30.63124 
1 1 1 9   10 13 o 507.2656 19.00794 50.05941       3.744540      54.16600       5.506630      46.52714       5.107073  526.4728 27.02388 487.8282 27.06352 38.64459       38.24558 
1 1 1 9   10 14 o 1168.816 15.27922 265.5912       6.935456      255.6229       9.644718      276.2654       9.980322  1145.973 21.67141 1191.359 21.57118 -45.38599      30.57722 
1 1 1 9   10 15 o 561.8976 18.60132 61.42241       4.059093      65.72014       5.818971      57.34915       5.664975  580.7208 25.80185 542.3931 26.89403 38.32776       37.26962 
1 1 1 9   10 16 o 1007.764 15.54764 197.4880       6.084871      204.7090       8.726628      190.6550       8.488910  1025.296 21.91641 989.4520 22.09171 35.84369       31.11868 
1 1 1 9   10 17 o 1201.889 15.75297 280.9447       7.352835      286.9652       10.48208      275.1125       10.31684  1213.737 22.23797 1188.386 22.35430 25.35022       31.53161 
1 1 1 9   10 18 o 1012.399 16.17637 199.3765       6.360056      202.5028       8.903823      196.1195       9.087958  1019.461 22.48940 1003.134 23.32809 16.32697       32.40328 
1 1 1 9   10 19 o 511.8573 22.16878 51.05071       4.406753      47.78277       5.860580      55.30220       6.684580  493.4821 30.73276 530.7022 32.59130 -37.22006      44.79615 
1 1 1 9   10 20 o 355.1448 41.29765 25.13037       5.589501      25.13037       5.589501      0.000000       0.000000  355.1448 41.29765 ?        ?        0.000000       41.29765 
1 1 1 9   10 21 o 654.1258 29.16471 83.69987       7.408784      87.68764       11.35882      80.74721       9.774064  664.9655 44.23758 639.3431 39.55961 25.62238       59.34583 
1 1 1 9   10 22 o 166.3539 66.26891 3.207382       6.431511      8.852294       9.523992      -1.524848      8.720137  224.7067 82.81484 162.4163 71.44170 62.29037       109.3719 
1 1 1 9   10 23 o 665.8906 20.89440 86.55703       5.403322      90.45761       7.281126      81.77592       8.061176  679.3956 27.59611 644.9059 32.18652 34.48962       42.39714 
1 1 1 9   10 24 o 202.1271 54.39469 8.550147       4.363817      7.488052       5.769371      9.970195       6.671112  194.3872 65.01092 219.3896 69.67530 -25.00241      95.29463 
1 1 1 9   10 25 o 862.6179 19.76309 145.4338       6.620661      134.6900       8.768022      159.6851       10.09834  827.7147 27.27677 900.5824 28.87343 -72.86768      39.72024 
1 1 1 9   10 26 o 555.6665 32.28974 61.39220       6.937931      56.42089       8.792619      69.59412       11.29382  527.7137 43.28450 582.2494 50.44482 -54.53564      66.46975 
1 1 1 9   10 27 o 135.4123 55.96200 1.597512       4.786300      0.5723624      6.163349      3.155046       7.596995  143.1839 61.53645 170.4696 70.48149 -27.28571      93.56482 
1 1 1 9   10 28 o 446.4564 31.11095 39.85717       5.360403      40.63157       7.324492      38.96405       7.865944  445.1208 42.90253 433.2456 47.53146 11.87518       64.03020 
1 1 1 9   11 0  o 252.8009 34.60468 12.82854       3.308168      14.03035       4.107626      10.61005       5.580869  262.8015 41.63488 224.4700 61.97993 38.33156       74.66576 
1 1 1 9   11 1  o 601.4611 16.90184 70.50068       3.947931      68.91547       4.703741      74.27913       7.262006  594.1703 20.38470 614.8746 30.41179 -20.70428      36.61165 
1 1 1 9   11 2  o 658.5641 17.01145 84.51269       4.350781      82.14818       6.006495      87.12272       6.310635  648.1858 23.86127 667.4285 24.34671 -19.24274      34.08992 
1 1 1 9   11 3  o 258.0746 32.54200 13.28854       3.188991      9.953159       4.478726      16.71847       4.541762  218.6551 53.24074 287.7283 41.87398 -69.07326      67.73483 
1 1 1 9   11 4  o 90.96529 39.99229 -0.6785700     2.729518      4.216621       3.686488      -6.618458      4.060852  151.2709 51.95518 83.56690 40.48687 67.70402       65.86750 
1 1 1 9   11 5  o 460.6920 22.19331 41.41356       3.970641      41.06483       4.368994      43.06856       9.517763  457.8341 24.66324 461.4029 54.14544 -3.568848      59.49793 
1 1 1 9   11 6  o 720.7466 14.87482 101.0728       4.163536      104.0155       5.722863      97.76388       6.068594  730.5494 20.17139 707.9984 22.07129 22.55096       29.90028 
1 1 1 9   11 7  o 434.6251 20.47836 36.80664       3.456511      31.28618       8.932635      37.77880       3.748524  391.3107 60.74994 440.2165 21.92633 -48.90576      64.58575 
1 1 1 9   11 8  o 392.1854 20.81155 30.04692       3.158396      41.91181       8.957511      28.36239       3.375166  457.4005 51.31169 380.7500 22.93287 76.65048       56.20325 
1 1 1 9   11 9  o 1051.885 17.29876 215.2871       7.066611      211.9655       13.90432      216.4439       8.205344  1040.619 34.40568 1054.341 20.03954 -13.72241      39.81625 
1 1 1 9   11 10 o 292.0707 23.83292 16.73205       2.679728      16.54355       8.362635      16.75363       2.828900  282.0287 75.03809 292.0910 25.18473 -10.06235      79.15166 
1 1 1 9   11 11 o 290.3422 23.50389 16.52672       2.627458      24.82802       8.655232      15.68407       2.757590  347.8133 66.50115 282.5593 25.40142 65.25397       71.18733 
1 1 1 9   11 12 o 279.3271 29.18561 15.38258       3.119239      12.89843       4.900848      17.07413       4.044121  251.4563 51.90634 293.3236 36.27496 -41.86736      63.32567 
1 1 1 9   11 13 o 1024.727 15.06215 204.1409       5.994087      195.2925       8.371120      213.4512       8.586833  1001.654 21.51978 1047.234 21.11354 -45.58051      30.14768 
1 1 1 9   11 14 o 1312.240 15.36028 334.7950       7.827814      337.2263       11.22633      332.4943       10.92041  1316.120 21.96414 1306.923 21.51597 9.197876       30.74672 
1 1 1 9   11 15 o 649.0190 16.81250 81.92830       4.237578      89.34244       6.070655      74.88248       5.917943  677.2529 23.08111 619.8992 24.58226 57.35364       33.71980 
1 1 1 9   11 16 o 586.8304 18.10190 67.00852       4.125388      68.94276       5.739308      64.94087       5.933917  594.6913 24.85078 577.0200 26.48028 17.67126       36.31482 
1 1 1 9   11 17 o 672.0228 17.90067 87.88348       4.671767      91.12014       6.461583      84.33840       6.762434  683.6583 24.33727 657.4835 26.48440 26.17480       35.96841 
1 1 1 9   11 18 o 268.3212 55.28502 14.77839       5.569234      0.000000       0.000000      14.77839       5.569234  ?        ?        268.3212 55.28502 0.000000       55.28502 
1 1 1 9   11 19 f 1053.175 16.31952 215.8030       6.674763      221.5299       9.336488      209.8160       9.546082  1066.102 22.55054 1037.329 23.69630 28.77234       32.71149 
1 1 1 9   11 20 o 247.5389 47.70605 12.51077       4.419816      11.30355       5.238649      15.49265       8.233258  233.5652 58.01530 271.8809 75.36205 -38.31569      95.10633 
1 1 1 9   11 21 o 679.0421 21.97119 89.94975       5.793998      90.02186       6.960650      89.78708       10.45498  678.6178 26.41171 673.6632 40.14466 4.954590       48.05385 
1 1 1 9   11 22 o 882.1767 22.23043 151.9615       7.616080      157.1123       13.94408      149.7716       9.092056  891.3559 40.28199 874.7032 26.76538 16.65265       48.36346 
1 1 1 9   11 23 o 1310.395 20.73925 335.3291       10.55415      345.5147       19.30394      330.9862       12.60490  1321.602 37.61119 1300.229 24.96270 21.37305       45.14132 
1 1 1 9   11 24 o 430.1759 29.73049 36.58908       4.936319      39.81325       6.473726      32.11041       7.629910  446.4525 37.69033 396.0098 50.78176 50.44269       63.24041 
1 1 1 9   11 25 o 214.2995 58.70472 9.789700       5.029834      15.76427       7.112907      3.813943       7.113614  268.8208 68.06488 172.9513 69.42094 95.86948       97.22189 
1 1 1 9   11 26 o 394.3014 37.82951 31.37735       5.721674      32.79406       6.782888      27.88228       10.65374  400.4139 44.36480 349.8895 80.12919 50.52444       91.59106 
1 1 1 9   11 27 o 147.2734 59.88133 2.492724       5.368298      8.756335       6.468827      -11.36368      9.621402  203.3587 68.83495 133.1690 63.96448 70.18973       93.96651 
1 1 1 9   12 0  o 912.8371 17.59606 162.3988       6.237875      156.5247       7.899578      172.1282       10.16666  895.0787 22.72556 937.1710 27.93390 -42.09229      36.01047 
1 1 1 9   12 1  o 345.3794 27.69109 23.51129       3.682961      34.88131       5.265906      12.62395       5.152918  420.0928 32.53114 246.1415 55.26050 173.9512       64.12487 
1 1 1 9   12 2  o 715.0458 16.48540 99.57424       4.577848      98.82585       6.444468      100.3365       6.504052  711.3038 23.32942 716.7130 23.36742 -5.409180      33.01966 
1 1 1 9   12 3  o 771.0322 19.22869 115.8723       5.757716      110.0084       6.491538      137.4988       12.46659  750.7886 22.26394 835.2181 38.43436 -84.42950      44.41715 
1 1 1 9   12 4  o 505.9716 23.01544 49.96069       4.522448      49.55839       5.059758      51.55884       10.08458  502.9254 25.99472 506.3745 52.02057 -3.449127      58.15381 
1 1 1 9   12 5  o 258.7055 28.49493 13.24348       2.815391      15.72422       3.905126      10.55853       4.062674  280.6146 36.71461 226.8625 47.62959 53.75208       60.13768 
1 1 1 9   12 6  o 424.9341 17.93203 35.15325       2.959232      34.15141       3.916256      36.48655       4.517904  417.6944 24.24696 431.3658 27.10673 -13.67139      36.36880 
1 1 1 9   12 7  o 708.5446 16.90442 97.69055       4.651527      0.000000       0.000000      97.69055       4.651527  ?        ?        708.5446 16.90442 0.000000       16.90442 
1 1 1 9   12 8  o 1437.272 18.31932 402.0426       10.22531      404.9736       19.25088      400.8907       12.06852  1438.325 34.46400 1434.558 21.66247 3.767090       40.70663 
1 1 1 9   12 9  o 631.4937 15.19101 77.54613       3.725493      75.11179       10.31756      77.91111       3.995023  616.8833 43.34230 632.9124 16.25353 -16.02905      46.28965 
1 1 1 9   12 10 o 133.4979 48.44077 2.897576       3.240457      1.234880       7.883270      3.235636       3.554651  169.7919 71.12768 140.3395 50.76368 29.45241       87.38477 
1 1 1 9   12 11 o 1525.443 15.53602 452.4376       9.203728      437.3739       20.09859      456.4346       10.35303  1495.964 34.59525 1531.911 17.40227 -35.94727      38.72558 
1 1 1 9   12 12 o 712.6195 14.66916 98.72151       4.059672      106.1842       11.10106      97.56940       4.361804  735.4986 39.00403 708.3807 15.85519 27.11786       42.10346 
1 1 1 9   12 13 o 499.7709 18.82175 48.59377       3.653079      51.59806       5.669164      46.46058       4.777090  513.5604 28.53745 487.6476 25.31194 25.91281       38.14552 
1 1 1 9   12 14 o 758.6180 15.79402 111.9134       4.653116      104.9297       6.563699      118.9690       6.597429  733.9609 23.02755 781.6539 21.73363 -47.69299      31.66416 
1 1 1 9   12 15 o 846.1766 15.75924 139.2539       5.178743      143.9449       7.443417      134.8526       7.209864  859.6307 22.29628 832.0365 22.31294 27.59418       31.54349 
1 1 1 9   12 16 o 209.8569 43.47922 8.973083       3.427008      4.601376       4.693417      13.96571       5.015659  163.7156 58.43636 261.5473 51.21259 -97.83170      77.70160 
1 1 1 9   12 17 o 677.3580 17.80831 89.28999       4.684563      91.49532       6.485470      86.88416       6.773881  685.0054 24.37920 667.3131 26.13845 17.69226       35.74303 
1 1 1 9   12 18 o 671.1920 18.10533 87.68680       4.719339      96.16792       6.519832      78.35232       6.839980  702.2762 23.90564 633.4308 27.80531 68.84540       36.66899 
1 1 1 9   12 19 o 351.9584 31.26174 24.42724       4.228515      25.38530       5.204146      22.56581       7.253997  357.5622 38.06262 331.9093 58.40984 25.65295       69.71709 
1 1 1 9   12 20 o 725.8745 20.28147 102.6926       5.717274      103.5543       6.970090      100.9207       9.995351  728.2683 24.64444 715.8359 36.07065 12.43237       43.68570 
1 1 1 9   12 21 o 595.0460 21.14247 69.08244       4.885784      72.63897       6.431126      64.22795       7.513547  609.2266 27.18192 570.6212 34.06078 38.60547       43.57744 
1 1 1 9   12 22 o 270.8346 41.45356 14.85924       4.221341      19.45848       5.492883      8.224124       6.597530  309.0398 47.27026 205.0100 69.51574 104.0298       84.06495 
1 1 1 9   12 23 o 216.4785 64.60750 9.828972       5.844743      -7.292700      10.64101      17.22613       6.994266  157.3697 72.97601 284.1871 64.81031 -126.8174      97.60059 
1 1 1 9   12 24 o 380.4759 50.42847 29.75348       7.267679      0.000000       0.000000      29.75348       7.267679  ?        ?        380.4759 50.42847 0.000000       50.42847 
1 1 1 9   12 25 o 304.7815 41.36917 18.95398       4.770049      14.39026       6.227494      25.43252       7.419801  257.5165 62.82757 347.1540 57.01532 -89.63751      84.84132 
1 1 1 9   12 26 o 202.8553 56.81555 8.860423       4.654145      5.934667       6.129500      12.84384       7.152106  179.3507 66.37241 239.9849 71.43394 -60.63412      97.50951 
1 1 1 9   12 27 o 180.3226 61.51683 6.675325       5.166885      9.932261       6.327752      0.1592102      8.950336  212.8079 67.88758 164.8458 72.44749 47.96208       99.28425 
1 1 1 9   13 0  o 1236.028 15.34115 297.3866       7.364009      291.2572       8.589309      314.3905       14.30626  1222.639 18.08973 1266.852 29.07851 -44.21313      34.24613 
1 1 1 9   13 1  o 372.9851 26.27163 27.33182       3.781140      33.71677       5.261826      20.51424       5.437163  413.1664 33.07034 318.8362 45.17517 94.33023       55.98610 
1 1 1 9   13 2  o 760.9824 20.26854 112.8862       5.989974      119.8884       7.026215      94.25935       11.45972  783.7758 23.08350 689.4174 43.01669 94.35840       48.81889 
1 1 1 9   13 3  o 1009.288 15.17299 198.2074       5.947226      199.9880       8.399105      196.4169       8.422236  1012.794 21.35423 1003.662 21.60787 9.131897       30.37932 
1 1 1 9   13 4  o 855.6943 15.07917 142.4496       5.010997      149.7013       7.317253      136.0451       6.876504  876.3450 21.50032 835.4636 21.19397 40.88141       30.19020 
1 1 1 9   13 5  o 357.8275 22.72624 25.06223       3.141744      23.34753       4.407414      26.83361       4.479660  343.6734 33.44628 368.9897 31.56479 -25.31625      45.98901 
1 1 1 9   13 6  o 151.9788 40.43294 4.697332       2.428138      1.045613       3.213212      9.558617       3.707372  114.0096 46.33891 216.3023 45.57258 -102.2928      64.99350 
1 1 1 9   13 7  o 1835.440 16.77882 655.3904       11.95996      640.8185       16.30576      672.3591       17.59565  1813.372 23.15401 1857.094 24.39740 -43.72229      33.63542 
1 1 1 9   13 8  o 355.2269 20.24615 24.64415       2.781468      34.15944       8.954999      23.62813       2.926200  411.4664 57.62100 347.6423 21.78424 63.82410       61.60140 
1 1 1 9   13 9  o 469.4089 16.04555 42.84951       2.925054      30.00429       9.257980      44.27396       3.082977  383.6742 64.41644 477.1208 16.63849 -93.44656      66.53057 
1 1 1 9   13 10 o 613.7406 18.32850 73.27821       4.368576      59.26521       9.786031      76.76575       4.882024  547.2949 46.48207 628.0635 20.01559 -80.76862      50.60836 
1 1 1 9   13 11 o 986.4430 13.96315 189.1490       5.349134      191.8020       13.70295      188.6720       5.810103  990.4396 35.62527 985.1027 15.18708 5.336914       38.72735 
1 1 1 9   13 12 o 1171.215 14.42655 266.6711       6.561860      255.7417       15.58843      269.0248       7.233995  1143.698 35.09643 1176.232 15.83643 -32.53333      38.50392 
1 1 1 9   13 13 o 274.8744 25.53343 14.85382       2.694515      11.37298       8.920282      15.20332       2.826552  242.6364 80.83154 277.9835 26.50343 -35.34715      85.06567 
1 1 1 9   13 14 o 1128.780 15.07541 247.7716       6.608554      250.6321       9.515226      245.1060       9.185317  1134.406 21.59846 1121.909 21.08184 12.49634       30.18174 
1 1 1 9   13 15 o 671.3137 16.64565 87.67386       4.339644      89.90920       6.121098      85.41486       6.153398  679.2128 23.20574 661.9414 23.93688 17.27136       33.33888 
1 1 1 9   13 16 o 840.0034 16.08100 137.2642       5.245925      140.6396       7.311094      133.6821       7.531534  849.5691 22.15928 828.1203 23.41866 21.44879       32.24077 
1 1 1 9   13 17 o 671.4753 17.72328 87.75219       4.621705      91.63787       6.358341      83.39949       6.729604  685.5380 23.88275 653.6809 26.50914 31.85706       35.68081 
1 1 1 9   13 18 o 490.1138 23.07112 46.83859       4.391305      51.08995       5.478643      39.19962       7.343905  510.6621 27.72954 444.0751 43.12754 66.58707       51.27292 
1 1 1 9   13 19 o 652.7275 18.97736 82.99146       4.810562      87.35298       6.415041      77.38760       7.271490  668.9290 24.69400 628.8579 29.77439 40.07104       38.68214 
1 1 1 9   13 20 o 376.3749 27.99234 27.87618       4.062278      27.76604       5.262180      28.03862       6.390731  373.8552 36.71761 373.6444 44.94323 0.2108154      58.03513 
1 1 1 9   13 21 o 211.9861 49.52861 9.324658       4.003968      8.786556       5.132040      10.16171       6.400795  206.0693 60.29416 221.6760 67.93054 -15.60667      90.82920 
1 1 1 9   13 22 o 393.4952 29.34956 30.58575       4.452801      32.58669       5.736758      27.55329       7.062309  404.2785 36.94753 367.0828 50.91045 37.19571       62.90464 
1 1 1 9   13 23 o 1115.080 19.57027 242.9164       8.474831      260.3569       13.56209      231.7430       10.85526  1149.503 30.38005 1086.734 25.72106 62.76855       39.80604 
1 1 1 9   13 24 o 352.5934 46.44536 25.48609       6.205040      35.00430       11.74275      21.79884       7.308762  396.9656 78.94991 319.6887 61.09660 77.27692       99.82926 
1 1 1 9   13 25 o 421.1572 30.11857 35.29569       4.893629      33.19617       6.521218      38.00193       7.403759  403.7070 42.21888 430.9314 44.89945 -27.22446      61.63111 
1 1 1 9   13 26 f 573.9583 23.98619 64.89088       5.346502      72.08517       7.312444      56.62748       7.836970  601.1223 31.43280 529.0864 38.40280 72.03595       49.62656 
1 1 1 9   14 0  o 901.7936 18.90349 158.4281       6.620291      158.4281       6.620291      0.000000       0.000000  901.7936 18.90349 ?        ?        0.000000       18.90349 
1 1 1 9   14 1  o 528.1330 29.68668 54.74751       6.064122      0.000000       0.000000      54.74751       6.064122  ?        ?        528.1330 29.68668 0.000000       29.68668 
1 1 1 9   14 2  o 595.2249 18.66224 68.99593       4.313928      65.74999       6.062835      72.32451       6.139520  580.1464 26.90978 608.5856 25.97675 -28.43915      37.40224 
1 1 1 9   14 3  o 651.0026 17.28155 82.48743       4.369113      79.43486       6.201962      85.49494       6.156014  638.0189 25.03039 662.0475 23.94321 -24.02869      34.63810 
1 1 1 9   14 4  o 205.7018 40.44983 8.598134       3.116179      6.365554       4.558558      10.55657       4.269515  180.4037 57.62826 226.7868 49.83681 -46.38309      76.18874 
1 1 1 9   14 5  o 625.2028 16.44228 76.04356       3.992188      79.54499       5.779441      72.84825       5.521032  638.8259 23.29568 611.3481 23.25432 27.47778       32.91583 
1 1 1 9   14 6  o 406.4083 19.01693 32.14776       3.001449      34.75586       4.297667      29.66441       4.193626  421.2955 26.40080 388.8744 27.95503 32.42114       38.45109 
1 1 1 9   14 7  o 916.1362 13.67599 163.1606       4.865717      157.3618       6.681783      169.7072       7.099528  899.2166 19.13375 933.7741 19.57761 -34.55756      27.37486 
1 1 1 9   14 8  o 721.5721 29.33099 101.6069       8.219294      96.97220       11.10771      107.2157       12.21931  702.1165 40.91415 737.9455 42.82189 -35.82904      59.22569 
1 1 1 9   14 9  o 595.1918 32.36347 69.39569       7.452545      69.89902       10.01169      68.77020       11.16066  595.2462 43.61307 589.1257 49.23259 6.120483       65.77193 
1 1 1 9   14 10 f 462.0396 38.87677 42.09317       6.911022      38.93879       9.120101      46.34741       10.59142  440.9915 54.40624 480.7853 57.88858 -39.79382      79.44260 
1 1 1 9   14 11 o 436.3445 40.94350 37.64696       6.856994      27.45669       9.373245      49.37903       10.05737  365.5811 68.53850 497.6161 52.85197 -132.0350      86.54974 
1 1 1 9   14 12 o 353.5557 50.79225 25.13564       6.773755      30.36312       9.181877      18.89314       10.03378  385.9878 63.45932 300.7941 83.12724 85.19373       104.5812 
1 1 1 9   14 13 o 204.2971 31.67656 8.346688       2.431838      19.61703       8.916726      7.441033       2.527658  306.2833 75.45628 192.0271 35.19127 114.2562       83.25909 
1 1 1 9   14 14 o 828.4031 12.75727 133.4050       4.104189      141.0288       7.389566      130.0043       4.935405  850.7491 22.36606 817.5522 15.54459 33.19690       27.23738 
1 1 1 9   14 15 o 612.2333 17.37833 72.94176       4.131930      72.80455       5.916923      73.07237       5.772612  610.9548 24.93784 612.1483 24.28218 -1.193542      34.80690 
1 1 1 9   14 16 o 625.7270 18.93247 76.22892       4.600660      77.71945       5.933588      73.98207       7.285047  631.2848 24.20271 615.1385 30.49520 16.14624       38.93236 
1 1 1 9   14 17 f 234.3883 42.37390 11.13798       3.715142      15.10940       4.594200      3.633642       6.315289  273.4030 44.82293 169.1852 66.20287 104.2177       79.94946 
1 1 1 9   14 18 o 562.9983 19.82506 61.75707       4.334606      68.47914       5.855964      53.61054       6.446635  592.1958 25.46274 522.1909 31.94251 70.00494       40.84941 
1 1 1 9   14 19 o 234.6217 41.86828 11.18584       3.674948      11.29594       4.731053      11.01834       5.835269  233.4612 53.34753 229.9715 63.32673 3.489700       82.80238 
1 1 1 9   14 20 o 497.4532 22.47298 48.33156       4.341510      48.76336       5.659462      47.71408       6.767762  497.8010 29.40514 490.8486 35.74905 6.952362       46.28885 
1 1 1 9   14 21 o 639.1979 20.11564 79.76371       4.993408      90.17625       6.701855      66.76981       7.486631  678.5511 25.43223 581.2012 33.30782 97.34991       41.90715 
1 1 1 9   14 22 o 226.8255 52.02120 10.78975       4.484899      14.82270       6.203626      6.374016       6.491364  263.8329 61.65548 188.1070 68.51418 75.72589       92.17153 
1 1 1 9   14 23 o 221.9779 50.33443 10.36340       4.239192      8.811705       5.446161      12.74881       6.752551  204.6777 62.65024 242.4701 68.62067 -37.79236      92.91850 
1 1 1 9   14 24 o 485.5919 25.87754 46.55140       4.862426      47.06492       6.418363      45.85968       7.449233  485.2974 34.27601 476.2884 40.66257 9.008972       53.18167 
1 1 1 9   14 25 o 299.0893 53.06873 18.98467       5.938330      22.62971       11.96105      17.79233       6.840979  305.5714 92.70258 284.5021 63.52301 21.06927       112.3786 
1 1 1 9   14 26 o 137.4470 54.40844 2.568409       4.310138      3.271149       5.790809      1.695525       6.453867  155.9217 62.61731 151.4621 63.94913 4.459595       89.50095 
1 1 1 9   15 0  o 680.3035 17.23175 90.08429       4.552606      91.19218       5.468119      87.58133       8.218948  684.1231 20.58144 668.8810 31.64021 15.24207       37.74518 
1 1 1 9   15 1  o 1247.104 15.89280 302.5925       7.697169      294.4033       10.66800      311.4852       11.11674  1228.932 22.35257 1264.016 22.64627 -35.08496      31.81966 
1 1 1 9   15 2  o 784.0978 16.55585 119.6256       5.041383      113.1393       7.007308      126.5852       7.258511  761.7322 23.68759 805.7943 23.19505 -44.06213      33.15287 
1 1 1 9   15 3  o 310.7469 29.17722 19.02679       3.479872      20.08397       5.092694      18.10085       4.766088  316.8803 42.45016 300.6540 41.96331 16.22632       59.69033 
1 1 1 9   15 4  o 601.7665 17.50655 70.46099       4.091255      68.64214       5.933810      72.10917       5.648542  593.2383 25.75589 608.2220 23.91367 -14.98370      35.14583 
1 1 1 9   15 5  o 1486.510 22.50330 430.4570       12.99098      430.4570       12.99098      0.000000       0.000000  1486.510 22.50330 ?        ?        0.000000       22.50330 
1 1 1 9   15 6  o 647.3157 15.75910 81.48653       3.961646      83.27380       5.710201      79.82790       5.500885  653.8652 22.48719 640.2250 22.12442 13.64014       31.54622 
1 1 1 9   15 7  o 868.6613 13.93999 146.6888       4.702631      150.7557       6.714272      142.7727       6.588559  880.1238 19.64388 856.4880 19.80803 23.63586       27.89695 
1 1 1 9   15 8  o 871.1839 27.23753 148.0083       9.215216      136.0799       12.44797      162.4727       13.70744  833.5658 38.45304 910.7600 38.75470 -77.19421      54.59454 
1 1 1 9   15 9  f 993.3824 25.87134 192.3668       9.980753      176.4360       13.39047      212.2809       14.97129  949.5640 36.31146 1041.408 37.01778 -91.84375      51.85400 
1 1 1 9   15 10 o 1069.288 25.53983 222.8959       10.60573      222.1569       14.41597      223.7677       15.65849  1065.710 34.83188 1068.892 37.72144 -3.182251      51.34361 
1 1 1 9   15 11 o 837.5565 27.52148 136.8805       8.951872      131.1799       12.25170      143.4095       13.11173  818.0174 38.56611 855.1035 39.48330 -37.08612      55.19308 
1 1 1 9   15 12 o 552.8271 35.38088 60.08859       7.556169      61.75534       10.34175      58.17981       11.06716  557.5556 48.23669 539.6414 53.51402 17.91418       72.04532 
1 1 1 9   15 13 o 953.2715 26.24816 177.3214       9.717252      175.8840       13.38706      178.9222       14.12734  947.2658 36.39029 954.9846 38.09219 -7.718811      52.68081 
1 1 1 9   15 14 o 396.5890 47.21173 31.45591       7.128517      32.24730       9.873183      30.59412       10.30304  396.2505 66.51628 384.1505 71.69859 12.10007       97.80135 
1 1 1 9   15 15 o 595.1296 18.88646 68.95850       4.365058      71.82480       5.850250      65.35880       6.556129  606.7798 24.82649 577.5667 29.32545 29.21320       38.42313 
1 1 1 9   15 16 o 119.5558 47.57660 1.499851       3.311788      1.360712       4.295968      1.703669       5.199459  131.0668 53.46084 144.2541 58.82426 -13.18730      79.48808 
1 1 1 9   15 17 f 465.4583 21.64908 42.23945       3.913345      42.17670       5.302937      42.31448       5.798868  463.3743 29.62337 463.6100 32.41183 -0.2356873     43.90981 
1 1 1 9   15 18 o 459.1534 22.19727 41.13590       3.958088      41.97626       5.130383      39.90020       6.221159  462.1972 28.72426 449.0575 35.97520 13.13974       46.03583 
1 1 1 9   15 19 o 392.9404 25.61535 30.33013       3.887528      28.39981       4.911091      33.56940       6.361901  378.5490 33.76059 410.1111 40.47238 -31.56213      52.70475 
1 1 1 9   15 20 o 1038.278 17.97384 210.2090       7.247403      206.8845       10.75725      212.9723       9.807253  1027.343 26.96233 1043.300 24.20528 -15.95679      36.23345 
1 1 1 9   15 21 o 923.5695 18.89638 166.5126       6.777606      178.7783       10.34929      157.3019       8.968318  953.9870 27.93445 895.6174 25.78461 58.36957       38.01551 
1 1 1 9   15 22 o 416.4224 27.12739 34.23566       4.363073      32.40215       5.551091      37.19905       7.057183  402.5831 35.88157 429.0224 42.93317 -26.43927      55.95305 
1 1 1 9   15 23 o 151.4892 54.91010 4.086820       4.162174      6.723002       5.339138      0.2972395E-02  6.645354  183.4908 62.53415 145.9124 63.30204 37.57843       88.98129 
1 1 1 9   15 24 o 346.5124 33.56065 24.12773       4.459645      33.66351       5.894822      11.36558       6.819530  408.1738 37.61063 227.2304 70.19809 180.9433       79.63876 
1 1 1 9   15 25 o 180.0629 62.93928 6.538128       5.421459      9.678900       10.74141      5.464526       6.280070  222.4180 86.53162 175.5556 66.70990 46.86240       109.2608 
1 1 1 9   16 0  o 174.2626 51.26793 6.113550       3.701482      7.866154       5.258870      4.392818       5.210833  198.6719 61.68895 165.8155 61.22989 32.85645       86.91735 
1 1 1 9   16 1  o 1082.646 15.96802 228.0066       6.713758      229.4827       9.502914      226.5356       9.486482  1085.182 22.54894 1078.173 22.65628 7.009033       31.96501 
1 1 1 9   16 2  o 367.9691 26.72481 26.55623       3.792974      33.44180       5.450417      20.09032       5.281711  411.9526 34.38282 316.6487 44.15181 95.30389       55.96035 
1 1 1 9   16 3  o 718.6499 16.98812 100.4734       4.741225      92.60987       6.636239      108.6720       6.776161  689.2220 24.79333 746.7693 23.36519 -57.54730      34.06818 
1 1 1 9   16 4  o 204.9996 43.46227 8.563992       3.352763      8.753141       4.877593      8.394568       4.616241  207.1914 58.21054 202.8846 56.49898 4.306763       81.12091 
1 1 1 9   16 5  o 1142.030 15.07475 253.6074       6.685833      241.5826       9.229411      266.8853       9.698406  1113.843 21.33644 1170.722 21.33136 -56.87927      30.17069 
1 1 1 9   16 6  o 239.2949 31.05647 11.36837       2.818058      13.49781       4.419483      9.909333       3.658244  258.3139 45.72854 220.7798 44.20816 37.53406       63.60394 
1 1 1 9   16 7  o 622.8447 14.70098 75.42737       3.555938      77.36086       5.223404      73.75730       4.854542  630.3187 21.33858 615.5434 20.30774 14.77527       29.45741 
1 1 1 9   16 8  o 275.9635 65.11141 15.76382       6.865378      20.40507       9.174931      9.858775       10.34896  312.5557 76.26208 238.5420 86.56611 74.01369       115.3672 
1 1 1 9   16 9  o 982.8413 26.39086 188.4204       10.07314      191.2797       13.92629      185.2829       14.58788  988.2886 36.28470 972.1201 38.64063 16.16852       53.00639 
1 1 1 9   16 10 o 234.5680 68.99062 11.24011       6.703744      9.215604       8.893548      13.90389       10.20153  226.5070 80.48418 264.2167 86.36655 -37.70963      118.0546 
1 1 1 9   16 11 o 301.1994 61.98829 18.71931       7.009135      14.19119       9.564390      23.97219       10.30142  264.3520 83.37131 337.3857 79.86140 -73.03369      115.4496 
1 1 1 9   16 12 o 836.3269 28.32871 136.6211       9.200912      126.6607       12.23491      149.5865       13.95899  803.0944 39.22890 872.2469 41.20848 -69.15253      56.89504 
1 1 1 9   16 13 o 391.2935 49.16195 30.71977       7.305753      27.18032       9.885990      34.97856       10.84415  361.0283 73.01885 411.6515 70.36008 -50.62314      101.4016 
1 1 1 9   16 14 o 120.9630 58.93464 -15.56531      8.935279      -15.56531      8.935279      0.000000       0.000000  120.9630 58.93464 ?        ?        0.000000       58.93464 
1 1 1 9   16 15 o 407.0113 67.84894 34.15678       10.34696      34.15678       10.34696      0.000000       0.000000  407.0113 67.84894 ?        ?        0.000000       67.84894 
1 1 1 9   16 16 o 454.0946 20.47190 40.18748       3.610211      39.76766       5.067621      40.62013       5.144464  449.9453 29.15818 454.7376 29.28647 -4.792389      41.32671 
1 1 1 9   16 17 o 276.1089 32.83295 15.16564       3.451593      19.76182       4.512205      8.682893       5.358829  314.6555 37.67459 206.1617 61.93969 108.4937       72.49758 
1 1 1 9   16 18 o 489.4109 26.93881 47.03194       5.100404      47.03194       5.100404      0.000000       0.000000  489.4109 26.93881 ?        ?        0.000000       26.93881 
1 1 1 9   16 19 o 493.3987 23.48585 47.60886       4.500205      55.59015       6.155115      38.44250       6.596262  531.1594 29.96125 438.9830 39.10147 92.17636       49.26055 
1 1 1 9   16 20 o 561.9091 22.23618 61.75608       4.852375      70.34038       6.675494      52.13886       7.065707  598.2468 28.73261 512.2098 35.74465 86.03699       45.86112 
1 1 1 9   16 21 o 507.2492 22.20960 50.37679       4.375121      57.93282       5.670495      39.26197       6.877416  542.9209 26.89406 441.8979 40.52668 101.0229       48.63848 
1 1 1 9   16 22 o 174.8047 52.34129 6.352799       3.831444      8.096762       4.845231      3.442335       6.259318  195.9453 58.90272 163.2526 65.26350 32.69266       87.91389 
1 1 1 9   16 23 o 658.3011 20.08612 84.91312       5.135098      89.70813       6.874010      78.85834       7.724398  674.4897 26.24260 629.4452 31.70105 45.04449       41.15374 
1 1 1 9   16 24 o 236.8288 46.50523 11.83021       4.124598      7.263621       5.376514      18.36161       6.429951  186.7767 62.75703 290.6796 58.97551 -103.9029      86.11943 
1 1 1 9   16 25 o 389.6321 29.15027 30.32608       4.378922      32.69132       5.802591      27.19721       6.673884  400.9551 37.70772 359.8659 49.03024 41.08917       61.85335 
1 1 1 9   17 0  o 435.9096 25.29849 37.18511       4.264294      40.55370       5.892931      33.48220       6.178438  453.9871 33.66393 411.2487 39.15818 42.73846       51.63935 
1 1 1 9   17 1  f 763.8902 17.65587 113.5485       5.237789      114.8578       7.317173      112.1725       7.500951  767.5234 24.54843 758.3796 25.46840 9.143799       35.37322 
1 1 1 9   17 2  o 1194.592 16.02265 277.5744       7.433305      266.7476       10.18445      289.9170       10.87396  1170.107 22.41216 1219.766 22.95530 -49.65930      32.08194 
1 1 1 9   17 3  o 232.2623 40.79962 10.89101       3.545841      7.794850       5.098362      13.79169       4.934791  197.6553 60.63614 260.0485 50.68519 -62.39319      79.02993 
1 1 1 9   17 4  o 412.8604 23.17090 33.31704       3.700115      32.98703       5.395255      33.61008       5.084102  409.2094 34.26530 413.4703 31.90908 -4.260925      46.82201 
1 1 1 9   17 5  o 757.5135 16.33887 111.6169       4.806625      106.5524       6.822088      116.6092       6.773364  739.4171 23.75745 773.6654 22.54360 -34.24829      32.75103 
1 1 1 9   17 6  o 567.4479 16.90475 62.64197       3.725313      61.95594       5.555278      63.20257       5.021801  563.6698 25.37774 569.5523 22.70376 -5.882507      34.05130 
1 1 1 9   17 7  o 628.2758 15.28010 76.76926       3.728245      73.99625       5.524661      79.08813       5.052049  616.1985 23.08644 637.2980 20.41254 -21.09955      30.81648 
1 1 1 9   17 8  o 136.9064 61.49602 -2.963038      6.813060      3.439656       8.909313      -11.98052      10.57318  190.3324 77.23400 146.4746 69.42602 43.85774       103.8512 
1 1 1 9   17 9  o 1236.244 26.02510 298.2263       12.49467      277.5149       16.37402      327.0981       19.33245  1190.052 35.42920 1290.917 38.56209 -100.8655      52.36662 
1 1 1 9   17 10 o 709.8055 31.06872 98.54100       8.564277      87.85376       11.26541      113.1757       13.18277  666.4817 43.76746 756.4040 45.08180 -89.92230      62.83279 
1 1 1 9   17 11 o 840.5797 28.54045 138.0609       9.316821      144.8578       13.03022      130.9512       13.32673  858.6862 39.07413 814.5771 42.27259 44.10907       57.56527 
1 1 1 9   17 12 f 1204.039 36.32425 284.3996       16.98498      284.3996       16.98498      0.000000       0.000000  1204.039 36.32425 ?        ?        0.000000       36.32425 
1 1 1 9   17 13 o 386.9812 66.53898 30.86475       9.639360      30.86475       9.639360      0.000000       0.000000  386.9812 66.53898 ?        ?        0.000000       66.53898 
1 1 1 9   17 14 o 523.4214 54.57830 55.07264       10.93112      55.07264       10.93112      0.000000       0.000000  523.4214 54.57830 ?        ?        0.000000       54.57830 
1 1 1 9   17 15 o 455.3351 42.77519 41.27047       7.475327      46.07167       10.44186      36.22280       10.70652  476.8286 57.55198 418.4030 68.24372 58.42566       89.27170 
1 1 1 9   17 16 o 904.4404 27.93472 160.1065       9.811880      156.4370       13.46133      164.2659       14.33172  890.7057 38.91579 912.1598 40.45752 -21.45404      56.13599 
1 1 1 9   17 17 o 547.0833 22.52097 58.45837       4.784853      59.51011       5.292457      53.75103       11.19673  551.6556 24.70366 513.7396 57.08561 37.91608       62.20159 
1 1 1 9   17 18 o 654.8255 26.88628 84.05009       6.837294      84.05009       6.837294      0.000000       0.000000  654.8255 26.88628 ?        ?        0.000000       26.88628 
1 1 1 9   17 19 o 211.4847 45.10072 9.263955       3.591109      9.801044       4.576406      8.403267       5.793283  215.8823 54.56068 202.7142 64.98794 13.16809       84.85458 
1 1 1 9   17 20 o 354.5194 27.25745 24.84879       3.724031      30.42241       4.654471      14.93342       6.208064  391.5489 30.85964 264.1935 61.63538 127.3554       68.92922 
1 1 1 9   17 21 o 363.9804 27.91805 26.25586       3.916235      29.75085       4.934337      20.30716       6.437486  386.0146 33.23937 310.4473 55.42854 75.56735       64.63110 
1 1 1 9   17 22 o 431.4982 24.91190 36.76824       4.156834      44.88306       5.474479      25.71930       6.387980  475.2330 29.81354 352.3589 47.92554 122.8741       56.44204 
1 1 1 9   17 23 o 813.5798 17.98531 129.5726       5.682586      143.0498       7.929324      115.3421       8.147913  852.1882 23.95922 763.5093 27.47920 88.67889       36.45752 
1 1 1 9   17 24 o 495.9709 23.24164 48.47357       4.476627      49.16399       5.940466      47.56622       6.810071  495.7854 31.00894 484.9631 36.42495 10.82224       47.83650 
1 1 1 9   18 0  o 1111.301 24.13353 240.8308       10.41551      0.000000       0.000000      240.8308       10.41551  ?        ?        1111.301 24.13353 0.000000       24.13353 
1 1 1 9   18 1  o 956.4744 16.80026 178.0035       6.240469      180.8237       8.767738      175.1080       8.884126  963.0947 23.44178 947.6379 24.14039 15.45679       33.64930 
1 1 1 9   18 2  o 305.8012 33.05014 18.50849       3.862582      19.22676       5.502119      17.81052       5.423757  308.8023 47.39370 296.6531 48.77412 12.14917       68.00793 
1 1 1 9   18 3  o 966.5667 16.39805 181.7592       6.155339      181.2031       8.517176      182.3672       8.905748  964.2321 22.74500 967.1697 23.71045 -2.937622      32.85606 
1 1 1 9   18 4  o 722.3502 17.17626 101.5361       4.818416      98.58655       6.808578      104.4956       6.819975  710.9772 24.65885 732.0603 23.98877 -21.08313      34.40232 
1 1 1 9   18 5  o 1002.403 15.46048 195.4543       6.018569      191.4902       8.480845      199.4763       8.542572  991.2894 22.02981 1011.796 21.74041 -20.50671      30.95089 
1 1 1 9   18 6  o 386.5047 22.24344 29.21044       3.324666      30.58936       5.167890      28.23675       4.342632  393.7471 34.13392 378.9357 29.74842 14.81140       45.27795 
1 1 1 9   18 7  o 637.4427 15.99348 79.05526       3.959244      72.37588       5.844815      84.71911       5.382184  609.0940 24.70919 659.4136 21.01709 -50.31964      32.43859 
1 1 1 9   18 8  o 378.3518 52.51163 28.89788       7.507741      22.42237       10.10073      36.89200       11.22280  325.5172 80.37960 422.5838 70.89582 -97.06662      107.1779 
1 1 1 9   18 9  o 758.0856 30.28188 112.4064       8.915158      107.6372       11.99779      118.2863       13.32176  738.2148 42.02335 773.1852 44.55465 -34.97040      61.24605 
1 1 1 9   18 10 o 1097.615 26.88665 235.2963       11.46079      244.3950       16.03903      225.8039       16.38245  1115.753 37.01537 1071.712 39.36158 44.04016       54.03214 
1 1 1 9   18 11 o 680.8520 45.05370 91.87717       11.84539      91.87717       11.84539      0.000000       0.000000  680.8520 45.05370 ?        ?        0.000000       45.05370 
1 1 1 9   18 12 o 424.3296 64.44146 36.90144       10.28541      36.90144       10.28541      0.000000       0.000000  424.3296 64.44146 ?        ?        0.000000       64.44146 
1 1 1 9   18 13 o 640.8003 36.07022 80.89610       8.939835      125.5769       13.38809      44.94257       12.00962  796.4457 43.44886 467.3236 68.18096 329.1221       80.84830 
1 1 1 9   18 14 o 1007.445 27.42021 198.4971       10.72803      197.0840       14.72768      200.0945       15.65853  1000.604 37.90046 1007.431 40.02282 -6.827209      55.12051 
1 1 1 9   18 15 o 494.4803 40.23231 48.59924       7.658962      42.42497       10.31485      56.18634       11.43426  455.3982 59.76664 526.1812 56.85976 -70.78293      82.49293 
1 1 1 9   18 16 o 639.4642 33.89227 80.71078       8.386717      87.16730       12.01386      74.57351       11.71307  659.6979 47.20512 608.8031 49.98223 50.89478       68.74989 
1 1 1 9   18 17 o 365.7628 75.94353 28.83351       10.43453      0.000000       0.000000      28.83351       10.43453  ?        ?        365.7628 75.94353 0.000000       75.94353 
1 1 1 9   18 18 o 600.7714 22.81697 70.63332       5.323475      71.34606       6.094689      68.33953       10.93356  603.0898 26.02205 581.0370 48.90888 22.05280       55.40060 
1 1 1 9   18 19 o 182.9618 44.52402 6.975725       3.133615      6.138177       3.857800      8.600100       5.372519  172.8847 52.69178 202.7742 62.25152 -29.88959      81.55780 
1 1 1 9   18 20 o 385.0536 24.20597 29.22585       3.601272      30.64961       4.613644      27.00560       5.761403  392.6708 30.49349 364.8503 41.39434 27.82059       51.41347 
1 1 1 9   18 21 o 326.2249 28.60631 21.19016       3.587559      24.73074       4.579205      15.56330       5.772790  350.8950 34.03136 269.2532 56.98425 81.64178       66.37272 
1 1 1 9   18 22 o 285.7719 33.73608 16.51301       3.671858      21.54460       4.739862      8.961758       5.806612  325.2126 38.26092 203.8256 65.03303 121.3871       75.45325 
1 1 1 9   18 23 o 148.9863 51.34681 4.346407       3.602161      8.558486       4.639752      -2.044590      5.715193  198.3272 57.12954 123.6538 55.86042 74.67346       79.90101 
1 1 1 9   19 0  o 226.6720 48.96911 10.55369       4.184762      14.20136       5.799109      6.590363       6.044831  261.7998 58.50993 190.1662 66.45994 71.63358       88.54567 
1 1 1 9   19 1  o 786.8472 18.53144 120.5621       5.662752      110.9902       7.672455      132.0152       8.392591  753.8990 26.20555 822.1960 26.28407 -68.29706      37.11581 
1 1 1 9   19 2  o 743.4804 18.20969 107.6265       5.257751      102.8553       7.368745      112.5748       7.504274  725.7679 26.14374 759.3973 25.44554 -33.62939      36.48247 
1 1 1 9   19 3  o 431.1657 24.50503 36.39159       4.086305      35.60033       5.722974      37.21456       5.836513  424.6505 35.01483 434.2567 34.90303 -9.606171      49.43946 
1 1 1 9   19 4  o 734.5391 17.72076 105.0385       5.055047      103.6490       7.285529      106.3284       7.019711  728.6223 25.74724 738.1713 24.48692 -9.548950      35.53209 
1 1 1 9   19 5  o 516.3103 19.64943 51.92828       3.939932      56.66876       5.894430      48.09986       5.297121  537.7089 28.32705 495.3852 27.64421 42.32364       39.58060 
1 1 1 9   19 6  o 312.1801 27.22549 19.18256       3.267685      13.16064       5.062775      23.48248       4.278103  252.8484 53.24129 344.7823 32.32802 -91.93390      62.28752 
1 1 1 9   19 7  f 1090.819 15.03889 231.4863       6.370838      222.4563       9.019189      240.4786       9.000291  1068.231 21.74074 1110.833 20.86314 -42.60217      30.13189 
1 1 1 9   19 8  f 623.4996 35.43468 76.52085       8.544684      81.89717       11.46765      69.81034       12.81179  642.1019 46.29839 589.2025 56.69062 52.89948       73.19404 
1 1 1 9   19 9  o 811.0471 41.75965 129.9356       13.10854      129.9356       13.10854      0.000000       0.000000  811.0471 41.75965 ?        ?        0.000000       41.75965 
1 1 1 9   19 10 o 712.7841 45.14536 100.7599       12.43227      100.7599       12.43227      0.000000       0.000000  712.7841 45.14536 ?        ?        0.000000       45.14536 
1 1 1 9   19 11 o 450.2266 60.96309 41.31895       10.38511      41.31895       10.38511      0.000000       0.000000  450.2266 60.96309 ?        ?        0.000000       60.96309 
1 1 1 9   19 12 o 575.9263 37.11066 65.50060       8.256110      56.78134       11.13643      76.14094       12.30223  530.7245 54.82159 616.4239 51.87190 -85.69934      75.47251 
1 1 1 9   19 13 o 320.2313 62.79753 21.35555       7.530615      20.16576       9.992354      22.91971       11.45706  306.3990 82.24998 325.1261 88.40773 -18.72702      120.7518 
1 1 1 9   19 14 o 238.2789 72.60952 11.82845       7.326046      10.91250       10.39759      12.73147       10.32399  240.8956 86.86882 252.4178 86.93098 -11.52226      122.8950 
1 1 1 9   19 15 o 391.9642 51.62297 31.30700       7.666924      22.92407       10.88869      39.54968       10.79722  323.1049 85.46172 435.4405 65.91054 -112.3356      107.9255 
1 1 1 9   19 16 o 649.6317 47.31573 84.92215       11.85510      0.000000       0.000000      84.92215       11.85510  ?        ?        649.6317 47.31573 0.000000       47.31573 
1 1 1 9   19 17 o 559.5276 52.38870 63.86203       11.25128      0.000000       0.000000      63.86203       11.25128  ?        ?        559.5276 52.38870 0.000000       52.38870 
1 1 1 9   19 18 o 207.6461 72.06815 8.601167       7.102170      6.726765       10.77195      10.04255       9.446108  213.5917 85.53492 226.7726 82.64134 -13.18097      118.9362 
1 1 1 9   19 19 o 166.5381 49.22770 5.751747       3.405615      5.929912       3.653455      4.570630       9.406743  169.2948 51.20604 192.7059 78.91341 -23.41106      94.07117 
1 1 1 9   19 20 o 253.6738 30.17459 12.91710       2.914341      16.65686       3.972265      8.557320       4.288929  286.5439 36.52668 200.0146 53.96793 86.52936       65.16698 
1 1 1 9   19 21 o 380.8145 23.03515 28.63532       3.390659      29.71892       4.493572      27.20269       5.166845  385.6998 30.24186 366.4460 36.80415 19.25381       47.63523 
1 1 1 9   19 22 o 251.8231 35.40482 12.95877       3.366836      11.77850       4.364697      14.69291       5.290637  234.6956 49.44790 260.7936 54.01468 -26.09807      73.23032 
1 1 1 9   20 0  o 359.7668 32.59727 25.58638       4.504934      17.52560       6.225255      34.44849       6.527353  291.3191 57.06644 416.0076 40.93246 -124.6885      70.22852 
1 1 1 9   20 1  o 751.2856 19.21819 109.9756       5.607194      98.45034       7.507286      124.5174       8.432681  709.6055 27.24194 798.0442 27.20889 -88.43872      38.50256 
1 1 1 9   20 2  o 1027.572 16.65882 205.5544       6.647897      198.7530       9.101772      213.3320       9.733036  1009.220 23.22267 1045.410 23.97362 -36.19006      33.37704 
1 1 1 9   20 3  o 578.1378 21.25734 65.16887       4.772745      62.99431       6.690948      67.42149       6.809987  566.3788 30.53233 586.1057 30.01942 -19.72681      42.81809 
1 1 1 9   20 4  o 959.2910 16.46818 179.1265       6.135134      171.7154       8.527588      187.0784       8.833261  938.0695 23.40794 979.1710 23.22922 -41.10144      32.97769 
1 1 1 9   20 5  o 429.3673 23.52290 36.08144       3.907439      36.01777       5.802913      36.13425       5.285207  426.8935 35.31971 428.2562 32.00971 -1.362701      47.66659 
1 1 1 9   20 6  o 1331.321 15.80706 344.9280       8.172628      338.8863       11.46142      351.1774       11.65674  1318.138 22.38976 1341.834 22.36919 -23.69629      31.64936 
1 1 1 9   20 7  o 336.0920 26.10975 22.19772       3.381167      16.29573       5.004790      27.15329       4.585995  283.3376 47.13975 370.8876 32.15755 -87.54996      57.06368 
1 1 1 9   20 8  o 375.9238 33.64820 27.93538       4.860396      27.93538       4.860396      0.000000       0.000000  375.9238 33.64820 ?        ?        0.000000       33.64820 
1 1 1 9   20 9  o 155.3743 71.10513 -5.738567      9.640379      -5.738567      9.640379      0.000000       0.000000  155.3743 71.10513 ?        ?        0.000000       71.10513 
1 1 1 9   20 10 o 307.8271 67.50104 19.88888       7.847231      28.23022       10.33460      8.531159       12.05928  365.5081 75.31174 236.6938 91.79754 128.8143       118.7377 
1 1 1 9   20 11 o 630.7834 35.33622 78.48846       8.621388      85.34097       11.96334      71.08457       12.43533  653.8202 47.43865 593.7576 54.53833 60.06262       72.28316 
1 1 1 9   20 12 o 353.1933 57.53754 25.68962       7.620361      24.41916       10.46153      27.12567       11.12244  336.2518 81.06087 354.1673 82.41395 -17.91550      115.5981 
1 1 1 9   20 13 o 274.7696 69.79231 16.10839       7.461787      15.81372       10.05685      16.46927       11.12963  272.3301 85.43154 278.2238 90.16903 -5.893707      124.2135 
1 1 1 9   20 14 f 443.3561 68.12073 41.29781       11.35372      0.000000       0.000000      41.29781       11.35372  ?        ?        443.3561 68.12073 0.000000       68.12073 
1 1 1 9   20 15 o 895.0731 41.86292 159.6187       14.55178      0.000000       0.000000      159.6187       14.55178  ?        ?        895.0731 41.86292 0.000000       41.86292 
1 1 1 9   20 16 f 426.4288 46.01594 36.90773       7.499723      28.96515       10.64860      44.72507       10.56432  362.9959 77.87103 463.2458 60.14115 -100.2498      98.39133 
1 1 1 9   20 17 f 384.9530 51.37432 30.59607       7.488685      7.989021       10.91889      50.67488       10.29024  220.4230 86.80629 495.2532 54.39814 -274.8301      102.4426 
1 1 1 9   20 18 o 192.0905 70.60362 6.885923       6.915770      0.3686650      10.00031      12.85979       9.574340  176.6610 77.13461 243.7410 83.72836 -67.08005      113.8428 
1 1 1 9   20 19 o 209.1318 72.41551 9.126143       7.168796      11.63665       10.44619      6.891325       9.855952  235.4633 86.73882 205.6249 81.99702 29.83847       119.3614 
1 1 1 9   20 20 o 226.2532 38.93310 10.58279       3.297532      10.32832       3.508734      12.50765       9.650181  222.3669 42.17366 237.1782 83.88474 -14.81122      93.88965 
1 1 1 9   20 21 o 378.8800 21.82424 28.33494       3.197627      39.49101       4.443255      16.35004       4.605354  446.1518 25.75378 279.9657 43.79248 166.1862       50.80393 
1 1 1 9   21 0  o 234.1326 51.77617 11.34156       4.582848      15.29673       6.413820      7.215896       6.550595  270.2693 62.37384 197.4424 69.17419 72.82689       93.14272 
1 1 1 9   21 1  o 421.8138 42.30731 35.49914       6.837094      0.000000       0.000000      35.49914       6.837094  ?        ?        421.8138 42.30731 0.000000       42.30731 
1 1 1 9   21 2  o 949.1370 17.58223 175.4586       6.480834      165.3173       8.743660      187.8227       9.654441  919.9927 24.47264 980.4058 25.35673 -60.41302      35.24024 
1 1 1 9   21 3  o 606.9964 20.60978 71.83871       4.858336      72.80360       6.891232      70.88524       6.850399  609.8157 29.09848 601.6909 29.31666 8.124817       41.30603 
1 1 1 9   21 4  f 312.4195 33.24694 19.36380       3.971852      19.24356       5.742411      19.47408       5.499551  307.5168 49.78537 310.0899 47.15367 -2.573151      68.57151 
1 1 1 9   21 5  f 592.7640 19.64358 68.48171       4.521999      69.72643       6.518389      67.32692       6.278499  596.9675 28.11652 586.6934 27.55603 10.27411       39.36843 
1 1 1 9   21 6  o 204.4255 45.24033 8.588917       3.496587      11.63734       5.210783      6.091931       4.715997  236.4872 57.33205 177.6917 58.75288 58.79550       82.09059 
1 1 1 9   21 7  o 738.1040 26.20220 106.5086       7.510749      0.000000       0.000000      106.5086       7.510749  ?        ?        738.1040 26.20220 0.000000       26.20220 
1 1 1 9   21 8  o 1052.547 16.44306 215.7161       6.721284      201.4525       8.408686      240.9554       11.18541  1016.201 21.30690 1110.138 25.94460 -93.93689      33.57241 
1 1 1 9   21 9  o 264.8405 73.98196 14.86738       7.902277      5.267429       10.54291      27.17523       11.93760  209.6689 84.38831 353.2611 87.47559 -143.5923      121.5457 
1 1 1 9   21 10 f 185.0906 72.32008 4.751504       7.527788      2.774715       10.22977      7.086200       11.11733  194.4346 81.20209 222.1321 87.55582 -27.69751      119.4144 
1 1 1 9   21 11 o 212.2722 74.66907 8.570851       7.636279      7.862655       10.23065      9.461765       11.47478  220.7449 84.84302 236.0800 90.06259 -15.33504      123.7320 
1 1 1 9   21 12 o 406.5927 52.75534 33.79128       8.133836      43.83322       11.26159      22.83973       11.76059  458.4420 65.08107 320.3336 90.52601 138.1084       111.4922 
1 1 1 9   21 13 o 523.0300 59.52926 56.46919       11.87621      0.000000       0.000000      56.46919       11.87621  ?        ?        523.0300 59.52926 0.000000       59.52926 
1 1 1 9   21 14 o 647.6376 50.34553 85.17744       12.56303      0.000000       0.000000      85.17744       12.56303  ?        ?        647.6376 50.34553 0.000000       50.34553 
1 1 1 9   21 15 o 158.9255 67.10193 1.425841       7.106206      0.6869469      9.621469      2.312667       10.54071  176.6706 76.40739 190.7610 81.18642 -14.09042      111.4869 
1 1 1 9   21 16 o 255.6836 69.45733 14.34451       7.075842      8.985521       10.05258      19.60689       9.961549  221.2463 84.32223 293.6519 83.42996 -72.40555      118.6204 
1 1 1 9   21 17 o 318.5203 62.22304 21.89958       7.420865      30.12973       11.52297      16.06725       9.700219  362.0403 83.63905 265.7784 83.97620 96.26196       118.5221 
1 1 1 9   21 18 o 207.2920 70.93850 9.059916       6.870970      10.20829       10.16000      8.092057       9.327349  225.2023 85.02383 209.4122 80.86790 15.79015       117.3400 
1 1 1 9   21 19 o 135.0337 60.93629 -2.147274      6.780018      -5.254408      9.211110      1.526744       10.01619  146.4049 67.89304 178.3278 77.54063 -31.92288      103.0632 
1 1 1 9   21 20 o 158.4033 44.22099 5.302372       2.824246      6.641961       2.948452      -9.599942      9.834114  176.9254 43.27040 138.3874 65.97939 38.53799       78.90251 
1 1 1 9   22 0  o 534.1797 25.41888 55.80681       5.273169      55.40572       7.382315      56.22464       7.534797  529.1542 36.13992 532.9310 36.62836 -3.776855      51.45610 
1 1 1 9   22 1  o 333.7003 36.95739 22.20171       4.709032      22.14682       6.489029      22.26278       6.844319  329.0621 52.54546 329.0155 55.54322 0.4660034E-01  76.45963 
1 1 1 9   22 2  o 944.7150 17.94447 173.9064       6.583540      174.9498       9.147625      172.7853       9.482465  946.0206 24.89888 939.8718 25.97913 6.148804       35.98429 
1 1 1 9   22 3  o 548.1176 23.22349 58.67776       4.943439      65.38539       7.117069      52.42494       6.871551  576.2585 31.92681 515.1697 34.54605 61.08881       47.03989 
1 1 1 9   22 4  o 278.2289 40.11917 15.59060       4.209645      16.46646       5.704460      14.54327       6.237916  282.4365 53.97525 263.2249 62.03709 19.21155       82.23095 
1 1 1 9   22 5  o 543.5624 22.02549 57.67845       4.649466      57.41322       6.324785      57.99030       6.858238  540.2150 30.26936 542.3423 32.71515 -2.127319      44.57034 
1 1 1 9   22 6  o 702.5071 18.73199 96.21095       5.110492      102.2719       7.088367      89.65028       7.374793  723.1285 25.24078 676.4634 28.07227 46.66510       37.75115 
1 1 1 9   22 7  o 114.4402 46.72829 1.038642       3.286437      0.6211547E-02  4.809271      1.943132       4.501434  127.1350 54.49059 137.3645 55.19263 -10.22956      77.55933 
1 1 1 9   22 8  o 508.3620 20.46046 50.44227       4.039396      45.73153       5.565008      55.68802       5.872528  481.7372 29.89352 532.1071 28.52214 -50.36990      41.31749 
1 1 1 9   22 9  o 911.4504 19.40366 162.1111       6.868228      164.1912       7.661842      153.6019       15.49670  916.7590 21.52039 876.3387 45.69262 40.42023       50.50686 
1 1 1 9   22 10 o 569.3165 40.74398 64.70872       8.948802      81.38438       12.59268      47.69601       12.71931  633.7808 51.61065 474.9101 71.15535 158.8707       87.90189 
1 1 1 9   22 11 o 851.1285 48.49169 146.0445       15.96206      0.000000       0.000000      146.0445       15.96206  ?        ?        851.1285 48.49169 0.000000       48.49169 
1 1 1 9   22 12 o 663.5679 50.68791 89.49284       12.96343      0.000000       0.000000      89.49284       12.96343  ?        ?        663.5679 50.68791 0.000000       50.68791 
1 1 1 9   22 13 f 474.0511 66.00520 47.60992       11.82183      0.000000       0.000000      47.60992       11.82183  ?        ?        474.0511 66.00520 0.000000       66.00520 
1 1 1 9   22 14 o 314.2030 64.31039 21.27079       7.582999      23.23349       10.27058      18.91872       11.24326  320.2548 82.17277 287.6844 90.34362 32.57034       122.1243 
1 1 1 9   22 15 o 614.9383 36.33840 75.67110       8.639575      57.77729       11.47642      99.07618       13.12533  525.5748 57.14787 695.8745 48.87818 -170.2996      75.19944 
1 1 1 9   22 16 o 224.1589 72.00151 10.96406       7.108584      10.97496       9.816160      10.95203       10.30797  229.8163 84.16927 231.0782 85.96137 -1.261932      120.3072 
1 1 1 9   22 17 o 440.5098 45.56040 40.00373       7.681558      39.16509       11.41424      40.69798       10.38525  418.0329 72.96300 433.0091 63.65788 -14.97620      96.82936 
1 1 1 9   22 18 o 264.4916 67.18964 15.80882       6.915059      11.86930       9.669613      19.93243       9.892952  231.4560 83.72524 288.3030 83.52959 -56.84698      118.2671 
1 1 1 9   22 19 o 310.7104 63.10683 21.48257       7.354962      7.363383       9.948822      38.49957       10.92215  204.1850 82.04836 412.4778 70.72943 -208.2928      108.3263 
1 1 1 9   23 0  o 562.6072 72.46833 66.48826       15.46557      0.000000       0.000000      66.48826       15.46557  ?        ?        562.6072 72.46833 0.000000       72.46833 
1 1 1 9   23 1  o 461.8986 30.55174 42.10162       5.449427      36.68621       7.184192      49.43940       8.362660  427.3115 43.91664 496.7077 43.80111 -69.39615      62.02588 
1 1 1 9   23 2  o 493.8537 27.66308 47.96898       5.284161      48.42538       6.996803      47.36307       8.061692  493.8275 36.74656 486.3275 43.13199 7.500000       56.66285 
1 1 1 9   23 3  o 148.0623 55.85612 3.368114       4.382655      4.869629       5.915972      1.541728       6.524656  173.3912 64.99966 155.6283 64.91055 17.76289       91.86041 
1 1 1 9   23 4  o 413.1147 28.44900 33.64620       4.536387      36.76036       6.149230      29.92769       6.719470  429.6699 37.21937 384.7945 45.86933 44.87537       59.07010 
1 1 1 9   23 5  o 342.3055 30.71678 23.21953       4.039904      32.75255       5.976154      15.19695       5.482312  404.9625 38.46120 270.0962 54.15100 134.8663       66.41984 
1 1 1 9   23 6  o 293.4731 34.16880 17.21332       3.821367      18.99436       5.407282      15.43629       5.401181  304.8206 47.20388 272.4581 52.95353 32.36249       70.93858 
1 1 1 9   23 7  o 609.2326 27.50296 72.86398       6.507145      0.000000       0.000000      72.86398       6.507145  ?        ?        609.2326 27.50296 0.000000       27.50296 
1 1 1 9   23 8  o 400.2685 25.41709 31.53781       3.930496      28.01523       5.228553      36.11512       5.960143  374.4255 36.41824 425.5392 36.41603 -51.11371      51.50161 
1 1 1 9   23 9  o 196.5089 54.35482 8.099904       4.287776      9.348621       4.580148      -0.7546940     12.19641  210.5049 55.30702 191.0790 84.25213 19.42592       100.7834 
1 1 1 9   23 10 o 449.6212 23.89261 39.74242       4.156969      41.62564       4.434073      26.07251       11.94635  459.9356 24.91730 337.9426 89.57824 121.9930       92.97921 
1 1 1 9   23 11 f 234.8223 89.66763 10.23528       11.38108      0.000000       0.000000      10.23528       11.38108  ?        ?        234.8223 89.66763 0.000000       89.66763 
1 1 1 9   23 12 o 431.0450 50.26458 38.25462       8.256175      44.25385       11.44860      31.75391       11.91750  454.7344 66.82146 373.9784 84.09692 80.75601       107.4123 
1 1 1 9   23 13 o 176.0651 70.93204 4.074148       7.456548      6.749251       10.81815      1.653009       10.29183  211.3946 85.34196 184.0683 79.31622 27.32625       116.5089 
1 1 1 9   23 14 o 223.8062 74.31390 10.83513       7.542013      6.248058       10.54181      15.64495       10.79473  206.0490 83.86146 261.9056 88.91920 -55.85655      122.2267 
1 1 1 9   23 15 o 248.4108 73.74332 13.98044       7.629637      12.64950       10.40101      15.53090       11.22603  240.1169 86.83770 259.2148 90.57052 -19.09795      125.4743 
1 1 1 9   23 16 o 332.5850 59.92811 24.06889       7.455646      32.68001       10.92404      16.56021       10.20082  376.4910 77.30245 263.9463 86.36773 112.5447       115.9097 
1 1 1 9   23 17 o 186.1274 70.32348 6.589218       6.953716      6.930700       9.989334      6.268176       9.685769  202.3660 81.89863 197.4428 80.37448 4.923248       114.7495 
1 1 1 9   23 18 o 184.0253 69.46588 6.503747       6.781230      9.629746       9.754963      3.580481       9.433338  215.5002 82.84241 181.6149 77.03133 33.88528       113.1225 
1 1 1 9   24 0  o 141.7212 62.06144 -0.7553564     6.516259      -0.7553564     6.516259      0.000000       0.000000  141.7212 62.06144 ?        ?        0.000000       62.06144 
1 1 1 9   24 1  o 779.4070 22.35481 118.9012       6.766488      125.7341       8.824517      109.1513       10.54123  799.5367 28.42003 741.8430 36.58907 57.69373       46.32988 
1 1 1 9   24 2  o 533.3185 26.26801 55.83823       5.440538      63.01962       7.269653      46.69501       8.202740  563.7687 33.35192 481.0146 44.41243 82.75409       55.54111 
1 1 1 9   24 3  o 425.9173 28.39397 35.83341       4.669638      19.75856       6.460008      53.42437       6.757784  307.1164 56.23531 518.7680 33.72627 -211.6516      65.57340 
1 1 1 9   24 4  o 172.9559 54.68674 6.060372       4.113139      7.907143       5.798042      4.189435       5.835856  197.5334 65.13722 166.3203 64.03928 31.21318       91.34489 
1 1 1 9   24 5  o 229.9017 46.81281 10.98784       4.037570      13.61718       5.737102      8.407632       5.683251  252.8104 59.43562 201.7243 64.33596 51.08606       87.58829 
1 1 1 9   24 6  o 276.2937 52.35818 15.96190       5.412387      15.96190       5.412387      0.000000       0.000000  276.2937 52.35818 ?        ?        0.000000       52.35818 
1 1 1 9   24 7  o 368.4924 28.39787 26.89409       4.032567      22.27924       5.476462      32.35984       5.959994  330.6136 43.72609 401.2264 38.73112 -70.61279      58.41293 
1 1 1 9   24 8  o 154.5105 53.62061 4.503040       3.931538      7.486467       5.201693      0.5278403      6.004356  190.8488 61.62215 142.6747 61.01114 48.17415       86.71590 
1 1 1 9   24 9  o 577.6700 25.82491 65.63049       5.793575      69.07245       6.455638      51.38457       13.13354  591.9391 28.08239 487.3416 71.52181 104.5976       76.83743 
1 1 1 9   24 10 o 719.7934 16.10610 101.1332       4.502214      99.93464       4.749510      111.7522       14.13694  715.2776 17.09803 739.0306 49.54342 -23.75299      52.41082 
1 1 1 9   24 11 o 129.8892 60.71158 -5.984587      7.597944      -1.041180      10.32967      -11.81178      11.21509  172.8156 76.79922 147.0496 70.20618 25.76605       104.0530 
1 1 1 9   24 12 o 489.5092 42.93470 48.83242       8.079565      39.02538       10.97108      60.45436       11.94317  421.6591 69.41370 534.8093 58.45515 -113.1502      90.74837 
1 1 1 9   24 13 o 172.8118 70.51804 3.823029       7.478613      4.358172       10.69800      3.311551       10.45877  196.0401 82.52821 189.8619 80.83860 6.178223       115.5240 
1 1 1 9   24 14 o 352.3967 59.89712 26.96339       7.903831      21.95482       11.32539      31.71898       11.03565  299.1321 90.08427 369.1118 79.34650 -69.97961      120.0460 
1 1 1 9   24 15 o 421.5721 49.07709 37.29920       7.884489      37.51784       11.10450      37.07692       11.19677  405.4858 73.21134 402.0488 74.45300 3.437012       104.4181 
1 1 1 9   24 16 o 232.1469 71.52895 12.40724       7.085839      32.52528       10.48114      -4.528081      9.616393  374.4262 74.69843 150.6690 69.69372 223.7572       102.1620 
1 1 1 9   25 0  o 267.4107 48.97549 14.94104       4.898674      23.29580       6.809621      5.980201       7.052294  333.0589 54.53501 186.3864 70.72429 146.6725       89.30841 
1 1 1 9   25 1  o 403.0552 40.95591 32.88799       6.321700      30.07439       6.928449      46.87419       15.44738  382.5136 47.67512 450.2561 91.46254 -67.74249      103.1422 
1 1 1 9   25 2  o 99.86276 46.62478 -3.879961      4.461385      -5.337315      6.198105      -2.313072      6.426811  116.8691 54.69224 132.2031 59.52391 -15.33402      80.83524 
1 1 1 9   25 3  o 413.4665 29.62913 33.93380       4.726051      36.70648       6.652535      31.10864       6.715198  426.1269 40.69415 390.2102 45.14685 35.91672       60.78036 
1 1 1 9   25 4  o 329.6230 35.08368 21.83816       4.422049      19.17814       6.161715      24.66321       6.349975  301.5405 54.62865 345.4433 48.68349 -43.90277      73.17357 
1 1 1 9   25 5  o 229.8792 63.40571 11.46174       5.844220      11.46174       5.844220      0.000000       0.000000  229.8792 63.40571 ?        ?        0.000000       63.40571 
1 1 1 9   25 6  o 498.7537 24.83861 48.92113       4.811067      54.91724       7.199378      44.08271       6.467126  523.8478 35.59973 469.0244 35.77469 54.82346       50.46949 
1 1 1 9   25 7  o 420.3219 27.45558 34.99930       4.457056      36.48010       6.448883      33.64512       6.167017  424.7389 39.55085 407.8210 39.43041 16.91797       55.84825 
1 1 1 9   25 8  o 526.0195 24.26226 54.43239       4.956340      49.52871       6.667336      60.48932       7.409985  497.2898 34.74179 549.7178 34.89038 -52.42804      49.23750 
1 1 1 9   25 9  o 253.6942 45.13862 13.42655       4.284211      10.63075       4.573730      33.43614       12.23592  222.5052 53.57220 378.5072 85.28520 -156.0019      100.7152 
1 1 1 9   25 10 o 184.4585 39.83570 7.107635       2.770161      7.269064       2.849006      4.311593       11.85698  186.4088 40.51190 202.5071 86.14407 -16.09837      95.19462 
1 1 1 9   25 11 o 447.0367 23.50649 39.47177       4.066597      38.51174       4.311158      47.22050       12.24807  440.9701 25.27976 460.5388 70.74412 -19.56879      75.12521 
1 1 1 9   25 12 o 375.7581 54.87793 30.17401       7.772032      24.49452       11.07024      35.69436       10.91405  316.7662 87.22241 395.7646 73.72287 -78.99841      114.2051 
1 1 1 9   25 13 o 280.4813 69.12463 18.02592       7.481039      24.83515       10.75186      11.63579       10.41572  318.7806 85.21092 229.7073 86.22014 89.07332       121.2222 
1 1 1 9   25 14 o 162.5719 67.66912 3.007813       7.070559      7.700397       9.944535      -1.789544      10.05494  204.7737 82.12032 163.1853 73.87169 41.58838       110.4571 
1 1 1 9   25 15 o 153.8681 66.16573 1.428980       7.132757      9.773113       10.23634      -6.446116      9.944477  216.3645 84.39029 146.7306 68.86072 69.63391       108.9198 
1 1 1 9   26 0  o 250.0049 53.60820 13.40473       5.048635      10.62009       7.035256      16.36135       7.249248  220.3273 71.70761 270.1124 68.89019 -49.78511      99.43761 
1 1 1 9   26 1  o 249.8979 63.16338 13.76446       6.132919      12.49067       6.739306      19.90246       14.79382  236.8147 69.03748 286.5116 103.5724 -49.69690      124.4725 
1 1 1 9   26 2  o 285.4712 56.46427 17.50838       6.038114      18.08953       6.634776      14.70624       14.56885  288.0683 61.19511 260.3051 100.9139 27.76318       118.0189 
1 1 1 9   26 3  o 353.6102 34.19493 25.17260       4.637230      33.72252       6.653104      17.09449       6.466925  405.9253 42.85131 279.8151 61.21378 126.1102       74.72190 
1 1 1 9   26 4  o 554.3881 23.82393 60.50253       5.129267      55.56532       7.107251      65.86927       7.409972  526.1143 34.98455 573.8110 33.39658 -47.69672      48.36580 
1 1 1 9   26 5  o 189.1095 56.68672 7.645234       4.492214      6.800343       6.485297      8.424511       6.228388  187.4181 68.44879 199.9267 67.54420 -12.50861      96.16370 
1 1 1 9   26 6  o 272.6960 42.92997 15.42387       4.396087      14.75306       6.353908      16.03983       6.088589  257.9373 63.78725 271.0558 59.47399 -13.11850      87.21220 
1 1 1 9   26 7  o 423.2667 26.78960 35.57552       4.380889      37.17060       5.793006      33.44469       6.695566  429.3700 35.04683 403.1729 43.44941 26.19717       55.82232 
1 1 1 9   26 8  o 494.5409 24.01717 48.23838       4.612666      47.30885       5.807336      49.82711       7.592259  486.3866 30.90489 494.5446 39.86971 -8.158020      50.44508 
1 1 1 9   26 9  o 600.2008 23.61451 71.06631       5.504318      71.15501       6.074883      70.65951       13.00917  599.5372 26.09118 572.9453 59.32628 26.59186       64.81017 
1 1 1 9   26 10 o 233.3010 33.66156 11.12617       2.961615      11.66230       3.068866      3.855485       11.30137  238.8214 34.05284 193.7899 83.30782 45.03151       89.99883 
1 1 1 9   26 11 o 153.4796 43.35914 4.984893       2.698465      5.032848       2.788250      4.276042       10.71988  154.2058 44.24876 191.6179 81.71998 -37.41209      92.93066 
1 1 1 9   26 12 o 177.1684 70.24001 5.329078       7.193592      7.062281       10.13646      3.570467       10.21049  201.3000 82.11543 184.9663 79.34052 16.33368       114.1834 
1 1 1 9   26 13 o 145.8005 64.45800 -0.2072183     7.185270      -4.116905      10.25264      3.566480       10.07276  155.7859 72.02605 183.6144 78.78328 -27.82849      106.7453 
1 1 1 9   27 0  f 355.7896 38.74332 25.94628       5.266722      22.61165       7.269197      29.63099       7.641263  320.1494 60.68738 371.4754 54.59597 -51.32599      81.63136 
1 1 1 9   27 1  o 234.5449 53.80560 11.99269       4.796804      4.979964       6.774939      19.04182       6.792506  173.5871 68.37256 292.7688 61.68804 -119.1817      92.08811 
1 1 1 9   27 2  o 158.1775 65.59866 2.763546       6.609714      1.942512       7.464370      5.745596       14.22558  160.2415 68.26145 215.1237 92.97268 -54.88220      115.3410 
1 1 1 9   27 3  o 208.3826 57.51472 9.569672       4.806840      5.132775       7.286695      12.98804       6.395884  177.6507 70.61025 239.1190 66.47343 -61.46829      96.97692 
1 1 1 9   27 4  o 131.0850 54.56448 1.465669       4.597375      3.642902       6.979108      -0.2033263     6.110476  166.1688 68.00074 136.6450 59.96166 29.52379       90.66147 
1 1 1 9   27 5  o 356.3654 35.80914 25.85025       4.888780      31.91160       7.232107      20.74986       6.634095  389.0175 48.95462 307.9518 57.58881 81.06570       75.58456 
1 1 1 9   27 6  o 140.5353 53.71294 3.252145       4.086183      4.154228       5.481925      2.124296       6.129645  158.7240 61.79906 149.7795 62.73067 8.944458       88.05829 
1 1 1 9   27 7  o 224.6426 48.94679 10.89330       4.149441      7.636085       5.409021      15.55143       6.468465  188.0406 62.94763 261.6380 64.15295 -73.59732      89.87772 
1 1 1 9   27 8  o 172.8839 53.61826 6.433957       3.974184      6.949501       5.053873      5.598607       6.433181  180.4057 60.84378 174.7085 67.24587 5.697205       90.68612 
1 1 1 9   27 9  f 119.1550 49.31577 1.273963       3.724816      -2.327919      4.678803      7.507439       6.155101  108.4468 49.59510 188.1009 66.94347 -79.65408      83.31328 
1 1 1 9   27 10 o 407.7731 21.43106 32.88660       3.381929      29.75104       3.541318      65.38609       11.40108  387.0089 23.67607 551.3523 53.93704 -164.3434      58.90467 
1 1 1 9   27 11 o 222.9445 35.26814 10.28417       2.951975      11.38722       3.100268      -0.4257061     9.660362  234.9058 35.05740 163.5758 73.36848 71.33002       81.31393 
1 1 1 9   28 0  f 123.8387 54.85490 -0.5573236     5.228443      -0.5206230     8.415054      -0.5803998     6.672704  153.2630 68.62832 138.2965 61.57705 14.96645       92.20401 
1 1 1 9   28 1  o 318.7208 43.69499 21.40548       5.266045      27.32087       8.322192      17.45532       6.800699  346.3771 64.23236 274.9114 64.76427 71.46573       91.21517 
1 1 1 9   28 2  o 218.3263 69.86593 11.11985       6.697927      8.556959       7.666423      19.38457       13.76706  199.1234 74.12157 267.2715 99.35928 -68.14812      123.9608 
1 1 1 9   28 3  o 191.5807 68.56933 7.959641       6.466422      8.840485       7.446591      5.258767       13.03948  200.6448 73.33633 202.5859 88.27668 -1.941071      114.7649 
1 1 1 9   28 4  o 410.1284 30.56000 33.93869       4.832515      35.34689       6.773773      32.47909       6.896291  411.2107 43.05516 391.9684 46.19088 19.24228       63.14542 
1 1 1 9   28 5  o 259.7396 45.03757 14.38315       4.378318      20.65961       6.127047      7.833831       6.258810  307.4908 53.23652 189.9362 67.51486 117.5546       85.97897 
1 1 1 9   28 6  o 223.8575 49.93000 10.96730       4.230273      17.58212       5.791508      3.401735       6.193747  282.1264 54.83444 156.6602 64.07938 125.4662       84.33851 
1 1 1 9   28 7  o 123.0147 51.26976 1.330308       4.066224      -4.287463      5.240571      9.828959       6.445722  106.3829 49.94568 206.8271 68.70206 -100.4442      84.93847 
1 1 1 9   28 8  o 152.2351 54.27350 4.610875       4.047385      4.796134       5.200899      4.326399       6.444824  160.2757 60.75491 164.2664 66.02690 -3.990723      89.72575 
1 1 1 9   29 0  o 308.6201 59.76451 21.80785       6.904208      0.000000       0.000000      21.80785       6.904208  ?        ?        308.6201 59.76451 0.000000       59.76451 
1 1 1 9   29 1  o 159.8572 59.84420 5.048030       5.011386      8.126729       7.991737      3.052915       6.433414  193.6298 74.83169 154.2206 64.40041 39.40924       98.72787 
1 1 1 9   29 2  o 148.9194 56.74857 4.067759       4.552647      7.347897       6.727153      1.295985       6.183924  184.9950 69.32006 142.2476 61.38813 42.74741       92.59467 
1 1 1 9   29 3  o 359.8456 44.41652 27.50893       6.075373      30.26603       6.800341      16.60690       13.52255  375.2302 47.74810 246.9184 96.80409 128.3118       107.9394 
1 1 1 10  0  0  o 199.2585 72.14827 10.42681       5.124660      10.42681       5.124660      10.42681       5.124660  199.2585 72.14827 199.2585 72.14827 0.000000       0.000000 
1 1 1 10  0  1  o 745.2386 28.04367 108.7885       8.090216      108.7885       8.090216      108.7885       8.090216  745.2386 28.04367 745.2386 28.04367 0.000000       0.000000 
1 1 1 10  0  2  o 130.0943 69.54641 4.870701       4.799331      4.870701       4.799331      4.870701       4.799331  130.0943 69.54641 130.0943 69.54641 0.000000       0.000000 
1 1 1 10  0  3  o 419.8987 37.24469 35.32443       5.963566      35.32443       5.963566      35.32443       5.963566  419.8987 37.24469 419.8987 37.24469 0.000000       0.000000 
1 1 1 10  0  4  o 605.3292 40.03842 72.80648       9.317834      72.80648       9.317834      72.80648       9.317834  605.3292 40.03842 605.3292 40.03842 0.000000       0.000000 
1 1 1 10  0  5  f 321.7764 74.13320 23.58963       8.063992      23.58963       8.063992      23.58963       8.063992  321.7764 74.13320 321.7764 74.13320 0.000000       0.000000 
1 1 1 10  0  6  o 321.1977 69.26779 23.11129       7.580570      23.11129       7.580570      23.11129       7.580570  321.1977 69.26779 321.1977 69.26779 0.000000       0.000000 
1 1 1 10  0  7  o 502.6240 42.01886 50.63675       8.070041      50.63675       8.070041      50.63675       8.070041  502.6240 42.01886 502.6240 42.01886 0.000000       0.000000 
1 1 1 10  0  8  o 224.9394 89.73096 14.06424       7.587991      14.06424       7.587991      14.06424       7.587991  224.9394 89.73096 224.9394 89.73096 0.000000       0.000000 
1 1 1 10  0  9  o 648.3615 26.38808 82.37578       6.619345      82.37578       6.619345      82.37578       6.619345  648.3615 26.38808 648.3615 26.38808 0.000000       0.000000 
1 1 1 10  0  10 o 357.4590 40.07632 25.94222       5.383896      25.94222       5.383896      25.94222       5.383896  357.4590 40.07632 357.4590 40.07632 0.000000       0.000000 
1 1 1 10  0  11 o 422.6710 34.04940 35.55824       5.505636      35.55824       5.505636      35.55824       5.505636  422.6710 34.04940 422.6710 34.04940 0.000000       0.000000 
1 1 1 10  0  12 o 170.2340 72.85062 8.147290       4.919114      8.147290       4.919114      8.147290       4.919114  170.2340 72.85062 170.2340 72.85062 0.000000       0.000000 
1 1 1 10  0  13 o 84.52748 56.02512 -1.184426      4.846646      -1.184426      4.846646      -1.184426      4.846646  84.52748 56.02512 84.52748 56.02512 0.000000       0.000000 
1 1 1 10  0  14 o 417.5691 53.01128 35.79934       8.218992      35.79934       8.218992      35.79934       8.218992  417.5691 53.01128 417.5691 53.01128 0.000000       0.000000 
1 1 1 10  0  15 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 10  0  16 o 595.9518 28.33859 69.64036       6.524895      69.64036       6.524895      69.64036       6.524895  595.9518 28.33859 595.9518 28.33859 0.000000       0.000000 
1 1 1 10  0  17 o 98.15385 63.02956 0.2572879      5.472488      0.2572879      5.472488      0.2572879      5.472488  98.15385 63.02956 98.15385 63.02956 0.000000       0.000000 
1 1 1 10  0  18 o 309.2184 54.72326 20.44442       5.957448      20.44442       5.957448      20.44442       5.957448  309.2184 54.72326 309.2184 54.72326 0.000000       0.000000 
1 1 1 10  0  19 o 726.1413 26.84890 103.2113       7.547900      103.2113       7.547900      103.2113       7.547900  726.1413 26.84890 726.1413 26.84890 0.000000       0.000000 
1 1 1 10  0  20 o 899.5601 34.55271 158.9521       12.03048      158.9521       12.03048      158.9521       12.03048  899.5601 34.55271 899.5601 34.55271 0.000000       0.000000 
1 1 1 10  0  21 o 1544.764 24.94931 465.6550       14.95868      465.6550       14.95868      465.6550       14.95868  1544.764 24.94931 1544.764 24.94931 0.000000       0.000000 
1 1 1 10  0  22 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 10  0  23 o 477.7050 38.00547 45.75052       6.948069      45.75052       6.948069      45.75052       6.948069  477.7050 38.00547 477.7050 38.00547 0.000000       0.000000 
1 1 1 10  0  24 o 582.6982 32.81075 67.40376       7.371014      67.40376       7.371014      67.40376       7.371014  582.6982 32.81075 582.6982 32.81075 0.000000       0.000000 
1 1 1 10  0  25 o 124.4281 73.92566 3.978280       6.231267      3.978280       6.231267      3.978280       6.231267  124.4281 73.92566 124.4281 73.92566 0.000000       0.000000 
1 1 1 10  0  26 o 130.8584 75.64189 5.003523       6.230697      5.003523       6.230697      5.003523       6.230697  130.8584 75.64189 130.8584 75.64189 0.000000       0.000000 
1 1 1 10  0  27 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 10  0  28 o 426.3877 45.43279 38.48389       7.308203      38.48389       7.308203      38.48389       7.308203  426.3877 45.43279 426.3877 45.43279 0.000000       0.000000 
1 1 1 10  0  29 o 683.8481 31.92356 94.53612       8.436016      94.53612       8.436016      94.53612       8.436016  683.8481 31.92356 683.8481 31.92356 0.000000       0.000000 
1 1 1 10  1  0  o 490.7723 19.35420 46.99915       3.688784      50.79720       6.250073      44.96898       4.569522  507.1302 31.89746 478.7054 24.66340 28.42474       40.32035 
1 1 1 10  1  1  o 586.5349 17.50862 67.06998       3.988171      61.54744       6.680651      70.12783       4.971164  558.6848 30.91119 599.1705 21.36386 -40.48572      37.57547 
1 1 1 10  1  2  o 263.0912 28.81106 13.74374       2.895574      10.24952       4.786505      15.76056       3.636437  221.0767 55.75830 280.8040 34.04182 -59.72733      65.32866 
1 1 1 10  1  3  o 598.7350 18.48308 69.92409       4.297709      66.54311       5.430079      75.59318       7.031400  583.1852 23.97572 620.4521 29.18136 -37.26697      37.76754 
1 1 1 10  1  4  o 280.4781 36.65981 15.79580       3.897619      14.88341       8.107784      16.07003       4.444916  263.2632 75.42917 281.5615 41.92936 -18.29834      86.29966 
1 1 1 10  1  5  o 133.5410 50.54593 2.661813       3.596523      1.065436       7.779638      3.095729       4.055967  164.7731 69.92485 142.3957 53.73027 22.37733       88.18405 
1 1 1 10  1  6  o 689.4606 19.09114 92.73599       5.111744      97.08842       9.596973      91.01211       6.039816  700.6342 35.38528 682.3454 22.79247 18.28882       42.09056 
1 1 1 10  1  7  o 465.3809 26.45414 42.54958       4.761384      44.96756       8.248794      41.34140       5.830832  473.2543 45.44021 457.2129 33.06147 16.04141       56.19496 
1 1 1 10  1  8  o 124.3381 51.22495 1.073513       3.993579      -0.2475014     6.773264      1.777473       4.944454  148.5335 64.17352 141.1171 57.43372 7.416412       86.12127 
1 1 1 10  1  9  o 369.8868 30.76308 27.00693       4.378940      14.50121       7.366893      33.83958       5.445333  262.0244 70.74281 413.5900 34.20918 -151.5656      78.57998 
1 1 1 10  1  10 o 558.0811 22.27745 60.75338       4.828262      67.07689       8.616190      57.85874       5.829532  582.6199 38.29374 543.2546 27.72363 39.36530       47.27589 
1 1 1 10  1  11 o 862.7504 16.19780 144.8372       5.427118      155.3792       7.979389      135.7628       7.403170  892.6428 23.01781 834.4213 22.84569 58.22156       32.43062 
1 1 1 10  1  12 o 373.2353 25.91326 27.30575       3.732787      20.40973       5.269455      34.25175       5.288511  319.2492 43.64508 417.1473 32.91230 -97.89813      54.66363 
1 1 1 10  1  13 o 307.7104 43.56017 18.95641       5.060042      0.000000       0.000000      18.95641       5.060042  ?        ?        307.7104 43.56017 0.000000       43.56017 
1 1 1 10  1  14 o 1063.313 18.33910 219.9492       7.572988      213.1843       13.06162      223.3747       9.294671  1044.830 32.19018 1071.083 22.34513 -26.25269      39.18562 
1 1 1 10  1  15 o 600.4570 19.71424 70.14809       4.597164      68.43404       6.487510      71.87688       6.515322  592.4674 28.19588 607.2362 27.62805 -14.76880      39.47552 
1 1 1 10  1  16 f 1019.690 22.83801 202.4270       9.043874      202.4270       9.043874      0.000000       0.000000  1019.690 22.83801 ?        ?        0.000000       22.83801 
1 1 1 10  1  17 o 832.1749 20.50722 134.7713       6.627494      130.9574       7.954441      143.4290       11.98463  819.8726 24.98247 856.4962 36.03058 -36.62360      43.84434 
1 1 1 10  1  18 o 575.6130 21.43032 64.51125       4.790572      64.24841       6.731509      64.78097       6.819124  572.8682 30.36568 575.2012 30.63719 -2.332947      43.13596 
1 1 1 10  1  19 o 264.3207 47.86145 14.17228       4.732098      15.77600       5.907763      11.30140       7.904368  277.3690 56.75736 238.3392 75.85846 39.02982       94.74124 
1 1 1 10  1  20 o 921.8179 17.63768 165.3449       6.314145      174.7725       9.082245      156.5258       8.784305  946.7891 24.70086 895.9220 25.24697 50.86707       35.32055 
1 1 1 10  1  21 o 1156.431 24.43059 260.7780       10.97189      260.7780       10.97189      0.000000       0.000000  1156.431 24.43059 ?        ?        0.000000       24.43059 
1 1 1 10  1  22 o 945.1793 20.39049 174.0434       7.484622      171.3597       12.43672      175.5674       9.371776  935.0665 34.24801 948.4395 25.44393 -13.37305      42.66521 
1 1 1 10  1  23 o 1071.135 17.68464 223.4414       7.356458      219.8401       10.19054      227.3604       10.63062  1060.981 24.73212 1078.813 25.37373 -17.83203      35.43309 
1 1 1 10  1  24 o 1155.599 17.53857 260.2014       7.870988      247.9729       10.79914      274.0591       11.49603  1126.216 24.69105 1183.870 25.00438 -57.65381      35.14067 
1 1 1 10  1  25 o 730.6262 20.36362 104.2247       5.778009      105.5642       8.222011      102.9178       8.121593  733.2827 28.87211 724.0298 28.88396 9.252869       40.83971 
1 1 1 10  1  26 o 328.8391 38.10849 21.74048       4.776481      24.63332       6.737966      18.81827       6.772092  345.6628 51.78820 298.1599 60.55191 47.50299       79.67780 
1 1 1 10  1  27 o 345.4283 37.13831 24.01785       4.903794      23.74108       6.937922      24.29416       6.932107  336.6416 54.96526 340.9649 54.16247 -4.323242      77.16705 
1 1 1 10  1  28 o 420.0872 31.69437 35.21522       5.132628      28.72365       7.090293      42.36211       7.439563  371.4598 50.45580 456.3003 42.47020 -84.84045      65.95078 
1 1 1 10  1  29 o 297.8098 49.83786 18.68234       5.560354      20.37439       6.818277      15.32271       9.607574  306.6206 59.40473 257.3283 83.80005 49.29227       102.7199 
1 1 1 10  2  0  o 420.6359 18.01272 34.50615       2.942480      33.29230       4.036639      35.88243       4.298262  411.5321 25.38124 427.1653 26.03435 -15.63312      36.35925 
1 1 1 10  2  1  o 804.7570 14.14454 126.0917       4.420605      119.8793       6.034422      133.2868       6.494229  783.6750 19.82767 826.2471 20.23903 -42.57202      28.33293 
1 1 1 10  2  2  o 300.7537 23.21120 17.79300       2.690071      12.30347       3.703528      23.92374       3.913849  246.1155 40.13108 347.8409 29.24452 -101.7254      49.65628 
1 1 1 10  2  3  o 216.1569 33.41292 9.413559       2.714400      9.674914       3.280083      8.845682       4.834997  217.5975 40.29942 205.8434 57.99944 11.75414       70.62563 
1 1 1 10  2  4  o 868.1187 16.92907 146.8984       5.707425      146.8984       5.707425      0.000000       0.000000  868.1187 16.92907 ?        ?        0.000000       16.92907 
1 1 1 10  2  5  o 647.2023 16.51262 81.62832       4.150342      85.50056       6.001085      78.07808       5.746152  661.1851 23.37108 631.8251 23.41813 29.35999       33.08498 
1 1 1 10  2  6  o 504.5560 20.08239 49.68880       3.935073      37.40456       8.124419      53.45393       4.497876  429.5925 49.60984 523.0326 22.14373 -93.44009      54.32753 
1 1 1 10  2  7  o 695.7452 16.78168 94.31660       4.534335      98.56053       9.865391      93.17994       5.105569  705.9750 36.10374 691.2035 19.01999 14.77148       40.80735 
1 1 1 10  2  8  o 321.2570 30.43472 20.42527       3.751798      18.30480       5.436160      22.35394       5.184471  299.6020 48.36946 333.8200 40.84309 -34.21805      63.30689 
1 1 1 10  2  9  o 978.9416 15.93346 186.5670       6.057519      191.9318       8.845415      181.8290       8.312638  991.5367 22.97108 965.2638 22.17507 26.27289       31.92811 
1 1 1 10  2  10 o 850.0296 18.61844 140.7424       6.146180      147.4554       11.04334      137.7300       7.397786  867.2228 32.79002 840.2502 22.67071 26.97266       39.86410 
1 1 1 10  2  11 o 924.7109 22.30868 166.6892       8.011389      0.000000       0.000000      166.6892       8.011389  ?        ?        924.7109 22.30868 0.000000       22.30868 
1 1 1 10  2  12 o 570.2314 26.66147 63.44850       5.904229      0.000000       0.000000      63.44850       5.904229  ?        ?        570.2314 26.66147 0.000000       26.66147 
1 1 1 10  2  13 o 448.7312 26.61815 39.40483       4.617930      29.92889       7.981087      44.17390       5.661969  385.4306 54.86871 474.5932 30.88801 -89.16260      62.96542 
1 1 1 10  2  14 o 534.9536 20.51517 55.69590       4.262056      54.20203       5.974730      57.24368       6.081605  526.2944 29.34904 540.9453 29.05562 -14.65088      41.29885 
1 1 1 10  2  15 o 941.0126 22.90848 172.4013       8.371818      0.000000       0.000000      172.4013       8.371818  ?        ?        941.0126 22.90848 0.000000       22.90848 
1 1 1 10  2  16 o 1244.449 16.06814 301.1039       7.765521      300.6219       10.96639      301.5887       10.99789  1242.646 22.72418 1244.639 22.75297 -1.992676      32.15721 
1 1 1 10  2  17 o 575.0361 42.92530 65.19374       9.516877      0.000000       0.000000      65.19374       9.516877  ?        ?        575.0361 42.92530 0.000000       42.92530 
1 1 1 10  2  18 o 841.5089 24.42577 137.9933       7.982426      137.9933       7.982426      0.000000       0.000000  841.5089 24.42577 ?        ?        0.000000       24.42577 
1 1 1 10  2  19 o 1109.951 16.73067 239.6554       7.211826      248.2679       10.36510      231.5735       10.04076  1128.707 23.64635 1090.086 23.71799 38.62134       33.49169 
1 1 1 10  2  20 o 279.8605 40.42369 15.68153       4.266105      16.54690       5.979388      14.78431       6.088457  284.2082 56.16552 267.6359 60.05424 16.57236       82.22578 
1 1 1 10  2  21 o 937.7745 17.94501 171.1565       6.535370      173.7678       9.242869      168.5457       9.241949  943.8455 25.21610 929.4902 25.60300 14.35535       35.93557 
1 1 1 10  2  22 o 826.7715 19.04331 133.1170       6.114430      133.3811       8.509712      132.8352       8.791385  826.4645 26.51323 824.6044 27.45261 1.860107       38.16539 
1 1 1 10  2  23 o 191.6687 60.59611 7.321229       5.050204      10.26896       7.933834      5.313263       6.548131  228.2419 76.23709 182.7340 68.40743 45.50789       102.4289 
1 1 1 10  2  24 o 676.4904 21.33126 89.32269       5.604105      78.97720       7.577839      101.8108       8.325638  634.3497 30.76016 720.4824 29.75542 -86.13263      42.79688 
1 1 1 10  2  25 o 582.9553 23.77285 66.48833       5.382010      66.51292       7.397555      66.46068       7.844739  580.1594 32.96927 579.2838 35.03540 0.8756104      48.10876 
1 1 1 10  2  26 o 229.5372 53.59262 11.09423       4.690596      4.834179       6.447526      18.13253       6.836563  175.8856 67.41221 291.8733 62.21510 -115.9877      91.73399 
1 1 1 10  2  27 o 383.1223 33.86605 29.33277       4.986942      28.52709       6.930108      30.19804       7.181827  372.0910 49.16205 382.8584 49.45871 -10.76736      69.73573 
1 1 1 10  2  28 o 514.9689 31.57018 52.82766       6.283259      44.29350       7.568900      71.74646       11.26936  466.6997 42.21770 590.0379 49.64159 -123.3382      65.16611 
1 1 1 10  2  29 o 346.1968 43.67072 24.70576       5.740765      26.15004       6.937728      21.56928       10.22381  352.0769 52.33193 301.8705 84.08820 50.20645       99.04269 
1 1 1 10  3  0  o 436.3911 17.88007 37.14213       3.030213      38.44366       4.149945      35.65567       4.434977  442.5090 24.24083 425.5476 26.97535 16.96136       36.26689 
1 1 1 10  3  1  o 452.0446 17.27180 39.84086       3.032123      36.65617       4.206987      43.28347       4.374029  431.8977 25.19134 469.6727 24.06129 -37.77496      34.83603 
1 1 1 10  3  2  o 908.1218 14.40071 160.5878       5.078741      154.2744       5.836392      180.2793       10.30745  889.6201 16.89320 958.5515 27.68904 -68.93140      32.43552 
1 1 1 10  3  3  o 596.9984 15.95636 69.44562       3.699431      67.69693       4.344024      74.06150       7.057699  589.0112 18.99069 613.9402 29.60118 -24.92908      35.16925 
1 1 1 10  3  4  o 174.9782 39.68821 6.304352       2.634950      6.043074       3.234434      6.819909       4.543447  171.1588 47.15359 183.4749 57.40023 -12.31615      74.28491 
1 1 1 10  3  5  o 884.8976 15.63895 152.5413       5.374382      167.3155       12.08075      148.8959       6.000910  921.3351 33.76357 873.8676 17.68249 47.46747       38.11364 
1 1 1 10  3  6  o 463.6308 21.25565 41.97954       3.827144      39.81910       8.759145      42.48931       4.254769  442.5846 51.94888 465.5404 23.61100 -22.95584      57.06282 
1 1 1 10  3  7  o 156.1974 47.19635 4.911830       3.104849      -2.185322      7.437968      6.409472       3.416774  145.9277 64.99078 176.3862 48.41135 -30.45842      81.03987 
1 1 1 10  3  8  o 123.1002 49.46297 1.499177       3.615478      -3.779590      5.293059      6.116326       4.950254  113.2003 52.12868 178.7526 60.21715 -65.55234      79.64612 
1 1 1 10  3  9  o 619.1051 21.74785 74.77679       5.228881      84.50618       9.868098      70.97866       6.165593  653.6398 39.05331 602.5168 26.34982 51.12292       47.11129 
1 1 1 10  3  10 o 1150.327 21.84496 258.0194       9.758888      0.000000       0.000000      258.0194       9.758888  ?        ?        1150.327 21.84496 0.000000       21.84496 
1 1 1 10  3  11 o 696.1169 20.47345 94.39645       5.534791      78.30344       9.712553      102.1358       6.735435  629.9741 39.90543 723.6620 23.96635 -93.68793      46.54921 
1 1 1 10  3  12 o 917.7430 18.59622 163.9277       6.627865      163.2359       11.74150      164.2512       8.029441  913.5031 33.09677 918.1499 22.51872 -4.646851      40.03110 
1 1 1 10  3  13 o 926.7005 18.68190 167.1029       6.723391      170.9679       12.21551      165.4232       8.052905  935.1715 33.63508 921.5981 22.50003 13.57343       40.46690 
1 1 1 10  3  14 o 1199.967 15.91045 279.9786       7.414461      285.1660       10.69475      275.1779       10.28832  1210.176 22.75590 1188.861 22.28361 21.31494       31.84949 
1 1 1 10  3  15 o 1035.904 16.06654 208.6427       6.463535      211.6936       9.172680      205.6339       9.109288  1042.780 22.65038 1027.727 22.82332 15.05359       32.15499 
1 1 1 10  3  16 o 550.8040 23.89181 59.08132       5.110625      57.63140       6.119740      62.42294       9.290514  542.8500 29.13500 562.7848 42.82935 -19.93475      51.79963 
1 1 1 10  3  17 o 969.0629 16.53133 182.6223       6.221395      185.3347       8.822538      179.9394       8.774420  975.5129 23.28802 961.1819 23.50633 14.33099       33.08896 
1 1 1 10  3  18 o 482.9511 27.60279 45.64597       5.155588      50.22435       6.258253      35.97670       9.094810  506.0147 32.01149 422.7598 56.83496 83.25491       65.22997 
1 1 1 10  3  19 o 1446.403 23.64561 407.7119       13.28214      407.7119       13.28214      0.000000       0.000000  1446.403 23.64561 ?        ?        0.000000       23.64561 
1 1 1 10  3  20 o 785.6580 26.03683 120.4077       7.944189      120.4077       7.944189      0.000000       0.000000  785.6580 26.03683 ?        ?        0.000000       26.03683 
1 1 1 10  3  21 o 253.6895 45.64330 13.05641       4.331491      14.75595       6.075459      11.29953       6.177111  267.1469 60.02389 234.1511 65.40998 32.99576       88.77687 
1 1 1 10  3  22 o 233.7204 68.87518 11.23142       6.675580      0.000000       0.000000      11.23142       6.675580  ?        ?        233.7204 68.87518 0.000000       68.87518 
1 1 1 10  3  23 o 598.1374 22.66561 69.81949       5.264976      64.35699       7.153927      76.27425       7.776585  571.8989 32.34303 622.7706 32.26447 -50.87170      45.68444 
1 1 1 10  3  24 o 143.8469 56.04882 2.710897       4.511841      1.636223       6.115047      3.994968       6.684300  152.5362 63.16426 173.4167 68.03840 -20.88055      92.83829 
1 1 1 10  3  25 o 385.7016 36.95697 29.68001       5.467967      24.01773       8.347826      33.93497       7.236453  336.7290 66.19572 409.7056 46.29254 -72.97653      80.77668 
1 1 1 10  3  26 o 139.8236 56.10722 2.173342       4.645223      5.304123       6.408699      -1.292270      6.742694  178.9765 67.53787 141.4467 62.49184 37.52979       92.01410 
1 1 1 10  3  27 o 364.7263 42.13773 27.03248       5.858652      22.56898       6.736697      40.88547       11.86810  327.8275 54.85234 432.7257 73.23476 -104.8982      91.49923 
1 1 1 10  3  28 o 230.1253 62.57169 11.58047       5.739359      17.22803       6.911001      -0.9708611     10.30281  279.9218 64.84581 172.2662 76.62035 107.6557       100.3776 
1 1 1 10  3  29 o 498.9734 39.20709 50.49178       7.536303      0.000000       0.000000      50.49178       7.536303  ?        ?        498.9734 39.20709 0.000000       39.20709 
1 1 1 10  4  0  o 339.8647 21.85379 22.67344       2.869142      21.66632       3.890524      23.87424       4.248185  330.4622 30.66446 346.7276 31.90711 -16.26532      44.25351 
1 1 1 10  4  1  o 953.6829 13.94054 177.0899       5.163114      172.3710       7.063280      182.5045       7.566119  939.7013 19.35480 966.7150 20.15332 -27.01367      27.94216 
1 1 1 10  4  2  o 405.0785 20.15244 32.04290       3.170259      32.07360       3.717869      31.96111       6.068797  404.1406 23.79326 399.5168 39.63786 4.623749       46.23072 
1 1 1 10  4  3  o 327.1540 22.94792 21.03432       2.897118      17.49690       3.379691      30.83635       5.625902  296.9484 29.70527 393.0804 37.30056 -96.13205      47.68370 
1 1 1 10  4  4  o 147.3790 44.09166 4.385581       2.719715      5.207579       3.165893      2.070222       5.313370  160.0235 47.50233 146.6552 59.59582 13.36826       76.21111 
1 1 1 10  4  5  o 437.4423 21.44946 37.38218       3.643888      58.86860       9.011149      33.18190       3.984164  542.4122 43.13453 410.9341 25.08546 131.4781       49.89857 
1 1 1 10  4  6  o 257.5958 33.88951 13.28494       3.307962      1.222378       7.702340      16.01307       3.662982  165.1602 69.80389 283.1821 33.98633 -118.0219      77.63797 
1 1 1 10  4  7  o 954.0695 22.24611 177.7771       8.242561      0.000000       0.000000      177.7771       8.242561  ?        ?        954.0695 22.24611 0.000000       22.24611 
1 1 1 10  4  8  o 949.2126 17.33927 175.5220       6.391788      0.000000       0.000000      175.5220       6.391788  ?        ?        949.2126 17.33927 0.000000       17.33927 
1 1 1 10  4  9  o 459.9710 30.50761 41.62688       5.418698      0.000000       0.000000      41.62688       5.418698  ?        ?        459.9710 30.50761 0.000000       30.50761 
1 1 1 10  4  10 o 1110.423 17.89216 240.0744       7.715766      236.0778       13.36021      242.0745       9.451220  1098.091 31.32905 1114.304 21.84019 -16.21289      38.19035 
1 1 1 10  4  11 o 379.5271 26.16819 28.24269       3.833387      27.13221       5.655714      29.18637       5.213680  369.5281 40.05158 384.3477 35.32484 -14.81952      53.40387 
1 1 1 10  4  12 o 767.3266 17.12038 114.5489       5.101780      118.4350       7.302100      110.8428       7.130958  779.4991 24.12149 754.0733 24.35041 25.42578       34.27520 
1 1 1 10  4  13 o 987.4725 22.17582 189.8849       8.504185      0.000000       0.000000      189.8849       8.504185  ?        ?        987.4725 22.17582 0.000000       22.17582 
1 1 1 10  4  14 o 880.7036 24.19796 151.0759       8.276306      156.5010       11.84723      145.9047       11.56674  895.0234 34.08429 864.1334 34.46690 30.89001       48.47377 
1 1 1 10  4  15 o 1020.366 33.77572 203.3317       13.38408      203.3317       13.38408      0.000000       0.000000  1020.366 33.77572 ?        ?        0.000000       33.77572 
1 1 1 10  4  16 f 694.2621 18.12831 93.75206       4.887747      96.82470       6.949647      90.74456       6.875585  704.9742 25.38409 682.4305 25.94318 22.54370       36.29601 
1 1 1 10  4  17 o 611.1869 20.06927 72.69977       4.763581      66.44915       6.578115      79.59179       6.907381  583.5994 29.02409 638.8316 27.84191 -55.23218      40.21902 
1 1 1 10  4  18 o 361.4172 29.76745 25.67299       4.140936      30.91490       5.791983      20.19211       5.922535  395.4412 38.19052 316.3878 49.85150 79.05347       62.79879 
1 1 1 10  4  19 o 927.6831 19.96670 167.5474       7.193394      172.7312       8.752957      156.7618       12.62573  941.3843 23.94197 894.6183 36.34048 46.76605       43.51837 
1 1 1 10  4  20 o 1265.097 19.37905 311.5748       9.521040      314.4359       11.61380      305.7111       16.62644  1270.116 23.54524 1249.731 34.25742 20.38464       41.56861 
1 1 1 10  4  21 o 1389.120 19.61287 375.7616       10.58056      373.7290       12.85807      380.0242       18.62037  1384.401 23.91586 1392.869 34.42312 -8.467529      41.91563 
1 1 1 10  4  22 o 1008.471 24.87393 198.5147       9.741728      198.5147       9.741728      0.000000       0.000000  1008.471 24.87393 ?        ?        0.000000       24.87393 
1 1 1 10  4  23 o 282.6468 43.01435 16.13999       4.572611      15.57430       6.079770      16.87672       6.938227  273.5485 58.96684 283.6549 64.44894 -10.10641      87.35419 
1 1 1 10  4  24 o 108.5530 49.09657 -2.233289      4.430030      0.1018921      5.933777      -5.173917      6.658721  141.1319 60.50924 124.6022 57.76212 16.52970       83.65303 
1 1 1 10  4  25 o 125.0202 53.09807 0.3618869      4.491890      4.362749       5.954480      -4.921643      6.842725  169.3300 64.81096 127.2696 58.84182 42.06037       87.53754 
1 1 1 10  4  26 o 432.2113 43.47726 37.75285       7.198683      38.78111       8.898233      35.80510       12.24668  433.6482 54.00732 402.4370 81.16068 31.21118       97.48767 
1 1 1 10  4  27 o 509.4025 32.42909 51.63642       6.382025      50.37784       7.421240      55.21005       12.50522  500.6866 38.46043 509.4055 64.66895 -8.718811      75.24147 
1 1 1 10  4  28 o 243.9252 54.35773 12.76497       5.017612      18.72404       7.182280      7.083968       7.012710  291.7260 65.05287 192.6880 71.05543 99.03796       96.33665 
1 1 1 10  5  0  o 402.8107 20.00175 31.69244       3.128938      32.16820       4.248625      31.12858       4.625306  403.9253 27.24358 396.6101 30.25785 7.315186       40.71548 
1 1 1 10  5  1  o 548.5688 18.28999 58.71651       3.896481      58.43161       4.587409      59.45442       7.382886  546.7151 21.60620 547.4767 34.90614 -0.7615967     41.05199 
1 1 1 10  5  2  o 497.6933 17.56949 48.30880       3.395853      44.58094       3.889993      60.24943       6.961977  477.6614 20.97011 551.9396 32.62473 -74.27820      38.78296 
1 1 1 10  5  3  o 350.2170 22.31012 24.07673       3.018560      25.15598       3.595633      21.50032       5.555480  357.3131 26.09225 325.3174 45.19383 31.99573       52.18513 
1 1 1 10  5  4  o 577.0474 17.13789 64.91511       3.840580      65.35632       4.734100      64.06569       6.568606  578.4182 21.07500 570.2367 29.76451 8.181458       36.47029 
1 1 1 10  5  5  o 892.1970 16.40834 155.1086       5.685301      144.3568       8.773549      162.8915       7.464588  858.3695 26.31922 913.2806 21.04619 -54.91113      33.69931 
1 1 1 10  5  6  o 339.5408 29.11827 22.77968       3.802448      0.000000       0.000000      22.77968       3.802448  ?        ?        339.5408 29.11827 0.000000       29.11827 
1 1 1 10  5  7  o 240.4016 39.26647 11.69821       3.539371      0.000000       0.000000      11.69821       3.539371  ?        ?        240.4016 39.26647 0.000000       39.26647 
1 1 1 10  5  8  o 517.3267 21.32610 52.20967       4.284542      0.000000       0.000000      52.20967       4.284542  ?        ?        517.3267 21.32610 0.000000       21.32610 
1 1 1 10  5  9  o 135.6125 45.24298 3.448552       2.794232      -1.125985      5.381173      5.137345       3.269576  128.1333 56.24710 160.2381 48.43551 -32.10481      74.22758 
1 1 1 10  5  10 o 374.2924 26.70712 27.49620       3.856614      27.11427       5.889140      27.78298       5.103079  368.8170 41.85752 374.7359 35.48825 -5.918976      54.87685 
1 1 1 10  5  11 f 1119.596 15.76404 243.8303       6.854200      236.9226       9.725751      250.6466       9.661177  1102.577 22.71362 1134.201 21.93371 -31.62451      31.57524 
1 1 1 10  5  12 o 402.7627 24.99401 31.74429       3.890124      39.33282       5.704233      25.14639       5.318892  447.3190 33.07056 356.0604 39.10961 91.25864       51.21741 
1 1 1 10  5  13 o 400.7531 30.22298 31.52155       4.669115      32.63469       5.618834      29.03786       8.393029  406.9287 35.92376 378.7885 58.97415 28.14014       69.05408 
1 1 1 10  5  14 o 902.9283 16.38575 158.5293       5.745760      159.5957       8.264401      157.5316       7.993817  905.2937 23.50682 899.4879 22.88395 5.805847       32.80618 
1 1 1 10  5  15 o 800.1049 19.94089 124.5572       6.196115      134.0116       11.68461      120.8585       7.308269  827.9797 36.33846 787.7905 23.88778 40.18915       43.48689 
1 1 1 10  5  16 o 845.9685 19.64101 139.2492       6.452768      130.6787       11.52433      143.1633       7.788091  817.5110 36.29896 857.4103 23.38914 -39.89929      43.18178 
1 1 1 10  5  17 o 420.6434 25.32755 34.61014       4.118181      34.08894       5.857256      35.11966       5.791280  415.7915 36.64839 422.2467 35.65002 -6.455261      51.12757 
1 1 1 10  5  18 o 325.6480 33.14600 20.94521       4.133431      18.79216       5.767687      23.21859       5.926664  304.7875 50.49555 340.5642 45.98685 -35.77667      68.29781 
1 1 1 10  5  19 o 194.9702 50.99542 7.783609       3.905293      9.403453       5.480124      6.112161       5.566731  214.8737 62.14392 183.7376 63.80209 31.13617       89.06499 
1 1 1 10  5  20 o 395.7731 33.22492 30.86021       5.059422      34.33777       6.119081      23.34527       8.995228  416.7003 38.23900 334.9276 71.34142 81.77264       80.94331 
1 1 1 10  5  21 o 515.1253 27.90803 51.98067       5.562202      49.24421       6.601541      58.67735       10.32714  500.2332 34.18646 542.5281 49.56246 -42.29489      60.20923 
1 1 1 10  5  22 o 896.3795 21.00392 156.6279       7.311732      159.6250       8.911770      150.4553       12.78930  904.1088 25.38138 874.7947 37.64547 29.31403       45.40260 
1 1 1 10  5  23 o 540.0543 24.85992 57.00133       5.213929      66.06989       7.090374      46.32368       7.693746  579.4391 31.62850 482.4060 41.47055 97.03317       52.15524 
1 1 1 10  5  24 o 425.9811 39.73623 36.21798       6.497742      36.21798       6.497742      0.000000       0.000000  425.9811 39.73623 ?        ?        0.000000       39.73623 
1 1 1 10  5  25 o 499.9053 31.01724 49.38630       5.991972      46.59561       6.934453      57.61063       11.90438  483.6678 37.20325 528.6988 58.98437 -45.03094      69.73692 
1 1 1 10  5  26 o 541.0551 30.31561 57.91734       6.344303      62.14022       7.469785      46.98494       12.01881  558.9541 34.58138 469.9465 67.81705 89.00757       76.12506 
1 1 1 10  5  27 o 677.9214 26.08463 90.48956       6.867396      95.64548       10.78445      86.97281       8.906669  689.2383 40.46781 660.1943 34.86246 29.04395       53.41380 
1 1 1 10  5  28 o 680.7448 23.46870 91.16277       6.204421      89.27737       8.824278      93.00611       8.725311  668.0779 34.12521 683.3539 32.87814 -15.27594      47.38673 
1 1 1 10  6  0  o 688.2402 17.86864 92.42010       4.775946      89.95865       5.670984      98.42466       8.857331  678.2787 21.52892 706.4188 32.28588 -28.14001      38.80558 
1 1 1 10  6  1  o 527.9788 19.19974 54.42310       3.936767      54.32157       4.693828      54.66393       7.229050  526.8780 22.93977 524.5316 35.70039 2.346436       42.43526 
1 1 1 10  6  2  o 667.0016 17.03732 86.74749       4.413227      86.19423       5.307523      87.98702       7.944336  664.2400 20.57496 668.6725 30.59258 -4.432556      36.86781 
1 1 1 10  6  3  o 431.4542 20.55642 36.35890       3.444373      35.24331       4.121000      38.94440       6.273688  423.4390 25.17352 442.2371 36.86510 -18.79807      44.64013 
1 1 1 10  6  4  o 570.5063 18.84480 63.49947       4.175227      64.99556       6.265847      62.30466       5.599506  575.5456 28.03316 563.9979 25.56491 11.54773       37.93972 
1 1 1 10  6  5  o 823.6533 16.61650 132.1914       5.315108      121.8972       8.150522      139.8082       7.010934  788.7860 26.60714 846.0941 21.33680 -57.30811      34.10570 
1 1 1 10  6  6  o 406.6733 26.49443 32.51394       4.161503      12.09112       9.217923      37.74194       4.663833  244.3459 82.17254 438.0669 27.55453 -193.7211      86.66936 
1 1 1 10  6  7  o 209.8279 41.85495 9.005033       3.291074      7.554665       7.743818      9.324743       3.635757  206.2309 74.87559 212.9169 45.35864 -6.686020      87.54290 
1 1 1 10  6  8  o 388.8136 22.84093 29.60450       3.433776      25.63490       8.101844      30.47369       3.791113  352.3423 61.44373 394.1934 24.89234 -41.85110      66.29450 
1 1 1 10  6  9  o 307.2206 27.64824 18.59414       3.263387      22.13536       8.010658      17.88950       3.573345  326.3463 65.48348 300.7241 31.04359 25.62219       72.46924 
1 1 1 10  6  10 f 178.8174 48.66652 6.527192       3.469995      8.695065       5.376266      4.979276       4.542944  207.1897 61.99342 166.0505 57.63859 41.13925       84.64864 
1 1 1 10  6  11 o 307.6524 39.88926 18.87677       4.653710      19.44780       5.577488      17.56831       8.442884  310.6465 47.76159 289.9614 74.55913 20.68518       88.54509 
1 1 1 10  6  12 o 685.0387 17.78926 91.29791       4.732612      93.33964       6.870675      89.45460       6.528292  691.9504 25.56798 677.4747 24.81295 14.47565       35.62870 
1 1 1 10  6  13 o 1103.290 15.69637 236.6805       6.725382      221.7168       9.315263      252.9723       9.719888  1067.090 22.47843 1139.897 21.95672 -72.80725      31.42257 
1 1 1 10  6  14 o 274.5840 34.95249 14.96560       3.642691      16.09073       5.347740      13.99166       4.975468  281.8566 50.72066 262.4024 50.65916 19.45422       71.68638 
1 1 1 10  6  15 o 760.9904 17.15158 112.6200       5.068872      105.4669       7.152763      119.8362       7.184276  735.7966 25.03157 784.4630 23.58211 -48.66632      34.39034 
1 1 1 10  6  16 o 468.8571 26.91403 42.99523       4.880044      33.58297       8.754419      47.23851       5.878022  408.5885 56.69954 490.9716 30.98708 -82.38312      64.61452 
1 1 1 10  6  17 o 244.1841 50.76334 12.18102       4.656853      9.973315       8.666059      13.07735       5.521861  231.3199 79.64669 252.1186 57.65068 -20.79869      98.32190 
1 1 1 10  6  18 o 283.4026 37.74486 16.00989       4.050923      15.04006       5.684025      17.01094       5.774794  270.8033 55.90021 288.9394 53.43187 -18.13605      77.32915 
1 1 1 10  6  19 o 725.3038 18.60190 102.3904       5.239687      107.4335       7.392687      97.29964       7.427508  742.1661 25.64916 706.1150 27.08568 36.05115       37.30300 
1 1 1 10  6  20 o 447.0073 25.93924 39.11587       4.483616      38.89383       6.145556      39.36855       6.555899  444.0862 35.94234 446.3657 38.18688 -2.279449      52.44130 
1 1 1 10  6  21 f 846.7317 20.93956 139.6993       6.885593      141.1570       8.272561      136.4120       12.42296  850.5047 25.04582 833.3151 38.38731 17.18958       45.83535 
1 1 1 10  6  22 o 774.8817 22.39236 117.1350       6.738501      112.6982       7.924369      128.7212       12.80561  759.2902 26.87379 806.9229 40.99868 -47.63263      49.02134 
1 1 1 10  6  23 o 458.2736 28.09075 41.28506       4.975257      42.03845       6.712899      40.36684       7.410927  460.1745 37.89999 449.4653 42.98093 10.70917       57.30418 
1 1 1 10  6  24 o 451.9474 32.73277 40.41455       5.706199      38.67371       6.705346      44.98541       10.86527  440.1351 39.65481 466.6138 61.45411 -26.47873      73.13763 
1 1 1 10  6  25 o 228.4265 60.63074 11.07479       5.468110      14.67387       6.277577      -0.2436939     11.13244  262.3237 62.50886 185.7464 81.23502 76.57733       102.5012 
1 1 1 10  6  26 o 394.3495 33.46334 31.01261       5.076444      40.26064       6.815955      19.49211       7.607430  447.4506 39.63429 299.8124 67.02103 147.6382       77.86331 
1 1 1 10  6  27 o 638.1069 23.82632 80.02689       5.904436      76.23026       7.917162      84.78476       8.862914  618.5312 33.07931 651.3344 35.16877 -32.80322      48.28129 
1 1 1 10  6  28 o 504.0869 28.57895 50.47589       5.571718      55.21701       7.813363      45.57051       7.947549  522.4686 38.78465 471.7321 43.88535 50.73651       58.56767 
1 1 1 10  7  0  o 209.5129 40.90746 9.020520       3.209018      10.88502       3.830100      4.628744       5.878257  229.7127 44.54123 170.4381 64.59423 59.27463       78.46232 
1 1 1 10  7  1  o 323.1940 27.27977 20.64505       3.391988      19.29791       4.023158      23.95679       6.307953  310.8983 33.86917 342.2360 48.84673 -31.33771      59.44008 
1 1 1 10  7  2  o 377.5416 23.69459 28.00498       3.456484      24.47118       4.083406      36.93664       6.491841  351.4861 30.20836 429.7760 39.33151 -78.28998      49.59348 
1 1 1 10  7  3  o 896.5872 14.69184 156.5507       5.115602      154.9153       5.954354      161.1601       9.996356  891.4088 17.20005 906.0693 28.40876 -14.66052      33.20993 
1 1 1 10  7  4  o 181.3538 53.73657 6.740322       4.054145      -2.415103      8.452293      9.476053       4.620320  154.9658 69.12872 212.8239 55.37230 -57.85812      88.57127 
1 1 1 10  7  5  o 92.06367 40.59045 -0.7589542     2.830337      -3.377051      3.713481      2.870148       4.372079  91.39515 42.62643 143.6837 55.39939 -52.28852      69.90067 
1 1 1 10  7  6  o 320.0489 28.07997 20.21478       3.454853      27.89721       8.487789      18.68920       3.782364  366.9081 61.76125 306.8355 32.22289 60.07263       69.66180 
1 1 1 10  7  7  o 1202.789 15.20769 281.5744       7.103634      287.0621       15.54815      280.1267       7.985842  1209.179 33.11008 1199.313 17.14590 9.866089       37.28618 
1 1 1 10  7  8  o 468.9029 20.32000 42.85378       3.700280      45.46933       9.177555      42.34605       4.043504  475.9672 50.41792 465.9347 22.34626 10.03247       55.14819 
1 1 1 10  7  9  o 390.6033 22.91028 29.85219       3.460109      35.19224       8.472851      28.78338       3.790596  417.7801 53.44721 383.1526 25.62232 34.62750       59.27147 
1 1 1 10  7  10 o 432.5750 30.02881 36.74277       5.013360      37.30586       6.085208      35.55306       8.845128  434.7755 36.37399 419.8448 55.61751 14.93069       66.45581 
1 1 1 10  7  11 o 1228.740 15.66779 293.6338       7.476457      310.5974       11.33569      280.5730       9.946589  1262.559 23.11896 1200.290 21.33830 62.26843       31.46124 
1 1 1 10  7  12 o 356.0205 27.17609 24.85960       3.729039      22.30380       5.706417      26.76449       4.926452  334.0296 45.14636 368.3576 34.85215 -34.32800      57.03391 
1 1 1 10  7  13 o 842.0634 16.23119 137.8787       5.307905      133.1905       7.647768      142.2359       7.372802  826.9551 23.81359 854.7422 22.21107 -27.78705      32.56407 
1 1 1 10  7  14 o 1275.821 15.83625 316.4763       7.846396      314.1950       11.09922      318.7552       11.09374  1270.377 22.49738 1279.588 22.32440 -9.211548      31.69402 
1 1 1 10  7  15 o 696.9391 17.73293 94.47421       4.799580      99.39167       7.002572      90.11734       6.591340  714.2352 25.24575 680.1226 24.95505 34.11261       35.49792 
1 1 1 10  7  16 o 701.3293 18.09955 95.68986       4.929668      106.8046       7.222374      85.99511       6.745263  740.2922 25.12169 664.1694 26.15123 76.12274       36.26273 
1 1 1 10  7  17 o 545.3191 21.34489 57.90908       4.520355      63.75932       6.502366      52.43736       6.288493  570.7170 29.43773 517.1101 31.46338 53.60693       43.08741 
1 1 1 10  7  18 f 153.5481 57.45885 3.568457       4.618926      4.355536       8.473375      3.235703       5.509450  192.3505 76.24088 159.2259 61.96527 33.12459       98.24646 
1 1 1 10  7  19 f 1177.641 16.52435 269.8029       7.557277      263.2622       10.51234      276.7988       10.87194  1162.195 23.29123 1191.661 23.49235 -29.46606      33.08129 
1 1 1 10  7  20 o 630.4805 20.43690 77.42585       5.003971      76.89663       6.929319      78.00262       7.233867  627.4147 28.43858 631.7694 29.48383 -4.354736      40.96400 
1 1 1 10  7  21 o 645.2698 20.65997 81.13850       5.177248      73.74411       6.985618      90.14958       7.711561  614.0635 29.29298 678.9477 29.24678 -64.88422      41.39388 
1 1 1 10  7  22 o 509.1735 28.71125 50.90887       5.654188      53.90273       6.726252      43.69753       10.43915  522.9948 33.28992 463.0004 59.42899 59.99438       68.11772 
1 1 1 10  7  23 o 442.8976 37.94001 38.99572       6.462733      38.99572       6.462733      0.000000       0.000000  442.8976 37.94001 ?        ?        0.000000       37.94001 
1 1 1 10  7  24 o 358.8997 39.51342 25.82983       5.416152      25.70902       6.324717      26.16205       10.48827  355.7894 46.91860 346.3614 79.63757 9.428070       92.43105 
1 1 1 10  7  25 o 255.7643 55.68605 13.79453       5.374299      14.79776       6.213816      10.81597       10.70678  263.2556 61.83174 237.3905 87.74703 25.86507       107.3439 
1 1 1 10  7  26 o 412.0769 32.53571 33.83084       5.164393      37.45488       6.854915      29.07385       7.853646  430.4048 41.52612 372.6350 56.00204 57.76978       69.71835 
1 1 1 10  7  27 o 389.2239 35.20905 30.45617       5.264468      21.06678       6.953317      43.06756       8.058513  313.1400 59.34978 458.3209 45.89155 -145.1809      75.02287 
1 1 1 10  7  28 o 152.5713 60.85496 3.159419       5.429835      -2.645555      8.569456      7.053369       7.018565  150.5316 68.16541 191.6176 71.00098 -41.08604      98.42593 
1 1 1 10  8  0  f 647.9502 18.35473 81.93098       4.618678      82.52952       5.592727      80.64729       8.190459  649.5712 22.17016 638.4547 33.14720 11.11652       39.87798 
1 1 1 10  8  1  o 435.4299 21.30056 37.05464       3.601946      33.98612       4.219584      45.29558       6.915027  415.5077 26.28491 476.7765 37.65302 -61.26883      45.92000 
1 1 1 10  8  2  o 205.4583 42.31517 8.688181       3.263932      11.48912       3.883246      1.946931       6.024392  236.6368 43.87110 152.9911 62.95901 83.64568       76.73663 
1 1 1 10  8  3  o 435.3443 28.31387 37.33624       4.760937      31.32693       9.640046      39.27479       5.475266  386.0654 66.70962 445.7211 31.84067 -59.65570      73.91888 
1 1 1 10  8  4  o 1103.322 15.04179 237.0291       6.445104      223.8514       8.570207      254.1839       9.778317  1070.920 20.60659 1140.739 22.07242 -69.81836      30.19641 
1 1 1 10  8  5  o 207.5791 38.41416 8.765051       2.982673      4.706825       3.865387      14.73760       4.689265  157.8061 53.21094 268.6185 46.64320 -110.8125      70.76010 
1 1 1 10  8  6  o 1044.332 14.92416 212.2632       6.052798      214.8391       8.478360      209.5857       8.643941  1049.512 20.80159 1036.449 21.47513 13.06311       29.89795 
1 1 1 10  8  7  o 842.7365 15.72494 138.2245       5.146461      133.6943       11.50315      139.3582       5.754506  824.8085 35.91167 845.9504 17.51601 -21.14197      39.95571 
1 1 1 10  8  8  o 1127.750 23.84663 248.1326       10.44402      242.5414       14.59181      254.0055       14.95505  1112.327 33.77916 1138.295 33.83024 -25.96814      47.80708 
1 1 1 10  8  9  o 1373.505 15.46177 366.9774       8.247407      346.3790       17.13594      373.1873       9.408835  1330.103 33.17376 1384.729 17.49618 -54.62537      37.50486 
1 1 1 10  8  10 o 1016.040 15.05529 200.7643       5.940566      197.7609       13.43972      201.4935       6.622649  1005.156 34.42936 1017.697 16.75657 -12.54150      38.29051 
1 1 1 10  8  11 o 405.4770 24.22169 32.15211       3.796722      27.11944       5.793088      35.94147       5.026825  369.6221 41.05092 427.9601 30.44418 -58.33801      51.10798 
1 1 1 10  8  12 o 878.7487 16.06285 150.1577       5.481699      137.8743       7.793113      162.1871       7.712106  841.3162 23.85194 912.7260 21.75728 -71.40979      32.28458 
1 1 1 10  8  13 o 639.5374 18.10311 79.55740       4.496214      77.85134       6.645652      80.99754       6.105809  631.9681 27.07787 644.8468 24.38140 -12.87872      36.43712 
1 1 1 10  8  14 o 819.5183 16.46628 130.5979       5.240614      124.0624       7.396570      137.1860       7.426214  798.1223 23.86344 839.3864 22.78125 -41.26416      32.99165 
1 1 1 10  8  15 o 1480.217 16.43521 426.0919       9.447755      443.2245       13.99085      411.7304       12.80946  1508.420 23.88327 1454.067 22.68395 54.35327       32.93892 
1 1 1 10  8  16 f 1201.648 22.58138 281.2587       10.53794      0.000000       0.000000      281.2587       10.53794  ?        ?        1201.648 22.58138 0.000000       22.58138 
1 1 1 10  8  17 o 1080.497 16.21304 227.0884       6.803243      226.3021       9.596285      227.8828       9.646389  1077.696 22.92867 1081.447 22.96844 -3.750854      32.45417 
1 1 1 10  8  18 o 504.8780 22.77440 49.67258       4.465409      47.78272       6.213281      51.69152       6.421973  493.2051 32.62310 513.1064 32.39428 -19.90131      45.97452 
1 1 1 10  8  19 o 733.1279 22.57918 104.7462       6.428592      109.0515       11.72563      102.8959       7.686821  743.9269 40.74100 726.0204 27.26277 17.90656       49.02130 
1 1 1 10  8  20 o 418.5122 27.88696 34.36536       4.506543      34.15642       6.172124      34.60393       6.595331  415.2540 38.71956 417.4470 41.22083 -2.192932      56.55406 
1 1 1 10  8  21 o 490.1053 25.07837 47.02459       4.757291      47.55946       6.552919      46.42854       6.917528  491.1094 34.57878 484.6604 37.03267 6.449066       50.66667 
1 1 1 10  8  22 o 512.2488 27.83246 51.51660       5.516039      51.67297       6.656584      51.17389       9.854406  511.7338 33.68323 504.1112 51.03910 7.622559       61.15186 
1 1 1 10  8  23 o 252.6111 61.03220 13.45103       5.920487      13.45103       5.920487      0.000000       0.000000  252.6111 61.03220 ?        ?        0.000000       61.03220 
1 1 1 10  8  24 o 541.1027 27.69118 57.62984       5.799515      50.40276       6.775152      77.44337       11.21808  503.9339 34.83302 620.1145 46.92958 -116.1806      58.44419 
1 1 1 10  8  25 o 779.3484 20.30724 118.7673       6.146253      114.3728       8.230841      124.3063       9.240788  762.4783 27.79641 794.0657 29.96571 -31.58746      40.87278 
1 1 1 10  8  26 o 483.5767 28.51573 46.30486       5.331528      48.27343       6.988684      43.56410       8.246246  490.6115 36.95134 461.5956 46.64074 29.01587       59.50429 
1 1 1 10  8  27 o 646.9514 31.48994 83.15997       7.911731      84.73327       9.984394      80.50495       12.97028  647.5281 39.89837 620.8942 54.33731 26.63397       67.41233 
1 1 1 10  8  28 o 172.9982 59.96087 5.998569       4.915513      0.2025673      6.862982      12.10385       7.043710  147.2793 64.11285 232.2517 71.27535 -84.97238      95.86779 
1 1 1 10  9  0  f 171.4268 47.32757 6.070172       3.254329      3.350476       3.805595      13.47103       6.277743  142.3664 52.36718 251.4987 64.08916 -109.1323      82.76318 
1 1 1 10  9  1  f 321.8723 33.49934 20.63226       4.126081      15.53417       5.311225      28.39229       6.552737  273.8118 51.84595 374.4915 46.02475 -100.6797      69.32734 
1 1 1 10  9  2  o 530.2214 18.83981 54.83934       3.879375      51.88158       4.534494      62.91484       7.492601  515.2009 22.66336 563.9429 34.37542 -48.74207      41.17398 
1 1 1 10  9  3  o 216.5138 40.82011 9.574388       3.306439      5.410017       4.314167      15.50278       5.147436  167.8513 56.21697 274.4697 50.13886 -106.6183      75.32764 
1 1 1 10  9  4  o 733.4919 16.04036 104.7711       4.569172      101.1060       6.092288      109.4832       6.907853  719.6710 21.79809 748.5180 23.76363 -28.84705      32.24697 
1 1 1 10  9  5  o 493.7638 19.30977 47.52475       3.702749      50.25206       4.863170      43.76298       5.711483  507.1111 24.69382 471.3146 31.38341 35.79654       39.93373 
1 1 1 10  9  6  o 439.6393 20.62555 37.68187       3.521519      31.29359       4.512684      47.63029       5.631453  398.7755 29.34544 492.3727 29.58822 -93.59723      41.67274 
1 1 1 10  9  7  o 363.0569 47.10540 26.48696       6.485078      22.27140       8.723870      31.69378       9.695450  325.9387 70.93475 392.0077 66.03312 -66.06897      96.91290 
1 1 1 10  9  8  o 276.6947 31.19703 15.16369       3.293782      20.52591       9.024924      14.33969       3.537817  312.3906 75.27794 268.3236 34.76815 44.06702       82.91919 
1 1 1 10  9  9  o 558.5655 17.78518 60.71623       3.857982      56.12840       9.623129      61.59483       4.211226  531.5485 47.10505 562.4839 19.27838 -30.93542      50.89737 
1 1 1 10  9  10 o 678.1038 16.17982 89.43540       4.260867      107.4525       10.99641      86.25243       4.621937  739.4726 38.42377 665.8064 17.87508 73.66620       42.37812 
1 1 1 10  9  11 o 1132.906 15.01041 249.5458       6.604113      233.0671       14.21256      254.0835       7.458184  1092.042 33.51236 1142.973 16.80232 -50.93115      37.48861 
1 1 1 10  9  12 o 423.4005 23.28159 35.01662       3.813470      39.30906       6.159871      32.34914       4.855908  446.9825 35.78575 405.9363 31.03762 41.04620       47.37039 
1 1 1 10  9  13 o 700.3432 17.59277 95.39697       4.784903      86.31377       7.035564      103.2140       6.526791  665.4051 27.22606 728.0400 23.08429 -62.63495      35.69514 
1 1 1 10  9  14 o 836.6351 16.46702 136.1186       5.350311      137.3451       7.810597      135.0342       7.343912  839.6990 23.95150 832.7370 22.70867 6.961975       33.00542 
1 1 1 10  9  15 o 87.59798 40.98501 -3.435243      3.477363      -7.790591      5.003210      0.6346846      4.836494  94.21677 45.47435 132.8493 55.68520 -38.63255      71.89407 
1 1 1 10  9  16 o 698.2646 17.82147 94.86971       4.832720      92.49134       6.849113      97.22789       6.819977  688.7065 25.60779 706.2058 24.86701 -17.49927      35.69492 
1 1 1 10  9  17 o 1154.713 16.17905 259.3709       7.255296      265.0922       10.38575      253.9174       10.13975  1166.330 22.92916 1141.493 22.87317 24.83789       32.38716 
1 1 1 10  9  18 o 766.2015 18.10839 114.2580       5.388287      128.8984       7.769925      100.6942       7.478788  813.0175 24.60872 718.3001 26.81003 94.71735       36.39185 
1 1 1 10  9  19 o 672.8303 19.61887 88.15678       5.126341      89.26163       7.128176      86.97321       7.377746  676.1476 27.14619 667.2414 28.47165 8.906250       39.33892 
1 1 1 10  9  20 o 834.1210 21.91096 135.6383       7.097715      155.2361       13.58741      128.2837       8.323654  888.4263 39.38105 810.4579 26.44573 77.96832       47.43673 
1 1 1 10  9  21 o 118.0191 55.01719 -5.454389      6.174289      -1.908022      9.665489      -7.899135      8.025071  169.9168 74.95772 131.2431 61.67782 38.67368       97.07117 
1 1 1 10  9  22 o 551.3203 25.76905 59.46650       5.517348      60.41362       6.677472      57.42859       9.794960  553.8867 31.16967 535.0212 47.63998 18.86548       56.93080 
1 1 1 10  9  23 o 294.1552 40.16574 17.45594       4.468467      16.39289       5.845767      18.95012       6.930543  280.4024 55.64621 300.0627 61.53915 -19.66025      82.96726 
1 1 1 10  9  24 o 449.8728 31.62882 40.09237       5.490730      37.28259       6.350524      48.41270       10.92808  431.7467 38.27168 483.2766 59.48196 -51.52991      70.73065 
1 1 1 10  9  25 o 480.9179 31.15664 45.88271       5.787720      50.87768       6.861818      33.56782       10.77426  505.0706 35.20329 392.2211 73.43296 112.8496       81.43508 
1 1 1 10  9  26 o 205.3326 60.83463 9.038176       5.196127      9.834474       7.316235      8.227705       7.381061  215.9510 73.20435 203.6837 73.22050 12.26730       103.5380 
1 1 1 10  9  27 o 253.3228 52.52103 13.71326       4.997364      14.10160       6.656871      13.21180       7.564490  251.4381 66.97303 242.1671 73.77888 9.270996       99.64291 
1 1 1 10  10 0  o 280.0275 33.19831 15.65062       3.540004      14.23729       4.269057      18.76156       6.333692  264.4539 43.04839 300.3323 56.37383 -35.87839      70.93075 
1 1 1 10  10 1  o 265.7061 33.74256 14.11419       3.403325      12.88620       4.001410      17.32584       6.471133  251.5933 42.46476 287.5540 59.89230 -35.96078      73.41896 
1 1 1 10  10 2  o 643.5714 16.86651 80.69299       4.215508      78.78181       4.949715      85.74005       8.043581  635.4678 20.05666 660.7061 31.34824 -25.23834      37.21534 
1 1 1 10  10 3  o 512.1607 20.21921 51.16378       4.021596      46.69313       5.236120      57.59447       6.279906  487.5348 27.77008 541.1323 30.00027 -53.59744      40.88023 
1 1 1 10  10 4  o 360.9266 24.44002 25.56312       3.405502      28.06235       4.510735      22.25032       5.193284  377.0672 31.08046 333.3015 40.98504 43.76569       51.43703 
1 1 1 10  10 5  o 373.8588 27.33627 27.47301       3.941425      26.97835       4.332328      29.84898       9.494867  369.9232 30.42629 379.2552 66.91162 -9.331940      73.50459 
1 1 1 10  10 6  o 470.8119 19.57977 43.18298       3.579999      42.10353       4.620243      44.80481       5.663264  463.6333 25.76189 477.4737 30.70424 -13.84039      40.08024 
1 1 1 10  10 7  o 171.5442 50.15933 5.937341       3.552797      -1.164687      8.702509      7.357759       3.891896  164.9446 71.98898 189.5837 51.51677 -24.63910      88.52339 
1 1 1 10  10 8  o 406.1860 22.70900 32.25399       3.567864      30.69600       9.277238      32.52442       3.865128  387.3300 63.90391 407.6630 24.52793 -20.33295      68.44947 
1 1 1 10  10 9  o 1053.873 14.96129 215.9759       6.123297      206.9984       13.88608      218.1430       6.822435  1028.458 34.76684 1058.971 16.58928 -30.51282      38.52191 
1 1 1 10  10 10 o 669.3945 16.30719 87.14628       4.239253      84.64666       10.74636      87.60695       4.613383  655.4138 42.44801 671.0668 17.70214 -15.65302      45.99129 
1 1 1 10  10 11 o 352.4730 23.26797 24.30114       3.167104      15.67635       8.349861      25.75049       3.422883  275.3848 75.71956 362.7458 24.43992 -87.36099      79.56608 
1 1 1 10  10 12 o 431.6021 18.43757 36.23797       3.090404      24.90751       5.648438      41.07878       3.692016  354.0755 41.88940 459.4168 20.69325 -105.3414      46.72186 
1 1 1 10  10 13 o 454.3730 21.84763 40.19420       3.855181      38.67180       5.989317      41.27117       5.037491  443.4139 35.06696 459.1394 28.39082 -15.72549      45.11907 
1 1 1 10  10 14 o 510.2143 20.61813 50.67472       4.085356      45.48854       5.982573      55.20631       5.592286  481.4814 32.18021 531.3608 27.19125 -49.87936      42.12992 
1 1 1 10  10 15 o 626.5328 18.67424 76.39256       4.543754      78.71705       6.593836      74.29075       6.270059  635.2545 26.72775 617.1947 26.15902 18.05981       37.39876 
1 1 1 10  10 16 f 930.9560 16.43724 168.5978       5.942729      167.7138       8.395402      169.4855       8.413204  927.6552 23.30381 932.5530 23.23057 -4.897766      32.90482 
1 1 1 10  10 17 o 104.5518 46.50072 -1.370515      3.794447      -4.317194      5.317203      1.687239       5.416492  111.7995 51.75276 146.7771 59.96745 -34.97759      79.21139 
1 1 1 10  10 18 o 422.5745 26.39722 34.98444       4.310315      38.16740       5.999891      31.58972       6.196263  439.9533 35.41629 398.9673 40.55500 40.98596       53.84256 
1 1 1 10  10 19 o 983.5062 24.37373 188.7078       9.309514      0.000000       0.000000      188.7078       9.309514  ?        ?        983.5062 24.37373 0.000000       24.37373 
1 1 1 10  10 20 o 565.1226 24.26675 62.34171       5.325768      62.69377       6.535744      61.64594       9.187952  565.1775 29.88329 557.3186 42.77731 7.858887       52.18150 
1 1 1 10  10 21 o 780.1171 27.42548 119.1123       8.308869      143.5549       13.28894      103.4236       10.64657  852.5976 40.13455 723.3475 38.03313 129.2501       55.29287 
1 1 1 10  10 22 o 195.7645 54.32751 7.948523       4.275992      8.555844       5.791118      7.220510       6.340487  205.1380 64.89275 195.4666 68.07970 9.671494       94.05272 
1 1 1 10  10 23 o 320.0825 36.85678 20.53065       4.497827      21.79998       5.991110      18.89116       6.808839  326.3524 48.76644 299.3804 60.64138 26.97208       77.81737 
1 1 1 10  10 24 o 926.5209 18.36806 167.6264       6.609164      167.6051       8.985741      167.6515       9.755131  924.2498 25.03436 923.5174 27.19944 0.7324219      36.96659 
1 1 1 10  10 25 o 296.7715 55.32579 18.61103       6.141851      22.19098       7.615582      11.95033       10.38783  321.1026 63.32065 240.1589 86.79342 80.94368       107.4365 
1 1 1 10  10 26 o 102.4507 48.60418 -5.685643      5.205509      -6.378994      6.116786      -3.864707      9.912753  111.5313 52.84681 158.5213 72.37632 -46.99000      89.61650 
1 1 1 10  10 27 o 523.2632 27.37582 54.32202       5.543746      52.74547       7.464047      56.26174       8.279252  510.6561 37.90775 525.8073 40.86596 -15.15121      55.74068 
1 1 1 10  11 0  o 488.9798 20.90517 46.66533       3.969838      46.07204       4.749272      48.04115       7.232259  484.6402 25.32152 491.8257 38.16357 -7.185486      45.79997 
1 1 1 10  11 1  o 398.1837 24.13925 31.09750       3.715175      29.30166       4.441695      35.28016       6.778639  385.4251 29.90854 420.1588 42.11010 -34.73376      51.65057 
1 1 1 10  11 2  o 98.77103 44.06348 -1.306473      3.434677      -2.544176      4.789788      0.3630328E-02  4.927890  112.2824 50.89291 128.8843 55.19720 -16.60183      75.07875 
1 1 1 10  11 3  o 663.8242 21.26499 85.94730       5.482091      82.17697       6.218830      99.09163       11.61149  648.6010 24.68898 706.9027 42.49347 -58.30176      49.14510 
1 1 1 10  11 4  o 1130.220 15.49809 248.5843       6.802505      249.9597       9.399206      247.0714       9.857543  1132.227 21.37617 1125.402 22.55449 6.824951       31.07484 
1 1 1 10  11 5  o 219.4951 36.89206 9.712054       3.033189      9.154018       3.794558      10.69967       5.048059  211.0814 47.44415 227.2710 57.22905 -16.18964      74.33781 
1 1 1 10  11 6  o 849.1647 15.06790 140.2649       4.969041      131.3366       6.557428      152.3058       7.615172  821.0699 20.56485 883.9522 22.18313 -62.88232      30.24904 
1 1 1 10  11 7  o 1018.775 13.14361 201.7877       5.200212      199.8773       8.041428      203.1609       6.817596  1013.049 20.43971 1021.786 17.18080 -8.737122      26.70134 
1 1 1 10  11 8  o 318.0396 28.71799 19.90559       3.508753      24.07461       9.033622      19.16490       3.807710  340.7259 70.59075 311.5228 31.92446 29.20309       77.47403 
1 1 1 10  11 9  o 234.0179 35.86393 10.95872       3.155478      -7.095575      8.788301      13.63076       3.380930  143.2559 66.39164 261.8784 34.04909 -118.6226      74.61360 
1 1 1 10  11 10 o 1429.273 15.46850 397.2088       8.586006      400.2027       19.35009      396.4749       9.580823  1430.699 34.82626 1427.711 17.27963 2.987671       38.87742 
1 1 1 10  11 11 f 502.5207 18.00086 49.12290       3.512977      40.36177       9.391114      50.54832       3.787990  448.9929 55.00851 509.7000 19.13666 -60.70712      58.24216 
1 1 1 10  11 12 o 584.3929 16.92218 66.42055       3.840512      52.75111       9.782432      68.91131       4.175775  515.4283 49.47897 595.1830 18.06586 -79.75470      52.67394 
1 1 1 10  11 13 o 576.8468 18.73883 64.74686       4.197889      67.37582       6.468483      62.83397       5.517664  587.6588 28.34322 567.8018 25.02249 19.85699       37.80824 
1 1 1 10  11 14 o 410.9217 24.51878 33.02965       3.894957      23.33035       5.822888      40.88353       5.239748  341.6029 44.98662 456.6211 29.70959 -115.0182      53.91155 
1 1 1 10  11 15 o 341.8186 29.10290 22.98034       3.826535      31.21203       5.701844      16.23493       5.161489  397.3381 37.39087 283.0645 48.70957 114.2735       61.40602 
1 1 1 10  11 16 o 306.3160 32.68692 18.56081       3.828356      14.58741       5.521482      22.23951       5.312772  266.5450 55.15876 333.8415 41.90133 -67.29648      69.26911 
1 1 1 10  11 17 o 290.9686 34.65998 16.81143       3.839472      21.64292       5.433917      11.99443       5.425760  328.8334 43.62804 240.8646 58.57013 87.96878       73.03332 
1 1 1 10  11 18 o 641.2375 19.24930 80.07156       4.793601      83.45797       6.664703      76.44206       6.899756  653.8550 26.24650 625.4850 28.40461 28.37006       38.67429 
1 1 1 10  11 19 o 1127.976 18.48317 247.7811       8.096628      248.2132       10.21265      247.0499       13.28456  1127.986 23.31346 1123.502 30.44707 4.484009       38.34764 
1 1 1 10  11 20 o 250.2310 47.48236 12.81689       4.445453      9.088640       5.341400      21.21945       8.018785  210.2183 61.51272 318.1159 67.02277 -107.8975      90.97179 
1 1 1 10  11 21 o 326.3814 46.21864 21.58062       5.694537      21.58062       5.694537      0.000000       0.000000  326.3814 46.21864 ?        ?        0.000000       46.21864 
1 1 1 10  11 22 o 199.9340 63.39406 8.138145       5.524238      12.08924       10.81215      6.742351       6.426349  247.9199 88.67261 191.4953 68.37585 56.42459       111.9736 
1 1 1 10  11 23 o 479.4829 26.09627 45.24259       4.841071      51.21492       6.413135      37.33140       7.381069  508.3863 32.65519 429.6925 44.89460 78.69376       55.51474 
1 1 1 10  11 24 o 161.1344 59.16257 4.526062       4.854182      -2.733822      6.689433      12.60073       7.054832  133.6199 60.39188 240.8620 70.75493 -107.2421      93.02386 
1 1 1 10  11 25 f 313.3864 40.51666 20.02478       4.815618      20.29585       6.465075      19.68695       7.217505  309.2885 55.88134 300.9551 63.73670 8.333435       84.76492 
1 1 1 10  11 26 o 103.4679 48.67589 -4.735421      5.020537      -6.888823      5.939654      0.6526971      9.395438  107.3930 51.22276 171.2385 74.76628 -63.84547      90.62984 
1 1 1 10  12 0  o 809.9587 16.47472 127.7431       5.182136      126.3468       6.173618      131.0736       9.534504  805.0294 19.74695 817.8056 30.02065 -12.77625      35.93301 
1 1 1 10  12 1  o 521.5779 20.37441 53.04022       4.126978      54.75544       4.933413      49.04199       7.532197  529.5284 23.98999 497.3089 39.32096 32.21954       46.06145 
1 1 1 10  12 2  o 543.2122 24.76649 57.62492       5.224707      55.22864       5.923323      66.02388       11.08942  530.4928 28.85990 574.3698 50.22007 -43.87695      57.92193 
1 1 1 10  12 3  o 127.0265 48.92493 2.154731       3.407042      -1.823959      4.755334      6.351302       4.883805  115.9388 51.77569 181.4400 59.77928 -65.50114      79.08403 
1 1 1 10  12 4  o 596.0013 18.19203 69.16262       4.210720      72.40391       5.842825      65.66025       6.073592  609.1111 24.70008 579.7734 26.97487 29.33777       36.57509 
1 1 1 10  12 5  o 822.4055 21.02857 131.7778       6.716202      131.7778       6.716202      0.000000       0.000000  822.4055 21.02857 ?        ?        0.000000       21.02857 
1 1 1 10  12 6  o 1440.233 15.51951 403.4668       8.680379      399.5566       12.01155      407.7411       12.55853  1432.089 21.59738 1446.511 22.35573 -14.42212      31.08417 
1 1 1 10  12 7  o 294.8762 26.78677 17.10152       3.034059      22.39371       3.856273      8.502304       4.915632  337.3297 29.74079 204.5111 58.77232 132.8186       65.86880 
1 1 1 10  12 8  o 974.0004 15.37662 184.4774       5.816317      181.1190       13.54482      185.2367       6.440331  961.9353 36.25762 975.8470 16.99411 -13.91168      40.04266 
1 1 1 10  12 9  o 781.2624 19.15031 118.7727       5.810329      121.4872       12.00569      117.9424       6.639711  787.4622 39.25813 778.2655 21.96815 9.196655       44.98666 
1 1 1 10  12 10 o 796.8631 15.26435 123.4637       4.723783      112.3818       12.01052      125.4916       5.137849  756.0696 41.05854 803.2938 16.46944 -47.22418      44.23851 
1 1 1 10  12 11 o 1265.976 18.11935 311.7913       8.908322      291.4788       16.35759      320.3559       10.62162  1221.043 34.49534 1282.783 21.32111 -61.74048      40.55266 
1 1 1 10  12 12 o 213.2672 36.08998 9.141267       2.882458      3.223412       8.969170      9.822867       3.043932  190.2230 77.37946 221.1471 36.73128 -30.92412      85.65494 
1 1 1 10  12 13 o 935.5632 15.00965 170.2058       5.453453      172.9230       13.54110      169.6797       5.957992  939.5256 37.11224 933.9825 16.42605 5.543030       40.58490 
1 1 1 10  12 14 o 133.7871 50.17580 2.657125       3.526047      3.528941       5.571951      2.074794       4.553862  162.0350 62.52245 140.0634 55.77308 21.97153       83.78361 
1 1 1 10  12 15 o 641.2065 18.64764 80.03343       4.643547      75.13321       6.712603      84.53032       6.430415  620.3199 27.86424 658.3062 25.15261 -37.98627      37.53758 
1 1 1 10  12 16 f 376.5363 26.33275 27.80328       3.826382      25.11398       5.480667      30.36065       5.344542  355.3002 40.44061 392.0540 35.48703 -36.75375      53.80309 
1 1 1 10  12 17 o 534.9346 20.93488 55.75142       4.349097      47.74564       5.976995      64.75964       6.340163  493.0368 31.37908 575.7300 28.35657 -82.69321      42.29352 
1 1 1 10  12 18 o 946.4384 18.51517 174.4300       6.805314      192.3794       9.074660      151.3628       10.28734  993.0726 23.52997 879.5814 30.11613 113.4912       38.21833 
1 1 1 10  12 19 o 577.7745 22.73026 65.13993       5.100242      65.49668       6.376090      64.50613       8.498534  578.5635 28.37759 571.0976 38.54379 7.465881       47.86346 
1 1 1 10  12 20 o 585.4517 21.48864 66.89413       4.885714      72.08702       6.609337      60.63793       7.254529  606.6686 28.05294 554.3286 33.86114 52.33997       43.97209 
1 1 1 10  12 21 o 242.5704 46.18255 12.09709       4.191636      18.52999       5.511217      3.269578       6.455994  300.8677 48.84258 166.0941 66.32268 134.7736       82.36683 
1 1 1 10  12 22 o 655.6320 20.90019 84.00340       5.321552      85.26236       7.090714      82.37983       8.052282  658.9366 27.70884 646.4781 32.07282 12.45850       42.38450 
1 1 1 10  12 23 o 432.2561 43.12025 37.75796       7.141926      0.000000       0.000000      37.75796       7.141926  ?        ?        432.2561 43.12025 0.000000       43.12025 
1 1 1 10  12 24 f 498.6015 26.01484 49.04866       5.019897      53.61663       6.715552      43.26403       7.557146  518.7144 33.51616 462.0337 42.59655 56.68076       54.20146 
1 1 1 10  12 25 o 300.6859 41.70728 18.55927       4.739119      16.61284       6.064693      21.61173       7.594790  277.5319 58.13105 314.3928 64.37021 -36.86090      86.73375 
1 1 1 10  12 26 o 544.3069 25.03961 58.45525       5.292969      54.78772       7.026024      63.26791       8.048504  522.0428 34.85614 559.8275 37.23201 -37.78473      51.00170 
1 1 1 10  13 0  o 719.0082 21.50134 100.8113       6.003815      100.8113       6.003815      0.000000       0.000000  719.0082 21.50134 ?        ?        0.000000       21.50134 
1 1 1 10  13 1  o 1067.803 15.59351 221.8749       6.466407      224.2606       7.704427      216.1890       11.89438  1073.064 18.48787 1051.241 29.13477 21.82275       34.50559 
1 1 1 10  13 2  o 238.6405 41.87196 11.53551       3.739041      10.25768       5.343148      12.76173       5.234141  222.7274 60.29541 248.4788 55.62698 -25.75140      82.03595 
1 1 1 10  13 3  o 721.6428 17.43708 101.3653       4.886794      104.5517       6.964664      98.27535       6.858500  732.0394 24.49840 709.6734 24.88528 22.36603       34.92061 
1 1 1 10  13 4  o 551.0722 19.64306 59.13709       4.203835      60.75926       5.923773      57.49132       5.966702  557.8309 27.34436 541.7649 28.45898 16.06604       39.46679 
1 1 1 10  13 5  o 737.2748 16.34007 105.7462       4.678550      105.8514       6.437325      105.6284       6.811453  737.0291 22.49017 736.0940 23.82750 0.9351196      32.76519 
1 1 1 10  13 6  o 513.4844 27.61860 51.59970       5.487291      0.000000       0.000000      51.59970       5.487291  ?        ?        513.4844 27.61860 0.000000       27.61860 
1 1 1 10  13 7  o 320.7251 24.10744 20.15767       2.980735      19.29854       3.828406      21.48015       4.749867  312.6700 31.97855 329.0335 37.86212 -16.36349      49.55974 
1 1 1 10  13 8  f 1321.781 15.41003 339.7266       7.910264      340.0456       17.95371      339.6497       8.811629  1318.526 35.06206 1321.406 17.17085 -2.880371      39.04082 
1 1 1 10  13 9  o 159.1645 45.43782 5.099361       2.947438      3.498909       8.927238      5.295166       3.122537  191.5034 77.45047 162.3467 46.89658 29.15675       90.54206 
1 1 1 10  13 10 o 178.3156 42.32360 6.487494       2.886964      13.69095       8.950088      5.650960       3.049992  260.2150 80.42479 166.9261 45.70792 93.28885       92.50600 
1 1 1 10  13 11 f 1029.079 14.71637 205.9102       5.881353      205.2301       14.42327      206.0459       6.441186  1023.901 36.27253 1029.281 16.11403 -5.379700      39.69078 
1 1 1 10  13 12 o 547.5226 17.05153 58.32233       3.625714      36.90457       10.20694      61.41511       3.878671  426.0028 63.64737 561.8055 17.77743 -135.8028      66.08347 
1 1 1 10  13 13 o 367.0722 22.43980 26.35280       3.183521      18.93195       9.507248      27.28995       3.378563  300.3008 80.06062 373.4499 23.41389 -73.14914      83.41411 
1 1 1 10  13 14 o 965.5460 14.34084 181.2975       5.377440      189.9467       8.996495      176.4895       6.707543  987.0760 23.46901 952.2316 18.13815 34.84442       29.66120 
1 1 1 10  13 15 o 708.1754 25.71509 97.86051       7.072238      97.86051       7.072238      0.000000       0.000000  708.1754 25.71509 ?        ?        0.000000       25.71509 
1 1 1 10  13 16 o 895.9591 17.80659 156.2547       6.195794      152.2841       7.991564      162.2373       9.809631  883.7388 23.28519 911.3732 27.71587 -27.63440      36.19903 
1 1 1 10  13 17 o 588.3422 34.19840 68.08566       7.780114      0.000000       0.000000      68.08566       7.780114  ?        ?        588.3422 34.19840 0.000000       34.19840 
1 1 1 10  13 18 o 932.8586 16.82516 169.4205       6.095411      172.6963       8.530537      166.0032       8.712778  940.6965 23.35064 922.0889 24.33077 18.60760       33.72297 
1 1 1 10  13 19 o 396.0295 27.31376 30.83950       4.175166      23.19503       5.460227      41.60171       6.478701  339.9306 42.27419 458.1717 36.71946 -118.2411      55.99487 
1 1 1 10  13 20 o 188.7836 52.01651 7.375501       3.935640      11.25992       5.219573      2.256962       5.991631  231.6470 58.11740 155.1489 63.19311 76.49811       85.85454 
1 1 1 10  13 21 o 346.1371 51.60571 24.59798       6.725011      0.000000       0.000000      24.59798       6.725011  ?        ?        346.1371 51.60571 0.000000       51.60571 
1 1 1 10  13 22 o 584.4788 24.33973 66.96912       5.524749      72.97400       7.958577      61.38388       7.675462  606.5234 33.92377 555.4521 35.77221 51.07135       49.29983 
1 1 1 10  13 23 o 142.0719 54.55214 3.006649       4.227010      4.624104       5.536487      0.7461973      6.545093  166.6801 62.80263 149.3287 63.77379 17.35133       89.50568 
1 1 1 10  13 24 o 457.7907 35.83578 42.06868       6.320212      20.65760       11.94740      50.38877       7.447637  295.1971 93.18911 499.9571 38.65857 -204.7600      100.8895 
1 1 1 10  13 25 o 433.7454 29.31846 37.46870       4.909604      37.05567       6.561703      37.99403       7.400115  426.7823 40.05844 429.6887 45.01447 -2.906403      60.25763 
1 1 1 10  14 0  o 718.3555 17.93677 100.4687       5.003933      97.36706       5.912679      108.2974       9.393568  706.7653 21.54176 743.5630 32.53006 -36.79767      39.01605 
1 1 1 10  14 1  o 361.5365 27.62307 25.68027       3.849044      26.16132       4.693635      24.69252       6.725770  363.9257 33.58900 349.5754 51.04697 14.35031       61.10658 
1 1 1 10  14 2  o 838.5872 16.98686 136.8489       5.532090      126.6053       7.663498      147.9954       7.994083  805.6448 24.49376 871.1840 23.62821 -65.53918      34.03287 
1 1 1 10  14 3  o 224.7949 43.27660 10.26898       3.640948      16.34704       5.312511      4.885286       4.999856  283.6239 50.06150 168.5774 60.29878 115.0465       78.37153 
1 1 1 10  14 4  o 1125.434 15.68659 246.3564       6.856092      240.6227       9.603559      252.3164       9.791119  1111.321 22.25177 1138.021 22.15409 -26.70032      31.39976 
1 1 1 10  14 5  o 895.1440 15.61569 155.8373       5.428527      154.5968       7.577949      157.1449       7.780241  890.8927 21.90273 898.1528 22.30565 -7.260132      31.26134 
1 1 1 10  14 6  o 297.3744 26.86524 17.38779       3.069073      14.18999       4.092529      21.49727       4.639373  265.9438 40.93855 329.3227 36.91014 -63.37888      55.12099 
1 1 1 10  14 7  o 655.1385 15.71221 83.46770       3.997592      83.29003       5.415959      83.68037       5.925198  654.0267 21.32318 655.3832 23.27982 -1.356567      31.56941 
1 1 1 10  14 8  o 1925.963 17.76375 721.6483       13.28650      650.8629       25.51538      747.9828       15.56298  1823.644 36.02749 1960.181 20.44413 -136.5370      41.42394 
1 1 1 10  14 9  o 1440.624 18.96671 403.8922       10.61135      363.7742       18.51037      423.5299       12.95063  1363.580 34.95477 1474.540 22.61550 -110.9600      41.63288 
1 1 1 10  14 10 o 190.0150 35.54105 7.293394       2.526270      10.48486       9.191957      7.032633       2.627450  236.9855 82.00317 186.1758 37.63400 50.80968       90.22660 
1 1 1 10  14 11 o 466.9219 17.71099 42.42474       3.211553      62.17965       10.29285      40.29406       3.380311  559.5650 47.82433 454.9644 19.13159 104.6006       51.50907 
1 1 1 10  14 12 o 512.2971 17.45465 51.07288       3.472651      54.34193       10.48791      50.67036       3.680246  521.4052 52.50930 510.2007 18.57410 11.20450       55.69761 
1 1 1 10  14 13 o 156.1636 43.40254 4.943336       2.727009      -4.659615      9.544303      5.796977       2.845635  159.0795 71.99603 168.4506 43.27029 -9.371078      83.99849 
1 1 1 10  14 14 o 694.0971 15.63851 93.72227       4.215447      103.6213       11.80954      92.27680       4.512735  724.4666 42.15686 688.6191 16.87457 35.84747       45.40872 
1 1 1 10  14 15 o 156.7801 60.85109 3.217918       5.302175      3.217918       5.302175      0.000000       0.000000  156.7801 60.85109 ?        ?        0.000000       60.85109 
1 1 1 10  14 16 o 779.4683 18.62136 118.3166       5.636867      104.3968       7.198059      140.3894       9.064176  731.2863 25.34545 847.6234 27.53578 -116.3371      37.42474 
1 1 1 10  14 17 o 408.1080 25.25502 32.65235       3.983011      27.30115       5.453668      38.76942       5.830892  370.5474 38.45819 443.1948 34.14045 -72.64740      51.42570 
1 1 1 10  14 18 o 837.4053 17.02978 136.5809       5.538252      134.1132       7.561191      139.4373       8.134767  828.6699 23.49528 844.6805 24.79846 -16.01068      34.16126 
1 1 1 10  14 19 o 623.7069 19.67508 75.88851       4.765682      79.74936       6.504263      71.41328       7.002687  638.2250 26.24196 603.2115 29.89284 35.01355       39.77716 
1 1 1 10  14 20 o 632.9386 21.83645 78.29934       5.367494      75.61012       7.722993      80.81198       7.465139  618.7965 32.24895 641.1694 29.98038 -22.37286      44.03202 
1 1 1 10  14 21 o 656.6821 21.62294 84.34781       5.514395      84.89809       7.962628      83.84066       7.644180  656.2334 31.24425 652.4662 30.16788 3.767151       43.43161 
1 1 1 10  14 22 o 349.2238 32.19124 24.31510       4.316709      14.12967       5.539476      40.06335       6.888030  257.8314 56.85175 446.1363 40.18705 -188.3049      69.62126 
1 1 1 10  14 23 o 518.3978 23.98399 52.81020       4.828504      54.87837       6.257245      49.76587       7.591656  525.5873 30.78999 496.7089 39.68700 28.87839       50.23029 
1 1 1 10  14 24 o 282.2523 40.63863 16.36605       4.326143      14.55154       5.633706      18.97367       6.753631  259.2978 57.45704 295.3486 60.90402 -36.05081      83.72939 
1 1 1 10  14 25 o 268.5108 57.04253 15.66463       5.764691      17.07026       11.89655      15.23330       6.590076  267.2052 93.24324 261.0819 65.19331 6.123322       113.7738 
1 1 1 10  15 0  o 793.0261 17.30626 122.3918       5.329896      116.9052       6.283332      136.4684       10.06437  774.6492 20.88608 835.3096 31.02496 -60.66034      37.40022 
1 1 1 10  15 1  o 890.4408 17.22284 154.2927       5.955769      152.4899       8.339405      156.1693       8.508603  884.2823 24.28377 894.8555 24.48372 -10.57312      34.48411 
1 1 1 10  15 2  o 106.2778 47.01036 -1.182937      3.826893      -4.184806      5.574249      1.493286       5.263221  115.8820 53.41226 143.7108 58.95938 -27.82877      79.55550 
1 1 1 10  15 3  o 346.9920 29.35353 23.68124       3.918461      21.74495       5.663026      25.45985       5.427551  329.3645 45.48748 358.0667 39.69938 -28.70227      60.37509 
1 1 1 10  15 4  o 661.5087 18.27819 85.15768       4.695662      89.53874       6.881161      81.33971       6.423749  677.5328 26.15191 645.8267 25.61206 31.70612       36.60464 
1 1 1 10  15 5  o 635.8167 17.91369 78.66082       4.423286      82.93012       6.437217      74.84179       6.088300  652.1620 25.41644 619.5543 25.30397 32.60773       35.86483 
1 1 1 10  15 6  o 931.7985 15.19671 168.8423       5.499201      161.5808       7.591173      176.8613       7.977273  910.8753 21.45962 952.9601 21.55519 -42.08484      30.41613 
1 1 1 10  15 7  o 173.4814 39.98903 6.137076       2.638926      6.177401       3.475948      6.082211       4.054511  174.6296 49.16740 175.3736 54.11906 -0.7439880     73.11844 
1 1 1 10  15 8  o 958.7208 12.62286 178.6647       4.699785      181.7000       7.504006      176.7056       6.028616  966.0639 20.00135 953.1173 16.28708 12.94659       25.79386 
1 1 1 10  15 9  o 680.9608 18.56737 90.25563       4.910214      86.25075       11.68110      91.11517       5.411542  660.1799 45.84527 684.0302 20.37125 -23.85028      50.16749 
1 1 1 10  15 10 o 489.4407 39.86713 47.34842       7.511953      43.88851       10.07671      51.67647       11.27022  466.8478 56.74652 506.6094 58.34997 -39.76154      81.39341 
1 1 1 10  15 11 o 875.1949 28.29143 149.6216       9.615849      142.5437       12.93008      158.3802       14.38346  851.9490 39.08047 897.4462 41.26928 -45.49713      56.83693 
1 1 1 10  15 12 o 815.1108 29.32016 129.8628       9.281344      133.6974       12.91453      125.7666       13.34780  824.6534 40.32543 797.9723 43.23319 26.68115       59.12063 
1 1 1 10  15 13 o 418.3358 48.64873 35.04507       7.755999      34.75055       10.42887      35.40957       11.60195  410.9461 67.70515 412.3901 75.21407 -1.444031      101.1985 
1 1 1 10  15 14 o 570.2291 17.23749 63.28897       3.817256      55.23752       10.90105      64.41424       4.075283  524.6043 54.29247 575.1940 18.24380 -50.58972      57.27572 
1 1 1 10  15 15 o 503.7710 19.16416 49.43269       3.749306      46.11365       10.85892      49.88192       3.994990  476.7135 59.98254 505.9563 20.33175 -29.24280      63.33471 
1 1 1 10  15 16 o 243.9577 40.15695 12.02344       3.672141      10.30862       5.609626      13.30928       4.857566  223.0824 62.33838 254.4966 50.92610 -31.41418      80.49561 
1 1 1 10  15 17 o 822.1219 16.68577 131.6250       5.327342      141.7469       7.655133      122.1194       7.418438  852.0020 23.13578 790.6171 24.16119 61.38483       33.45187 
1 1 1 10  15 18 o 209.5774 48.09724 9.099010       3.831695      10.87737       5.285358      7.128932       5.562963  227.7464 59.20821 191.0618 63.83770 36.68459       87.06815 
1 1 1 10  15 19 f 780.1302 19.64316 118.7969       5.951225      133.9737       9.425360      108.7349       7.674518  825.7999 29.38970 744.7598 26.53426 81.04016       39.59572 
1 1 1 10  15 20 o 398.0439 28.82185 31.31512       4.425183      41.07750       6.369320      22.20574       6.152613  453.9504 36.43610 328.6966 49.75500 125.2538       61.66968 
1 1 1 10  15 21 o 518.8841 22.43728 52.74215       4.521355      58.54200       6.009007      45.17366       6.864342  544.4936 28.51642 475.1321 37.50613 69.36148       47.11578 
1 1 1 10  15 22 o 241.8575 44.02250 12.12737       3.982541      11.48364       5.145723      13.08896       6.289101  231.2399 57.53360 244.9240 65.02970 -13.68414      86.82728 
1 1 1 10  15 23 o 294.6339 36.96777 17.63458       4.136812      19.63016       5.414097      14.83517       6.412474  307.2452 46.85766 259.5559 64.01601 47.68924       79.33279 
1 1 1 10  15 24 o 578.4291 21.93295 65.77755       4.926917      78.15767       6.855898      52.55552       7.085182  628.0386 28.10930 510.6263 35.95854 117.4122       45.64153 
1 1 1 10  16 0  o 764.5013 17.91288 113.7573       5.318287      112.1204       6.360847      117.5598       9.694621  758.5761 21.59175 775.1367 32.20509 -16.56061      38.77333 
1 1 1 10  16 1  o 342.5514 32.14784 23.15115       4.226638      21.30192       5.951623      25.03274       6.003451  325.0752 48.63836 353.8462 44.68380 -28.77100      66.04795 
1 1 1 10  16 2  o 511.2590 23.13463 50.94561       4.593370      49.29219       6.530402      52.56464       6.462149  500.7260 33.77987 517.4138 32.32150 -16.68774      46.75209 
1 1 1 10  16 3  o 662.7610 19.35752 85.51302       4.982356      87.38600       7.208627      83.79990       6.894121  669.0721 27.74289 655.2802 27.09093 13.79193       38.77610 
1 1 1 10  16 4  o 648.1412 18.69700 81.76604       4.706192      85.37641       6.869616      78.57303       6.460346  661.4727 26.74191 634.6307 26.21239 26.84198       37.44622 
1 1 1 10  16 5  o 496.4221 20.94819 47.99574       4.038551      42.91073       5.790501      52.81201       5.635405  467.3683 32.09736 519.3738 28.04333 -52.00552      42.62241 
1 1 1 10  16 6  o 914.6000 15.56740 162.7022       5.529365      163.3701       7.963431      162.0805       7.683486  915.6499 22.39457 912.1270 21.69077 3.522888       31.17702 
1 1 1 10  16 7  o 155.2808 43.59881 4.877275       2.737119      4.876653       3.609828      4.878117       4.198200  159.0471 51.33228 162.7596 55.45158 -3.712555      75.56374 
1 1 1 10  16 8  o 236.4157 23.95543 11.00960       2.169054      13.86328       3.225006      8.652456       2.931034  264.2984 32.07748 206.8432 37.88424 57.45518       49.64050 
1 1 1 10  16 9  o 883.0739 29.09875 152.4021       9.979284      142.7459       13.48321      164.0991       14.83980  852.0145 40.74913 913.2093 41.84368 -61.19476      58.40706 
1 1 1 10  16 10 o 423.4567 46.97677 35.82986       7.595199      25.86561       10.02431      49.26003       11.63786  351.0063 75.75896 492.7357 62.20382 -141.7294      98.02416 
1 1 1 10  16 11 o 427.0698 47.41737 36.46571       7.731612      36.98821       10.46961      35.83897       11.46657  424.8027 65.57328 415.2550 73.80774 9.547729       98.72911 
1 1 1 10  16 12 o 955.1486 38.88199 179.3039       14.42273      179.3039       14.42273      0.000000       0.000000  955.1486 38.88199 ?        ?        0.000000       38.88199 
1 1 1 10  16 13 o 909.9323 39.67782 162.8696       14.02119      162.8696       14.02119      0.000000       0.000000  909.9323 39.67782 ?        ?        0.000000       39.67782 
1 1 1 10  16 14 o 277.3782 68.18237 16.13606       7.292774      17.73669       9.804928      14.15412       10.91051  289.6071 82.94061 266.0554 89.39937 23.55173       121.9483 
1 1 1 10  16 15 o 737.3397 31.68285 106.5787       9.072351      113.5584       13.03398      100.0189       12.63577  756.3632 44.56995 709.1290 46.13367 47.23425       64.14668 
1 1 1 10  16 16 o 338.1262 23.59652 22.43907       3.079098      12.37636       10.60298      23.36583       3.217765  251.5961 88.01496 344.9830 24.17022 -93.38689      91.27340 
1 1 1 10  16 17 o 802.0313 16.76772 125.3307       5.222681      115.1654       7.196072      136.6447       7.591775  767.4207 24.14538 836.1110 23.38037 -68.69031      33.61013 
1 1 1 10  16 18 o 939.2005 17.81836 172.0258       6.499113      180.6441       10.15628      166.0496       8.457438  959.6696 27.25117 921.2318 23.63970 38.43774       36.07578 
1 1 1 10  16 19 o 808.4920 18.79646 127.6144       5.901738      144.2271       9.079108      115.4583       7.766424  856.9516 27.28091 767.1118 26.06961 89.83984       37.73424 
1 1 1 10  16 20 o 529.7422 21.53787 54.93003       4.430935      58.04519       5.775295      50.47256       6.908425  542.5244 27.50103 503.1594 35.58405 39.36493       44.97256 
1 1 1 10  16 21 o 314.8948 32.55447 19.85428       3.923637      25.42942       4.981298      10.74138       6.368582  355.4573 36.60871 223.1169 67.63404 132.3404       76.90618 
1 1 1 10  16 22 o 583.6924 20.58299 66.79432       4.665739      63.73291       6.087914      71.15197       7.263306  567.9962 27.59912 597.8870 31.39128 -29.89081      41.79861 
1 1 1 10  16 23 o 217.9684 58.62986 10.38316       5.071236      10.38316       5.071236      0.000000       0.000000  217.9684 58.62986 ?        ?        0.000000       58.62986 
1 1 1 10  16 24 o 259.1797 60.26337 14.82617       5.950873      0.000000       0.000000      14.82617       5.950873  ?        ?        259.1797 60.26337 0.000000       60.26337 
1 1 1 10  17 0  o 379.9524 28.78147 28.37091       4.215354      25.62605       5.001369      35.10347       7.832840  359.6717 36.30262 418.5783 49.11901 -58.90662      61.07829 
1 1 1 10  17 1  o 671.8818 20.67564 87.94273       5.394855      75.83817       7.273967      102.7413       8.042788  622.8013 30.07418 725.1443 28.55973 -102.3430      41.47427 
1 1 1 10  17 2  o 198.3112 52.77365 8.070521       4.135819      5.564545       5.785168      10.69011       5.914851  180.0814 64.81409 227.8736 64.13027 -47.79214      91.17871 
1 1 1 10  17 3  f 263.4450 40.24050 13.94257       3.986396      9.518957       5.812366      17.87150       5.477734  216.3523 64.39617 296.9357 49.22615 -80.58337      81.05603 
1 1 1 10  17 4  o 396.4251 26.52369 30.81465       4.059850      27.92724       6.149511      33.04542       5.405219  374.2288 43.10068 409.2918 34.32265 -35.06299      55.09731 
1 1 1 10  17 5  o 590.3541 19.45155 67.87240       4.459588      71.82648       6.667681      64.67181       5.998831  606.3169 28.31700 575.5074 26.84032 30.80951       39.01609 
1 1 1 10  17 6  o 757.1174 16.45952 111.5448       4.839587      108.6417       7.042853      114.1420       6.661478  746.2639 24.30123 765.1854 22.41692 -18.92151      33.06158 
1 1 1 10  17 7  o 600.9310 16.64450 70.27650       3.884394      60.94541       5.431509      80.04507       5.557379  558.8362 25.02695 640.7702 22.33262 -81.93402      33.54243 
1 1 1 10  17 8  o 558.8414 20.24620 60.84460       4.394001      59.81343       4.670794      68.77938       12.95670  553.9475 21.71172 584.6346 57.82465 -30.68707      61.76641 
1 1 1 10  17 9  o 646.7415 35.03046 82.27334       8.765610      76.85198       11.79452      88.96232       13.10106  621.0850 49.30463 667.9620 50.88691 -46.87695      70.85496 
1 1 1 10  17 10 o 323.7618 64.86342 21.74571       7.871330      17.91412       10.06792      27.77021       12.62442  291.4852 84.21116 359.4443 90.49732 -67.95914      123.6175 
1 1 1 10  17 11 o 541.7922 52.78905 58.84013       10.96611      58.84013       10.96611      0.000000       0.000000  541.7922 52.78905 ?        ?        0.000000       52.78905 
1 1 1 10  17 12 o 717.3217 44.92174 102.0360       12.45096      102.0360       12.45096      0.000000       0.000000  717.3217 44.92174 ?        ?        0.000000       44.92174 
1 1 1 10  17 13 o 1173.177 26.83191 269.0130       12.22483      268.2937       16.96633      269.7897       17.62981  1168.012 37.40354 1170.711 38.77661 -2.699463      53.87625 
1 1 1 10  17 14 o 636.7186 34.82051 79.90038       8.577522      70.54273       11.79051      90.42076       12.50159  592.8141 51.73204 673.0672 48.14553 -80.25311      70.66962 
1 1 1 10  17 15 o 935.1126 28.41924 171.3179       10.32059      183.6488       14.77050      159.5544       14.42660  964.2200 39.44491 897.9835 41.36830 66.23651       57.15975 
1 1 1 10  17 16 o 626.5573 36.37185 77.73195       8.812138      60.31937       12.09548      97.42917       12.86453  543.2881 58.23551 696.9874 47.81622 -153.6993      75.35095 
1 1 1 10  17 17 o 468.5385 58.35430 45.22383       10.38798      0.000000       0.000000      45.22383       10.38798  ?        ?        468.5385 58.35430 0.000000       58.35430 
1 1 1 10  17 18 o 293.4677 53.15143 17.92395       5.834603      17.92395       5.834603      0.000000       0.000000  293.4677 53.15143 ?        ?        0.000000       53.15143 
1 1 1 10  17 19 o 383.2266 26.36201 28.99402       3.899532      33.46861       5.145638      22.95723       5.976759  410.1677 32.57162 334.4674 47.33519 75.70023       57.45895 
1 1 1 10  17 20 o 244.9554 63.53493 13.03399       6.095283      0.000000       0.000000      13.03399       6.095283  ?        ?        244.9554 63.53493 0.000000       63.53493 
1 1 1 10  17 21 o 124.6170 49.04766 2.026000       3.483984      2.328911       4.311762      1.456236       5.913507  136.2509 54.26544 146.1656 61.43609 -9.914780      81.97031 
1 1 1 10  17 22 f 288.1480 34.84618 16.83544       3.820179      18.60516       4.883030      14.04343       6.133340  299.9089 43.16876 251.9565 62.88191 47.95242       76.27370 
1 1 1 10  17 23 o 275.0537 36.03496 15.44249       3.756605      19.15641       4.846207      9.851161       5.946251  304.2999 42.13932 211.2308 65.59818 93.06911       77.96694 
1 1 1 10  18 0  o 340.9250 31.96276 22.96707       4.182457      20.57771       5.070152      28.05586       7.399263  320.5154 41.72176 372.1805 52.66272 -51.66519      67.18681 
1 1 1 10  18 1  o 417.6186 28.54190 34.26119       4.601305      32.52781       6.300409      36.24246       6.735852  404.4383 40.66442 427.0073 41.12763 -22.56897      57.83664 
1 1 1 10  18 2  o 249.2214 45.48944 12.64001       4.240514      4.153572       6.007777      21.06579       5.986267  170.0862 65.10038 322.5312 49.36265 -152.4450      81.69902 
1 1 1 10  18 3  o 390.8517 28.32635 30.02148       4.270451      28.36728       6.268279      31.45428       5.833766  376.7476 43.65068 398.2268 38.19001 -21.47928      57.99878 
1 1 1 10  18 4  o 522.8395 21.91585 53.29976       4.449945      57.76356       6.606909      49.59346       6.020266  542.2118 31.51220 502.3667 31.00954 39.84506       44.21097 
1 1 1 10  18 5  o 767.9608 17.39640 114.8175       5.188317      117.0505       7.634431      112.9011       7.072522  774.2546 25.39013 760.6400 23.94237 13.61456       34.89836 
1 1 1 10  18 6  o 566.7023 19.19912 62.55934       4.225364      61.17409       6.374250      63.64514       5.643409  558.4241 29.49717 570.9113 25.45335 -12.48718      38.96096 
1 1 1 10  18 7  o 928.8330 15.19387 167.8584       5.480676      161.2599       7.824651      174.2137       7.679091  909.3696 22.15627 945.4069 20.91525 -36.03723      30.46880 
1 1 1 10  18 8  o 1062.995 18.72547 220.0796       7.730222      223.7025       8.701343      206.5125       16.83846  1071.307 20.91436 1023.334 42.36985 47.97272       47.25055 
1 1 1 10  18 9  o 778.6188 43.24927 119.9862       13.02621      119.9862       13.02621      0.000000       0.000000  778.6188 43.24927 ?        ?        0.000000       43.24927 
1 1 1 10  18 10 o 985.0071 38.29714 190.8473       14.64987      190.8473       14.64987      0.000000       0.000000  985.0071 38.29714 ?        ?        0.000000       38.29714 
1 1 1 10  18 11 f 907.8168 29.65908 161.3217       10.45644      150.5631       14.03442      174.7457       15.67679  873.7179 41.36141 940.7162 42.91119 -66.99835      59.59980 
1 1 1 10  18 12 o 272.9641 72.01767 15.73942       7.744961      11.26707       10.37660      21.36481       11.63760  244.5097 86.93027 314.8272 90.41754 -70.31744      125.4281 
1 1 1 10  18 13 o 239.4450 72.13187 11.92452       7.260386      7.288060       9.898818      17.32289       10.68124  216.9350 83.43753 285.3471 87.80410 -68.41211      121.1255 
1 1 1 10  18 14 o 141.9096 63.50766 -2.521128      7.195018      -1.382515      9.728146      -3.896125      10.69037  171.6143 75.47345 170.3847 76.73724 1.229553       107.6329 
1 1 1 10  18 15 o 647.5568 50.73972 84.60416       12.65801      0.000000       0.000000      84.60416       12.65801  ?        ?        647.5568 50.73972 0.000000       50.73972 
1 1 1 10  18 16 o 476.5594 64.64970 47.43362       11.65611      0.000000       0.000000      47.43362       11.65611  ?        ?        476.5594 64.64970 0.000000       64.64970 
1 1 1 10  18 17 o 232.1699 73.24033 11.41748       7.380799      23.44120       11.17099      2.102149       9.832673  322.5517 87.12589 185.5524 78.66995 136.9994       117.3877 
1 1 1 10  18 18 o 458.0871 28.92300 41.50964       5.118983      44.42904       5.921274      32.87294       10.18458  472.8800 32.43918 390.4221 69.72935 82.45795       76.90568 
1 1 1 10  18 19 o 488.9985 20.46797 46.82186       3.886963      59.10276       5.575109      35.20591       5.422077  547.9418 26.19937 419.8441 33.53426 128.0977       42.55530 
1 1 1 10  18 20 o 484.7171 20.64449 46.06531       3.886158      45.86797       5.171424      46.32132       5.890172  481.0409 27.80068 481.9808 31.64385 -0.9399109     42.12139 
1 1 1 10  18 21 o 169.6084 48.16268 6.084665       3.320632      10.77642       4.202599      -1.712205      5.417644  224.7696 49.48495 122.1656 54.85885 102.6040       73.88000 
1 1 1 10  18 22 o 405.8865 24.58115 32.63652       3.856400      32.64122       4.959790      32.62931       6.132540  403.1988 31.93625 399.4217 40.07531 3.777069       51.24407 
1 1 1 10  19 0  o 582.0668 25.36687 66.20692       5.734133      62.24438       7.527079      71.68663       8.851544  561.8085 34.66869 602.1516 38.04733 -40.34308      51.47346 
1 1 1 10  19 1  o 560.9113 23.15184 61.41076       5.043217      62.35889       7.100847      60.44569       7.163944  562.8744 32.62400 553.9493 33.45778 8.925049       46.73059 
1 1 1 10  19 2  o 971.0450 17.72221 183.6463       6.683210      173.5627       9.224869      194.7855       9.695672  942.5650 25.20118 998.5782 25.00160 -56.01324      35.49901 
1 1 1 10  19 3  o 753.5190 18.79122 110.6208       5.498918      119.2203       7.952757      102.7430       7.611736  781.0279 26.21943 724.9006 27.03817 56.12726       37.66325 
1 1 1 10  19 4  o 354.4561 30.76080 24.79277       4.192376      24.50041       6.201924      25.03878       5.689050  348.6781 46.99820 353.7614 42.24524 -5.083374      63.19408 
1 1 1 10  19 5  o 928.7439 16.54205 167.9166       5.966413      167.5207       8.728602      168.2637       8.174220  926.2958 24.26426 928.6702 22.66506 -2.374390      33.20330 
1 1 1 10  19 6  o 639.3690 18.23125 79.62143       4.526851      72.17735       6.652170      86.04204       6.177967  607.4568 28.19811 663.9112 23.96115 -56.45441      37.00365 
1 1 1 10  19 7  o 352.4749 25.14268 24.38570       3.419087      28.56462       5.535471      21.80792       4.347558  379.1861 38.10592 331.6308 34.25018 47.55527       51.23608 
1 1 1 10  19 8  f 757.6598 21.44929 111.9443       6.311246      111.9443       6.311246      0.000000       0.000000  757.6598 21.44929 ?        ?        0.000000       21.44929 
1 1 1 10  19 9  o 676.4678 47.11017 91.14720       12.29902      91.14720       12.29902      0.000000       0.000000  676.4678 47.11017 ?        ?        0.000000       47.11017 
1 1 1 10  19 10 o 344.6646 61.30933 24.56126       7.905627      13.56179       10.42466      39.44942       12.12820  259.5953 87.38544 433.7129 74.70145 -174.1175      114.9631 
1 1 1 10  19 11 o 215.4754 75.54523 8.744267       7.813452      -0.2375634     10.23652      21.28171       12.09412  181.4331 78.63905 313.2060 92.81438 -131.7728      121.6495 
1 1 1 10  19 12 o 1263.269 27.37125 312.5465       13.42822      287.4210       17.84291      345.3642       20.39211  1206.619 38.07743 1321.705 39.72828 -115.0856      55.02932 
1 1 1 10  19 13 o 795.9837 31.13017 124.5291       9.623071      117.5960       13.27667      132.2028       13.96777  767.3952 44.74350 813.9926 44.35267 -46.59741      63.00111 
1 1 1 10  19 14 o 432.2441 73.23201 39.78165       11.85408      0.000000       0.000000      39.78165       11.85408  ?        ?        432.2441 73.23201 0.000000       73.23201 
1 1 1 10  19 15 o 389.2661 77.52789 32.96566       11.30835      0.000000       0.000000      32.96566       11.30835  ?        ?        389.2661 77.52789 0.000000       77.52789 
1 1 1 10  19 16 o 444.1782 46.54585 40.07439       7.909808      33.38274       11.12654      46.91143       11.24675  391.0865 75.99680 472.9276 62.78777 -81.84109      98.57899 
1 1 1 10  19 17 o 494.9904 41.93889 49.43218       7.986193      36.07168       11.14936      63.51010       11.44479  406.7809 73.27169 555.1259 53.76060 -148.3450      90.87873 
1 1 1 10  19 18 o 172.5505 68.51819 4.201842       6.855316      6.447195       10.37945      2.464514       9.130045  207.6149 83.67173 179.5170 75.94201 28.09793       112.9962 
1 1 1 10  19 19 o 590.7314 22.59408 68.56576       5.183375      70.84445       5.831491      59.98986       11.31295  599.6642 25.04053 534.9158 55.25421 64.74835       60.66346 
1 1 1 10  19 20 o 510.8631 26.81131 51.75177       5.300668      51.75177       5.300668      0.000000       0.000000  510.8631 26.81131 ?        ?        0.000000       26.81131 
1 1 1 10  19 21 o 150.0231 47.10417 4.648006       3.056599      4.941381       4.133181      4.293896       4.540895  158.1764 54.97363 154.2853 57.12139 3.891037       79.27769 
1 1 1 10  20 0  o 553.1100 24.91973 59.79966       5.352824      54.48100       7.357628      65.78012       7.801972  524.7971 36.32434 577.2503 34.96758 -52.45319      50.42013 
1 1 1 10  20 1  o 538.2640 25.04231 56.62756       5.234771      52.22691       7.322918      61.22633       7.485942  513.6915 36.95433 556.9689 34.78294 -43.27740      50.74914 
1 1 1 10  20 2  o 283.7844 42.93854 16.26933       4.584300      20.03259       6.716707      12.98745       6.272430  311.4214 57.66023 248.7769 64.41524 62.64456       86.45244 
1 1 1 10  20 3  o 756.8389 18.95934 111.6292       5.572559      130.3454       8.234095      95.81288       7.569377  816.5372 25.96641 699.7112 27.85565 116.8260       38.08138 
1 1 1 10  20 4  f 699.2120 19.33556 95.28733       5.250415      94.41320       7.546678      96.10738       7.309422  694.5852 27.97707 701.0043 26.84939 -6.419128      38.77636 
1 1 1 10  20 5  o 367.1842 29.76982 26.57941       4.208560      32.54174       6.081272      21.09912       5.830264  404.4828 39.20609 322.6908 47.98415 81.79193       61.96447 
1 1 1 10  20 6  o 188.4005 48.56848 7.317901       3.576194      17.20323       5.580157      0.4278757      4.658663  289.8257 51.46220 128.3729 54.27340 161.4527       74.79278 
1 1 1 10  20 7  o 594.4085 18.97688 68.85886       4.380643      77.97813       6.628212      61.78624       5.837228  631.3576 27.03292 562.0425 26.74297 69.31512       38.02585 
1 1 1 10  20 8  o 639.5726 22.65751 79.85668       5.627688      82.92992       6.165880      64.52207       13.77317  651.4894 24.37024 561.1976 64.35970 90.29175       68.81918 
1 1 1 10  20 9  o 498.8419 45.04701 49.77188       8.632683      62.31692       11.69575      34.75763       12.79510  554.8899 54.99857 401.1281 84.78864 153.7617       101.0641 
1 1 1 10  20 10 o 326.0008 64.72006 22.31704       7.904761      24.13347       10.68070      20.11708       11.75431  333.1202 82.89328 303.8443 91.83524 29.27591       123.7134 
1 1 1 10  20 11 o 441.9240 49.04045 39.50868       8.274547      32.57019       11.24416      47.70470       12.22070  389.5395 77.05633 478.0703 67.71632 -88.53085      102.5825 
1 1 1 10  20 12 o 376.0017 58.53612 29.31657       8.269430      14.40935       11.26419      46.74281       12.17877  263.5001 90.79994 471.7553 68.47559 -208.2552      113.7257 
1 1 1 10  20 13 o 476.7458 64.26113 47.50966       11.59459      0.000000       0.000000      47.50966       11.59459  ?        ?        476.7458 64.26113 0.000000       64.26113 
1 1 1 10  20 14 o 180.0735 78.66968 -0.1407795     10.41559      0.000000       0.000000      -0.1407795     10.41559  ?        ?        180.0735 78.66968 0.000000       78.66968 
1 1 1 10  20 15 o 330.4892 63.64374 23.33752       7.872114      34.03234       11.01646      12.17849       11.25301  394.8525 74.57543 245.8543 90.10764 148.9982       116.9653 
1 1 1 10  20 16 o 384.5053 54.10095 30.81602       7.855156      30.48905       10.88700      31.17107       11.34488  369.5250 78.29774 372.2365 80.79755 -2.711517      112.5112 
1 1 1 10  20 17 o 393.5223 51.92539 32.25798       7.741745      22.93171       10.79059      42.15080       11.11351  313.6660 86.00874 441.5718 66.90270 -127.9058      108.9655 
1 1 1 10  20 18 o 342.7831 58.10058 25.17560       7.458174      20.78063       11.02762      28.88055       10.12500  295.0464 88.90074 357.0899 75.37809 -62.04349      116.5556 
1 1 1 10  20 19 o 253.2895 70.60979 14.58506       7.206065      14.80769       10.19850      14.36310       10.18334  252.3092 86.42497 249.3488 86.31039 2.960403       122.1424 
1 1 1 10  20 20 o 311.1052 31.35449 19.49827       3.736571      20.04552       4.034172      16.19428       9.912413  314.6830 33.52686 260.1642 85.13841 54.51880       91.50191 
1 1 1 10  21 0  o 316.0071 42.36074 20.12032       5.067772      24.29321       7.090053      15.76144       7.246327  343.9404 54.92904 272.4694 68.54266 71.47095       87.83676 
1 1 1 10  21 1  o 520.0102 25.81223 52.90443       5.212732      55.94739       7.380320      49.87529       7.363540  531.7266 35.95158 501.3188 38.10730 30.40778       52.38972 
1 1 1 10  21 2  o 200.1362 55.96385 8.287903       4.519451      10.35305       6.298075      6.095552       6.489145  223.5789 67.14339 187.6637 68.47964 35.91516       95.90462 
1 1 1 10  21 3  o 153.5808 57.11804 3.760042       4.550511      9.182407       6.430693      -1.678210      6.440106  213.3169 68.47855 137.5728 60.91216 75.74414       91.64935 
1 1 1 10  21 4  o 566.5093 23.38598 62.69794       5.145062      65.19431       7.114920      59.96162       7.449007  575.3063 31.97120 550.8790 35.00047 24.42737       47.40454 
1 1 1 10  21 5  o 417.7594 26.98877 34.30501       4.355209      34.89871       6.262451      33.74892       6.060886  418.6603 38.96453 411.8119 38.33784 6.848419       54.66283 
1 1 1 10  21 6  f 551.2787 20.47515 59.29770       4.383554      54.18914       6.496336      63.56814       5.939573  524.2217 32.06404 569.7990 26.84143 -45.57721      41.81585 
1 1 1 10  21 7  f 441.4051 21.71829 38.04671       3.722981      35.92754       5.939344      39.41831       4.778242  425.3277 36.30499 447.6894 27.61780 -22.36166      45.61573 
1 1 1 10  21 8  o 386.0411 22.19934 29.21177       3.314124      28.88158       5.688645      29.38141       4.077571  380.1398 39.09042 386.2309 27.36193 -6.091095      47.71515 
1 1 1 10  21 9  o 786.3576 32.80074 121.7937       10.01686      121.5870       13.36225      122.0588       15.13470  780.0078 44.29426 778.3370 50.33969 1.670715       67.05271 
1 1 1 10  21 10 o 618.4843 39.15890 76.17851       9.357066      74.08289       12.17431      79.20330       14.62634  603.9796 52.42319 619.6097 61.60064 -15.63019      80.88776 
1 1 1 10  21 11 o 643.4297 54.13518 84.46257       13.40152      0.000000       0.000000      84.46257       13.40152  ?        ?        643.4297 54.13518 0.000000       54.13518 
1 1 1 10  21 12 o 686.5250 51.99577 96.01113       13.75997      0.000000       0.000000      96.01113       13.75997  ?        ?        686.5250 51.99577 0.000000       51.99577 
1 1 1 10  21 13 f 285.7819 71.71893 17.90576       7.947034      10.44390       11.03407      25.94833       11.45538  235.0697 88.64024 337.7306 86.85116 -102.6609      124.0976 
1 1 1 10  21 14 o 393.1940 53.62046 32.12898       7.974275      40.15095       11.48687      24.66679       11.07885  430.4109 71.21124 328.1331 85.92414 102.2778       111.5975 
1 1 1 10  21 15 o 406.0065 52.40814 34.28171       8.070514      47.60318       11.43335      21.05269       11.39361  472.3155 63.97903 299.9673 90.35957 172.3482       110.7166 
1 1 1 10  21 16 o 141.3576 63.83247 -2.502437      7.454188      -19.79872      10.50062      15.06794       10.58350  123.7574 61.02020 257.6548 88.04217 -133.8974      107.1209 
1 1 1 10  21 17 o 163.3625 68.68567 2.310039       7.395200      -4.028556      10.39102      8.815723       10.52709  160.7761 73.66689 217.4555 85.36296 -56.67932      112.7548 
1 1 1 10  21 18 o 199.8487 70.91470 8.343352       6.902152      8.014325       10.11727      8.629808       9.440107  209.7361 83.25290 210.6107 81.34836 -0.8746033     116.3985 
1 1 1 10  21 19 o 608.9207 36.78704 75.09731       8.658440      73.81536       12.10523      76.44016       12.38949  590.5437 53.35923 600.7294 53.67150 -10.18567      75.68248 
1 1 1 10  22 0  o 660.5403 24.71494 85.40864       6.339967      86.14963       8.201722      84.30851       9.993632  661.6254 31.92015 651.0125 39.71811 10.61298       50.95512 
1 1 1 10  22 1  o 436.2306 32.26737 37.65115       5.427692      39.89507       7.206329      34.70938       8.251157  446.2863 42.07549 412.3752 52.72963 33.91113       67.45932 
1 1 1 10  22 2  o 487.8451 28.34864 46.84935       5.347680      53.48914       7.241023      38.88272       7.931589  519.2538 36.13322 438.8203 47.28906 80.43347       59.51357 
1 1 1 10  22 3  o 593.3203 23.86470 68.86602       5.498868      69.38905       7.307253      68.18311       8.349742  593.0387 31.84455 586.2780 36.86022 6.760742       48.71090 
1 1 1 10  22 4  o 912.1380 17.95748 162.2477       6.361123      162.2402       8.947257      162.2553       9.045522  910.2004 25.31191 910.1572 25.59112 0.4315186E-01  35.99442 
1 1 1 10  22 5  o 612.9779 20.39495 73.37379       4.855068      72.89966       7.121764      73.78547       6.636137  608.9734 30.11350 613.1997 27.86669 -4.226318      41.02896 
1 1 1 10  22 6  o 1058.848 16.35501 218.5229       6.725312      212.5992       9.593211      224.2479       9.430921  1042.250 23.70086 1070.777 22.67916 -28.52722      32.80359 
1 1 1 10  22 7  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 10  22 8  o 497.7732 20.62608 48.42568       3.987275      37.67577       5.929561      57.29869       5.387107  434.9803 35.40875 540.5032 25.66429 -105.5229      43.73140 
1 1 1 10  22 9  o 708.1711 53.28376 102.3094       14.54676      0.000000       0.000000      102.3094       14.54676  ?        ?        708.1711 53.28376 0.000000       53.28376 
1 1 1 10  22 10 o 417.1742 81.90299 38.55681       12.79556      0.000000       0.000000      38.55681       12.79556  ?        ?        417.1742 81.90299 0.000000       81.90299 
1 1 1 10  22 11 o 604.4371 56.41898 75.53365       13.09044      0.000000       0.000000      75.53365       13.09044  ?        ?        604.4371 56.41898 0.000000       56.41898 
1 1 1 10  22 12 o 550.6694 42.73234 61.27262       9.066943      44.78843       12.01341      83.09035       13.82093  455.3987 70.18224 632.7020 56.85539 -177.3033      90.32211 
1 1 1 10  22 13 o 284.0573 71.02048 17.91352       7.813734      14.97339       10.55114      21.48423       11.62772  259.0582 87.91045 302.5757 91.31418 -43.51752      126.7538 
1 1 1 10  22 14 o 321.1830 64.31116 22.48561       7.741932      17.30537       11.06341      27.45652       10.83757  272.9777 89.97551 345.0526 82.07178 -72.07492      121.7841 
1 1 1 10  22 15 o 583.3801 38.48606 68.75900       8.670343      66.67941       12.17472      70.89912       12.35061  562.1122 56.53787 580.6135 55.44791 -18.50134      79.18965 
1 1 1 10  22 16 o 140.1749 63.37621 -2.312825      7.374188      4.852044       10.57398      -9.096960      10.28920  196.3998 82.33062 144.1985 68.38775 52.20139       107.0290 
1 1 1 10  22 17 o 373.6779 55.33167 29.95996       7.786984      28.84397       10.66513      31.23418       11.39610  349.0597 80.34108 361.5374 82.92993 -12.47766      115.4646 
1 1 1 10  22 18 o 142.4455 63.14729 -0.6437312     6.942163      0.8873195      10.03390      -2.049585      9.614903  173.6494 76.50047 159.2999 72.16376 14.34955       105.1662 
1 1 1 10  23 0  o 753.8072 30.03269 111.9540       8.791896      111.9540       8.791896      0.000000       0.000000  753.8072 30.03269 ?        ?        0.000000       30.03269 
1 1 1 10  23 1  o 657.9586 23.74007 84.82375       6.066087      89.24154       7.947739      78.65883       9.388674  672.9387 30.41166 627.8374 38.69460 45.10126       49.21525 
1 1 1 10  23 2  o 312.6945 40.91533 19.79700       4.849423      19.08488       6.797999      20.53487       6.919866  300.1927 60.40313 312.0991 59.25949 -11.90637      84.61812 
1 1 1 10  23 3  o 209.8174 54.50569 9.283943       4.481365      9.327812       6.439612      9.242747       6.240302  212.2639 68.56653 211.0246 67.42722 1.239349       96.16547 
1 1 1 10  23 4  o 389.8651 30.14277 30.12298       4.528332      44.31493       6.562819      17.22602       6.256235  471.4206 36.12189 285.4213 58.40927 185.9993       68.67629 
1 1 1 10  23 5  o 372.4268 29.51782 27.48667       4.234297      30.26178       6.164273      25.00744       5.826402  387.1810 41.65099 350.8895 43.70369 36.29147       60.37232 
1 1 1 10  23 6  o 368.5927 28.71740 26.90749       4.078296      30.44101       6.277982      24.32760       5.364344  387.9479 42.35786 346.9497 40.57934 40.99820       58.65894 
1 1 1 10  23 7  o 644.8134 19.22280 81.26493       4.813694      73.11132       6.830144      89.31173       6.785262  609.1243 28.87327 674.1924 25.91521 -65.06805      38.79773 
1 1 1 10  23 8  o 197.1572 48.61028 8.173232       3.698382      5.993488       5.915707      9.571827       4.738596  180.5047 65.45747 212.0930 56.51121 -31.58830      86.47657 
1 1 1 10  23 9  o 126.5208 52.98861 0.9117509      4.373517      3.179658       4.724183      -12.68584      11.56765  148.0846 57.44914 148.8338 71.12543 -0.7492523     91.42883 
1 1 1 10  23 10 o 140.5412 64.57944 -4.453331      8.063976      -8.636959      11.66837      -0.6282469     11.15717  159.5237 74.77699 181.3265 80.23488 -21.80278      109.6779 
1 1 1 10  23 11 o 255.6449 74.96532 14.63001       7.925625      12.53682       10.82257      17.05092       11.63896  243.2398 88.48590 272.4839 92.33173 -29.24408      127.8863 
1 1 1 10  23 12 o 393.1955 55.73293 32.64668       8.272135      30.48462       11.32521      35.11935       12.11146  363.5085 82.15652 390.7445 82.40723 -27.23596      116.3643 
1 1 1 10  23 13 o 399.6638 53.87503 33.69753       8.148936      40.73274       11.46668      26.51902       11.58288  428.0159 71.50696 332.5920 88.22643 95.42386       113.5656 
1 1 1 10  23 14 o 100.6834 49.92312 -15.84869      7.389549      -29.11796      10.48696      -2.762864      10.41422  108.5852 54.65755 164.5203 74.75372 -55.93516      92.60435 
1 1 1 10  23 15 o 473.1476 45.92204 46.45435       8.331855      44.27084       11.76342      48.65248       11.80272  443.4651 70.67641 468.5328 66.75306 -25.06766      97.21690 
1 1 1 10  23 16 o 199.8510 73.73585 8.267734       7.553627      -0.2385380     10.51441      17.34034       10.85879  172.4782 77.00951 265.1614 89.18679 -92.68318      117.8336 
1 1 1 10  24 0  o 283.3472 60.34042 17.25399       6.436316      16.50884       7.100571      20.68694       15.24066  274.4406 67.16720 297.0843 105.3814 -22.64377      124.9667 
1 1 1 10  24 1  o 180.9853 59.25769 6.671597       4.801722      10.06771       6.721805      3.132679       6.861677  217.5819 70.02857 166.0435 67.62762 51.53844       97.35243 
1 1 1 10  24 2  o 684.3485 21.78568 91.78834       5.789972      93.67567       8.079140      89.79549       8.301918  688.4132 30.21955 673.3900 31.74562 15.02319       43.82927 
1 1 1 10  24 3  o 513.9635 25.35395 51.94453       5.060646      56.84188       7.073015      46.80796       7.243703  533.8581 34.29692 482.3531 39.00318 51.50504       51.93773 
1 1 1 10  24 4  o 738.9315 19.76737 106.8490       5.672585      107.8487       7.935376      105.8044       8.112036  739.6653 27.62513 732.2587 28.52577 7.406677       39.70979 
1 1 1 10  24 5  o 652.2960 28.54434 83.98012       7.230907      0.000000       0.000000      83.98012       7.230907  ?        ?        652.2960 28.54434 0.000000       28.54434 
1 1 1 10  24 6  o 278.2519 39.84481 15.80692       4.182723      15.06854       6.736431      16.27018       5.335915  262.1030 66.17089 278.2365 51.27087 -16.13348      83.70955 
1 1 1 10  24 7  o 367.9516 30.41643 26.97780       4.307403      25.53894       6.733149      27.97462       5.604226  350.0597 51.02828 371.5873 39.43813 -21.52768      64.49226 
1 1 1 10  24 8  o 163.7838 52.14794 5.489176       3.735109      9.635536       5.666867      2.304233       4.966613  211.3223 63.74124 142.7667 57.75880 68.55559       86.01759 
1 1 1 10  24 9  o 133.4195 52.83150 2.305880       4.065151      2.481511       4.317986      0.9365398      12.05691  137.5036 54.44938 191.4146 84.10577 -53.91096      100.1924 
1 1 1 10  24 10 o 192.9755 74.57861 6.550965       7.937755      5.203549       10.75990      8.159869       11.75770  200.7784 83.51674 219.7753 88.88463 -18.99693      121.9653 
1 1 1 10  24 11 o 181.6233 72.38885 5.116646       7.677888      11.47089       10.50648      -2.165823      11.24772  232.1389 86.70033 173.1596 78.28189 58.97928       116.8118 
1 1 1 10  24 12 o 344.0769 63.84369 26.13415       8.216928      24.30934       11.44827      28.07305       11.80073  314.3091 89.48819 338.8609 88.65325 -24.55185      125.9664 
1 1 1 10  24 13 o 260.1701 73.99578 15.78426       7.831758      4.681867       10.81784      28.01251       11.35310  195.1975 82.62453 338.6637 86.12440 -143.4662      119.3492 
1 1 1 10  24 14 o 368.3537 56.90948 29.44674       7.878611      14.74443       11.03044      44.75946       11.25709  248.0262 89.46832 447.2259 66.86700 -199.1997      111.6950 
1 1 1 10  24 15 o 149.8139 65.54546 0.4204722      7.253716      -6.415857      9.881943      8.407413       10.68123  146.3575 68.67227 210.5139 84.86555 -64.15637      109.1698 
1 1 1 10  25 0  o 466.7617 38.12654 44.05930       6.850801      49.83617       7.599683      19.00514       15.82665  495.7184 39.81178 282.0468 106.2002 213.6716       113.4172 
1 1 1 10  25 1  o 267.4789 60.53263 15.61700       6.141241      14.39222       6.739881      21.60735       14.90556  254.1193 67.24790 295.6284 104.2858 -41.50912      124.0879 
1 1 1 10  25 2  o 337.8810 37.51399 23.16166       4.839396      22.82068       6.761838      23.51971       6.929105  327.6251 55.10036 332.4398 55.63667 -4.814667      78.30382 
1 1 1 10  25 3  o 247.5101 50.09975 12.99278       4.650417      8.897936       6.595837      17.04041       6.557695  205.2995 69.50734 279.0356 62.11299 -73.73607      93.21638 
1 1 1 10  25 4  o 456.3981 28.44339 41.38387       5.016352      42.06772       7.730714      40.88651       6.592780  452.9070 44.52800 449.6358 38.11420 3.271149       58.61259 
1 1 1 10  25 5  o 155.6794 55.43312 4.568365       4.220948      6.032735       6.451029      3.472125       5.581569  181.4321 67.90260 156.3406 61.90658 25.09152       91.88682 
1 1 1 10  25 6  o 294.9521 38.29227 17.76869       4.282735      22.76805       6.761375      14.41893       5.534573  326.6478 55.27158 257.9640 56.78400 68.68378       79.24248 
1 1 1 10  25 7  o 354.7326 29.10698 25.12477       3.974495      24.59329       5.670345      25.63808       5.572501  345.3581 43.22449 353.5523 41.36733 -8.194275      59.82986 
1 1 1 10  25 8  o 202.5045 48.06636 8.764640       3.723471      12.83634       5.094100      4.093721       5.456083  243.1277 55.21112 159.3796 61.76480 83.74808       82.84418 
1 1 1 10  25 9  o 392.4470 24.58331 30.52711       3.727798      26.93258       5.084677      34.70451       5.481460  364.0717 36.45216 414.6539 34.34873 -50.58218      50.08588 
1 1 1 10  25 10 o 105.1501 42.70118 1.102491       2.725623      1.215341       2.807023      -0.7590618     11.40071  107.4257 43.43573 176.9579 79.51390 -69.53221      90.60421 
1 1 1 10  25 11 o 284.8082 71.17001 18.82863       7.849673      7.470662       10.74368      31.83474       11.49678  206.9645 84.49551 362.6427 83.37667 -155.6782      118.7062 
1 1 1 10  25 12 o 307.3936 67.88477 21.65967       7.887477      12.87565       10.90257      31.30554       11.42491  235.5823 88.25391 357.8947 83.69419 -122.3124      121.6284 
1 1 1 10  25 13 o 567.0322 40.03312 66.04060       8.759023      54.27185       12.09668      79.01163       12.69955  492.8764 64.76561 606.8367 54.46753 -113.9603      84.62444 
1 1 1 10  26 0  o 296.2593 46.83746 18.50146       5.209668      11.58169       7.172636      26.22821       7.579342  225.5503 72.31222 347.0477 58.30343 -121.4974      92.88889 
1 1 1 10  26 1  o 719.9783 31.47211 103.5827       8.799809      102.2364       10.38980      106.9997       16.55197  709.9726 37.81865 702.8104 61.25583 7.162231       71.98977 
1 1 1 10  26 2  o 395.5148 35.82169 31.73867       5.442502      31.02962       8.201428      32.29662       7.275256  378.8142 57.56019 392.0338 48.84500 -13.21957      75.49178 
1 1 1 10  26 3  f 563.4612 40.94913 64.95605       8.899339      64.95605       8.899339      0.000000       0.000000  563.4612 40.94913 ?        ?        0.000000       40.94913 
1 1 1 10  26 4  f 565.9224 25.01898 63.33804       5.498630      69.48682       8.592050      59.07296       7.155927  584.7656 38.04137 541.3185 34.21571 43.44714       51.16503 
1 1 1 10  26 5  o 399.3043 28.57684 31.86682       4.402159      36.58726       6.138068      26.86720       6.316972  423.6893 37.69790 358.1543 46.51436 65.53494       59.87251 
1 1 1 10  26 6  o 439.9088 25.59239 38.45465       4.353322      31.49805       5.811430      47.34979       6.571439  392.2172 38.65553 483.5313 35.23767 -91.31406      52.30625 
1 1 1 10  26 7  o 289.1195 36.06971 17.12189       3.961840      7.083817       5.394945      28.87194       5.836891  183.0374 62.85235 374.0190 40.84880 -190.9816      74.96027 
1 1 1 10  26 8  o 159.3445 51.73236 5.313830       3.662468      -5.154837      4.873267      18.90091       5.551848  98.82610 46.92612 297.1173 49.88298 -198.2912      68.48630 
1 1 1 10  26 9  o 255.3344 35.70340 13.41824       3.443520      9.334007       4.753923      17.92674       4.994741  204.7268 57.45015 291.0659 45.69171 -86.33911      73.40472 
1 1 1 10  26 10 o 115.1117 42.57166 2.265708       2.520870      1.782028       2.584245      11.76597       11.45309  110.0800 42.55014 228.3395 89.20837 -118.2595      98.83647 
1 1 1 10  26 11 o 220.7460 75.69428 11.37314       7.823404      7.737229       10.80715      15.37643       11.34000  205.4138 84.40431 247.8533 90.51356 -42.43951      123.7610 
1 1 1 10  27 0  f 217.2555 62.62606 10.82748       5.573729      6.592344       8.516782      14.00022       7.371552  189.3155 75.97016 241.7070 72.65247 -52.39149      105.1182 
1 1 1 10  27 1  o 184.0773 61.98987 7.401562       5.245986      4.640395       8.200451      9.314325       6.825303  176.9601 73.20122 203.2471 70.64333 -26.28694      101.7295 
1 1 1 10  27 2  o 181.1572 69.31479 6.409175       6.809401      14.10947       7.793049      -18.44844      14.00179  242.0734 75.08420 148.1379 72.51723 93.93549       104.3857 
1 1 1 10  27 3  o 199.8760 55.49620 8.902534       4.460771      8.274875       6.246658      9.555673       6.372180  193.8964 67.57176 205.0114 68.31905 -11.11505      96.09077 
1 1 1 10  27 4  o 418.1596 29.60506 35.18107       4.776608      28.03281       6.683184      42.64569       6.829478  362.4072 48.71933 454.9340 39.03352 -92.52679      62.42747 
1 1 1 10  27 5  o 316.5857 35.62931 20.57471       4.304402      19.94239       6.035831      21.22907       6.140197  301.9989 53.41840 312.3715 52.47618 -10.37259      74.88174 
1 1 1 10  27 6  f 117.1209 49.49910 0.8407025      3.872932      2.013319       5.350375      -0.4500375     5.613394  140.7875 58.75527 128.6698 56.92429 12.11769       81.80805 
1 1 1 10  27 7  o 417.0916 25.67769 34.72591       4.139041      34.80240       5.634817      34.63626       6.099766  412.5087 35.52012 409.5374 38.81578 2.971252       52.61505 
1 1 1 10  27 8  o 318.0169 32.09881 20.57545       3.910062      24.30050       5.316174      16.18555       5.771127  341.2532 40.93052 268.9254 57.02734 72.32773       70.19562 
1 1 1 10  27 9  o 500.7157 20.98076 49.49112       4.079813      47.49215       5.583025      51.78178       5.976507  485.6999 29.74204 506.7675 30.50985 -21.06760      42.60798 
1 1 1 10  28 0  o 308.8185 45.46656 20.49814       5.289660      8.328861       7.425738      33.03456       7.536918  193.0658 72.73508 388.5533 51.19415 -195.4875      88.94511 
1 1 1 10  28 1  o 196.8144 58.96244 8.897086       4.861168      3.184744       6.952476      14.36087       6.799536  158.4303 66.60421 243.4085 68.84947 -84.97821      95.79338 
1 1 1 10  28 2  o 312.2968 53.93978 21.65497       6.305377      24.66722       7.042690      9.486344       14.15515  331.6091 56.72586 216.4112 93.13680 115.1979       109.0518 
1 1 1 10  28 3  o 430.1412 37.94324 38.33540       6.273362      38.43022       7.060097      37.97969       13.67494  426.8037 43.18909 371.7126 94.51781 55.09113       103.9178 
1 1 1 10  28 4  o 259.7468 46.55627 14.59853       4.523796      8.306890       6.310196      21.25131       6.488766  191.8282 67.83372 307.9286 56.33663 -116.1003      88.17727 
1 1 1 10  28 5  o 217.9145 50.77721 10.54089       4.217532      14.66030       5.907074      6.257330       6.023615  251.7511 61.04862 174.6501 65.56546 77.10095       89.58662 
1 1 1 11  0  0  o 839.2513 20.59486 137.4036       6.703283      137.4036       6.703283      137.4036       6.703283  839.2513 20.59486 839.2513 20.59486 0.000000       0.000000 
1 1 1 11  0  1  o 324.1309 34.91269 21.25972       4.265739      21.25972       4.265739      21.25972       4.265739  324.1309 34.91269 324.1309 34.91269 0.000000       0.000000 
1 1 1 11  0  2  o 296.3456 35.90350 17.92748       3.970696      17.92748       3.970696      17.92748       3.970696  296.3456 35.90350 296.3456 35.90350 0.000000       0.000000 
1 1 1 11  0  3  o 317.0759 35.70531 20.41086       4.253217      20.41086       4.253217      20.41086       4.253217  317.0759 35.70531 317.0759 35.70531 0.000000       0.000000 
1 1 1 11  0  4  o 585.4901 26.85890 67.29860       6.077839      67.29860       6.077839      67.29860       6.077839  585.4901 26.85890 585.4901 26.85890 0.000000       0.000000 
1 1 1 11  0  5  o 937.0827 22.29777 171.3468       8.104227      171.3468       8.104227      171.3468       8.104227  937.0827 22.29777 937.0827 22.29777 0.000000       0.000000 
1 1 1 11  0  6  o 792.6969 23.23222 122.7361       7.138072      122.7361       7.138072      122.7361       7.138072  792.6969 23.23222 792.6969 23.23222 0.000000       0.000000 
1 1 1 11  0  7  o 248.2448 48.58342 13.38329       4.170831      13.38329       4.170831      13.38329       4.170831  248.2448 48.58342 248.2448 48.58342 0.000000       0.000000 
1 1 1 11  0  8  o 69.94492 49.43527 -6.595712      5.457809      -6.595712      5.457809      -6.595712      5.457809  69.94492 49.43527 69.94492 49.43527 0.000000       0.000000 
1 1 1 11  0  9  o 1002.098 23.72981 195.8665       9.223212      195.8665       9.223212      195.8665       9.223212  1002.098 23.72981 1002.098 23.72981 0.000000       0.000000 
1 1 1 11  0  10 o 307.3398 57.43430 20.37543       6.153496      20.37543       6.153496      20.37543       6.153496  307.3398 57.43430 307.3398 57.43430 0.000000       0.000000 
1 1 1 11  0  11 o 1779.599 24.78914 616.9219       17.12465      616.9219       17.12465      616.9219       17.12465  1779.599 24.78914 1779.599 24.78914 0.000000       0.000000 
1 1 1 11  0  12 o 1080.286 33.34525 228.2480       13.95928      228.2480       13.95928      228.2480       13.95928  1080.286 33.34525 1080.286 33.34525 0.000000       0.000000 
1 1 1 11  0  13 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 11  0  14 o 981.0935 34.73885 188.4485       13.19828      188.4485       13.19828      188.4485       13.19828  981.0935 34.73885 981.0935 34.73885 0.000000       0.000000 
1 1 1 11  0  15 o 632.1135 28.50244 78.30825       6.964501      78.30825       6.964501      78.30825       6.964501  632.1135 28.50244 632.1135 28.50244 0.000000       0.000000 
1 1 1 11  0  16 o 317.1791 53.94904 21.36540       6.068042      21.36540       6.068042      21.36540       6.068042  317.1791 53.94904 317.1791 53.94904 0.000000       0.000000 
1 1 1 11  0  17 f 380.7798 45.33541 29.60776       6.453309      29.60776       6.453309      29.60776       6.453309  380.7798 45.33541 380.7798 45.33541 0.000000       0.000000 
1 1 1 11  0  18 o 176.4140 81.56339 9.092618       6.162821      9.092618       6.162821      9.092618       6.162821  176.4140 81.56339 176.4140 81.56339 0.000000       0.000000 
1 1 1 11  0  19 o 782.0847 36.89278 120.5512       11.14847      120.5512       11.14847      120.5512       11.14847  782.0847 36.89278 782.0847 36.89278 0.000000       0.000000 
1 1 1 11  0  20 o 1018.461 25.21667 202.6643       9.959978      202.6643       9.959978      202.6643       9.959978  1018.461 25.21667 1018.461 25.21667 0.000000       0.000000 
1 1 1 11  0  21 o 176.8289 81.26235 9.230715       6.113556      9.230715       6.113556      9.230715       6.113556  176.8289 81.26235 176.8289 81.26235 0.000000       0.000000 
1 1 1 11  0  22 o 460.6465 38.87556 42.68103       6.840646      42.68103       6.840646      42.68103       6.840646  460.6465 38.87556 460.6465 38.87556 0.000000       0.000000 
1 1 1 11  0  23 o 554.0141 33.45186 61.06078       7.137194      61.06078       7.137194      61.06078       7.137194  554.0141 33.45186 554.0141 33.45186 0.000000       0.000000 
1 1 1 11  0  24 o 392.1498 45.13341 31.89125       6.637100      31.89125       6.637100      31.89125       6.637100  392.1498 45.13341 392.1498 45.13341 0.000000       0.000000 
1 1 1 11  0  25 o 141.4049 78.37623 6.261841       6.324230      6.261841       6.324230      6.261841       6.324230  141.4049 78.37623 141.4049 78.37623 0.000000       0.000000 
1 1 1 11  0  26 o 269.2920 73.19712 18.17238       6.617195      18.17238       6.617195      18.17238       6.617195  269.2920 73.19712 269.2920 73.19712 0.000000       0.000000 
1 1 1 11  0  27 o 993.5763 26.83260 196.0789       10.33654      196.0789       10.33654      196.0789       10.33654  993.5763 26.83260 993.5763 26.83260 0.000000       0.000000 
1 1 1 11  0  28 o 100.6830 65.80254 0.9053072      6.333345      0.9053072      6.333345      0.9053072      6.333345  100.6830 65.80254 100.6830 65.80254 0.000000       0.000000 
1 1 1 11  1  0  o 1364.498 17.28489 363.2665       9.159414      365.4997       11.26630      358.9130       15.73041  1367.029 21.22148 1349.814 30.00808 17.21509       36.75372 
1 1 1 11  1  1  o 497.4252 20.13294 48.34891       3.889224      45.63553       4.666660      54.51922       7.037275  481.8131 25.02635 523.8752 34.78766 -42.06210      42.85440 
1 1 1 11  1  2  o 146.0878 47.46175 4.176401       3.082538      -0.8272129     3.724482      15.05684       5.492210  106.0540 46.66890 268.1395 54.59764 -162.0854      71.82540 
1 1 1 11  1  3  o 203.5418 38.39605 8.469936       2.923777      8.242717       3.516532      8.978742       5.262206  199.1505 46.33908 207.3155 61.16694 -8.165024      76.73789 
1 1 1 11  1  4  o 414.5361 28.39058 33.88952       4.542982      33.09842       5.218585      36.36525       9.231834  408.4952 33.18239 419.6799 58.20980 -11.18469      67.00337 
1 1 1 11  1  5  o 383.2691 30.45734 29.03897       4.496015      29.72169       5.188442      26.98099       9.008241  386.7109 34.92486 357.4985 67.35486 29.21243       75.87109 
1 1 1 11  1  6  o 643.1502 21.22059 80.75085       5.300268      74.10744       6.090701      101.4790       10.75852  615.4004 25.48482 715.5075 38.86354 -100.1071      46.47419 
1 1 1 11  1  7  o 770.6299 21.05824 115.8650       6.302255      118.7072       10.96589      114.4633       7.701132  776.3857 36.36961 765.0210 25.92109 11.36469       44.66152 
1 1 1 11  1  8  o 494.1265 24.04940 47.67458       4.614985      42.08440       6.514771      53.30546       6.538444  461.1655 36.67904 520.3177 32.52083 -59.15216      49.01996 
1 1 1 11  1  9  o 918.9473 16.97108 164.3771       6.056590      172.3815       8.857662      157.3486       8.300121  939.8573 24.26773 898.0272 23.79945 41.83014       33.99024 
1 1 1 11  1  10 f 531.7858 26.14140 55.19529       5.398754      60.93900       9.613625      52.54956       6.524749  554.2377 45.05454 517.1394 32.65612 37.09827       55.64471 
1 1 1 11  1  11 o 800.7712 20.60417 124.8693       6.407543      110.6306       11.25077      131.7048       7.795281  750.0522 38.75690 821.9222 24.42154 -71.87006      45.80948 
1 1 1 11  1  12 o 641.7027 27.32085 80.31655       6.808573      0.000000       0.000000      80.31655       6.808573  ?        ?        641.7027 27.32085 0.000000       27.32085 
1 1 1 11  1  13 o 1021.974 16.71410 203.1144       6.633628      200.3832       9.413614      205.8084       9.349450  1014.273 23.89866 1027.975 23.41938 -13.70209      33.46062 
1 1 1 11  1  14 o 640.4122 23.60110 79.87061       5.869753      89.65936       7.058511      57.92570       10.56857  678.2357 26.79813 540.2027 50.97969 138.0330       57.59399 
1 1 1 11  1  15 f 1438.213 23.66060 402.8524       13.21530      402.8524       13.21530      0.000000       0.000000  1438.213 23.66060 ?        ?        0.000000       23.66060 
1 1 1 11  1  16 o 1610.494 17.31192 504.5142       10.82760      506.2081       15.32369      502.8253       15.30143  1611.793 24.48083 1606.387 24.52752 5.405151       34.65416 
1 1 1 11  1  17 o 910.3281 20.65843 161.3490       7.303368      154.0890       8.817393      177.2150       13.03479  888.9788 25.54000 951.5829 35.27194 -62.60419      43.54769 
1 1 1 11  1  18 o 961.4409 24.49228 180.2152       9.144917      180.2152       9.144917      0.000000       0.000000  961.4409 24.49228 ?        ?        0.000000       24.49228 
1 1 1 11  1  19 f 729.4994 19.75583 103.6154       5.596910      117.7838       8.101880      90.68143       7.740903  776.8876 26.85342 681.3534 29.25440 95.53424       39.71053 
1 1 1 11  1  20 o 586.9695 25.97079 67.23463       5.920094      71.16976       9.952640      65.07994       7.364639  599.8353 43.01013 575.6710 33.08098 24.16437       54.26069 
1 1 1 11  1  21 o 795.3117 27.35641 123.5851       8.449372      123.5851       8.449372      0.000000       0.000000  795.3117 27.35641 ?        ?        0.000000       27.35641 
1 1 1 11  1  22 o 200.4221 55.12836 8.286111       4.425059      7.875662       6.184221      8.716742       6.334440  201.4377 67.30798 209.4725 68.03590 -8.034744      95.70396 
1 1 1 11  1  23 o 575.5232 23.07217 64.71189       5.156789      63.39463       7.214419      66.08799       7.373793  566.9298 32.90916 578.8782 32.93631 -11.94836      46.55978 
1 1 1 11  1  24 o 166.4900 56.46449 5.290854       4.352779      2.689995       6.118453      7.956128       6.193756  158.9043 64.17057 200.6018 67.35820 -41.69743      93.03220 
1 1 1 11  1  25 o 496.9447 25.66115 48.57711       4.935459      49.11704       6.808921      47.97937       7.164211  496.8134 35.52481 490.1682 37.93055 6.645111       51.96864 
1 1 1 11  1  26 o 366.8058 34.46729 26.92493       4.852301      32.29487       6.915424      21.71722       6.810166  397.8679 45.57827 320.9443 56.71285 76.92355       72.75800 
1 1 1 11  1  27 o 154.9901 57.74417 4.118538       4.654871      0.1100232E-01  6.472890      8.517908       6.698890  143.6076 62.38876 203.2966 70.02424 -59.68903      93.78567 
1 1 1 11  1  28 o 248.5514 57.41392 13.41373       5.430280      13.49076       6.474500      13.23100       9.971760  246.1643 66.26064 243.3097 85.34146 2.854538       108.0446 
1 1 1 11  2  0  f 597.1632 18.25614 69.61531       4.233797      71.95621       5.131993      64.62729       7.491319  606.4344 21.79085 570.6916 33.95425 35.74286       40.34517 
1 1 1 11  2  1  o 204.6147 41.45905 8.628372       3.181593      7.746881       3.811200      10.65506       5.778918  192.4653 50.39526 224.0105 63.51063 -31.54529      81.07578 
1 1 1 11  2  2  o 353.7897 25.00693 24.65124       3.413711      32.80845       4.220181      9.210752       5.806184  408.0111 26.78236 210.2886 64.74129 197.7225       70.06233 
1 1 1 11  2  3  o 476.6076 22.79860 44.43728       4.219851      44.43728       4.219851      0.000000       0.000000  476.6076 22.79860 ?        ?        0.000000       22.79860 
1 1 1 11  2  4  o 365.2530 27.21417 26.30700       3.832565      26.30700       3.832565      0.000000       0.000000  365.2530 27.21417 ?        ?        0.000000       27.21417 
1 1 1 11  2  5  o 499.4724 25.21411 48.95560       4.875031      44.39138       5.706476      61.28498       9.378963  474.2245 31.15874 553.3896 44.00455 -79.16513      53.91908 
1 1 1 11  2  6  o 180.6562 53.95573 6.650876       4.075281      9.349411       4.804078      -0.2746905     7.696152  211.7722 57.10736 157.7123 68.27213 54.05989       89.00749 
1 1 1 11  2  7  o 614.0960 23.59733 73.65845       5.627651      67.22764       9.644650      76.97827       6.929638  581.2346 43.03326 626.9477 28.46107 -45.71313      51.59355 
1 1 1 11  2  8  o 752.6504 25.52250 110.6754       7.460096      0.000000       0.000000      110.6754       7.460096  ?        ?        752.6504 25.52250 0.000000       25.52250 
1 1 1 11  2  9  o 550.3558 30.54665 59.45157       6.503173      0.000000       0.000000      59.45157       6.503173  ?        ?        550.3558 30.54665 0.000000       30.54665 
1 1 1 11  2  10 o 237.0838 60.35754 11.63236       5.571760      0.000000       0.000000      11.63236       5.571760  ?        ?        237.0838 60.35754 0.000000       60.35754 
1 1 1 11  2  11 o 969.5490 19.47050 182.9915       7.331196      165.6681       12.87896      191.2957       8.916857  919.7105 36.05799 990.7851 23.17418 -71.07458      42.86282 
1 1 1 11  2  12 o 620.6471 19.72298 74.97034       4.753848      65.79755       6.704625      84.24413       6.741439  579.8178 29.87678 657.3149 26.40895 -77.49707      39.87549 
1 1 1 11  2  13 o 708.2277 18.50814 97.57808       5.090537      96.18585       7.209341      98.96243       7.188916  702.4789 26.42617 712.5913 25.97736 -10.11243      37.05625 
1 1 1 11  2  14 o 1021.724 16.73792 203.0043       6.641452      196.2441       9.189651      210.3960       9.609258  1003.841 23.57253 1039.376 23.80616 -35.53497      33.50220 
1 1 1 11  2  15 o 698.2708 19.53647 94.87256       5.297829      91.59045       7.311002      98.50161       7.687706  685.3975 27.46669 710.7456 27.85189 -25.34808      39.11709 
1 1 1 11  2  16 o 1366.695 23.53403 363.8760       12.49096      363.8760       12.49096      0.000000       0.000000  1366.695 23.53403 ?        ?        0.000000       23.53403 
1 1 1 11  2  17 o 529.0667 27.28143 54.75411       5.586304      57.28577       6.770246      49.35370       9.888156  540.3932 32.40985 497.3154 51.96579 43.07785       61.24411 
1 1 1 11  2  18 o 247.0957 47.22053 12.42090       4.366113      11.51536       6.267421      13.27473       6.085815  236.5167 65.82113 253.2587 62.30446 -16.74197      90.63259 
1 1 1 11  2  19 o 675.4078 20.50001 88.83894       5.377101      89.55388       7.592050      88.11933       7.616748  677.1461 28.87013 671.6559 29.20080 5.490234       41.06301 
1 1 1 11  2  20 o 1018.605 17.78638 201.9460       7.035930      212.8717       10.10387      191.6602       9.803545  1044.614 24.90599 991.0986 25.47055 53.51532       35.62383 
1 1 1 11  2  21 o 1094.751 17.81470 233.3393       7.573939      251.6787       11.09784      217.3504       10.36229  1135.453 25.16758 1055.152 25.28790 80.30078       35.67751 
1 1 1 11  2  22 f 267.8903 50.82236 14.73215       5.093928      6.613657       8.195576      19.84285       6.502520  202.8290 76.41257 310.5257 55.98011 -107.6967      94.72409 
1 1 1 11  2  23 o 336.9117 35.33535 22.59550       4.554488      18.29867       6.353021      27.13893       6.532776  296.8307 57.18579 366.3987 46.99399 -69.56799      74.01791 
1 1 1 11  2  24 o 304.2983 40.04730 18.66692       4.617654      21.68494       6.372897      15.33106       6.700080  324.5190 52.34851 268.3035 64.98965 56.21552       83.45071 
1 1 1 11  2  25 o 291.1818 42.37186 17.25583       4.650948      8.219785       6.324827      27.89487       6.862945  202.2882 68.06647 369.1198 49.09335 -166.8316      83.92379 
1 1 1 11  2  26 o 352.1610 36.15385 24.91578       4.874360      28.00620       6.825614      21.69949       6.963217  368.7567 48.86579 320.0763 58.16043 48.68045       75.96381 
1 1 1 11  2  27 o 184.9881 58.44572 7.162354       4.698723      5.449659       6.385000      9.185493       6.939585  177.5372 67.31223 209.3637 71.29354 -31.82648      98.04950 
1 1 1 11  2  28 f 350.1399 41.74253 25.13078       5.564194      24.87755       6.742812      25.67127       9.851009  343.4594 52.19482 334.3275 77.39960 9.131836       93.35416 
1 1 1 11  3  0  o 86.58157 39.78990 -2.146219      3.062666      2.006597       3.740153      -10.59808      5.335734  128.4162 50.73096 89.56339 44.03106 38.85284       67.17414 
1 1 1 11  3  1  o 573.3650 18.70374 64.18097       4.164737      65.41474       5.042900      61.53437       7.385946  578.1619 22.45964 556.8825 34.31907 21.27942       41.01505 
1 1 1 11  3  2  o 530.9606 17.13337 54.98145       3.532914      52.52516       4.885875      57.67306       5.114557  517.8275 24.29569 542.6149 24.27104 -24.78735      34.34187 
1 1 1 11  3  3  o 526.6395 18.06001 54.10440       3.693681      52.49696       4.366375      58.14922       6.926318  518.2279 21.69563 542.0797 33.05918 -23.85181      39.54250 
1 1 1 11  3  4  o 105.4578 43.70869 0.6472348      2.931932      2.068497       3.649482      -1.939853      4.923791  128.3414 50.29709 116.8577 52.39928 11.48373       72.63251 
1 1 1 11  3  5  o 454.3857 23.74974 40.48126       4.176387      41.90877       7.038824      39.70567       5.188348  458.3945 39.93869 448.7245 29.94488 9.670013       49.91788 
1 1 1 11  3  6  o 731.3808 19.75872 104.3328       5.612165      0.000000       0.000000      104.3328       5.612165  ?        ?        731.3808 19.75872 0.000000       19.75872 
1 1 1 11  3  7  o 696.7094 19.95964 94.64335       5.400481      0.000000       0.000000      94.64335       5.400481  ?        ?        696.7094 19.95964 0.000000       19.95964 
1 1 1 11  3  8  o 429.1891 26.75894 36.14046       4.437901      0.000000       0.000000      36.14046       4.437901  ?        ?        429.1891 26.75894 0.000000       26.75894 
1 1 1 11  3  9  o 390.6792 40.95769 30.35677       6.121761      0.000000       0.000000      30.35677       6.121761  ?        ?        390.6792 40.95769 0.000000       40.95769 
1 1 1 11  3  10 o 753.8158 20.95605 110.6912       6.134831      114.7362       11.02483      108.8770       7.383561  764.8682 37.11565 747.0482 25.45008 17.81995       45.00309 
1 1 1 11  3  11 o 234.1717 51.45854 11.24113       4.551989      9.156879       8.106053      12.20110       5.501292  222.4253 77.00481 243.1983 58.87747 -20.77301      96.93450 
1 1 1 11  3  12 o 715.4130 18.69416 99.58566       5.193865      107.2399       7.769787      93.40231       6.983445  741.5806 26.97881 692.1909 25.97861 49.38971       37.45323 
1 1 1 11  3  13 o 670.5287 19.20518 87.47775       5.001080      87.10319       7.105247      87.84551       7.040388  668.4063 27.37226 671.2844 27.00611 -2.878113      38.45219 
1 1 1 11  3  14 o 532.3400 26.77372 55.37360       5.517441      57.88057       6.609799      49.61259       10.01988  543.6525 31.44104 499.2214 52.46725 44.43106       61.16658 
1 1 1 11  3  15 o 207.0141 50.79652 8.770590       4.053175      13.98655       5.866998      4.008354       5.606014  260.8554 59.26259 166.5627 63.09144 94.29271       86.55972 
1 1 1 11  3  16 o 476.2771 24.45666 44.32027       4.508350      46.52860       6.386057      42.12610       6.365532  486.6609 34.00292 462.6631 35.70376 23.99789       49.30474 
1 1 1 11  3  17 o 521.2264 27.59984 53.16003       5.566871      56.59105       6.702271      45.52726       9.996588  537.0913 32.28251 476.5883 55.02187 60.50299       63.79316 
1 1 1 11  3  18 o 841.3105 25.45696 138.0469       8.317461      138.0469       8.317461      0.000000       0.000000  841.3105 25.45696 ?        ?        0.000000       25.45696 
1 1 1 11  3  19 o 734.8015 19.65420 105.1283       5.608584      117.1247       8.035009      93.72944       7.832345  774.7036 26.70686 692.6990 29.11517 82.00464       39.50885 
1 1 1 11  3  20 o 289.3191 42.13074 16.80229       4.594748      19.45740       6.416557      14.00805       6.582532  308.5415 55.59507 259.4747 65.35766 49.06677       85.80463 
1 1 1 11  3  21 o 553.4647 24.01373 59.77616       5.161519      65.82381       7.219203      53.45179       7.382517  578.7668 32.24677 520.3926 36.76624 58.37415       48.90409 
1 1 1 11  3  22 o 169.4297 56.68364 5.474466       4.386044      1.186288       5.893720      10.79711       6.566242  147.7811 61.66961 228.6090 68.53628 -80.82787      92.19740 
1 1 1 11  3  23 o 540.2141 27.68394 57.33099       5.788423      51.68771       8.957876      61.37661       7.584582  507.6630 45.93365 557.0353 35.24239 -49.37225      57.89582 
1 1 1 11  3  24 o 608.6641 22.89462 72.46311       5.411766      69.92291       7.331399      75.50435       8.021916  595.0748 31.83939 617.8692 33.55718 -22.79443      46.25831 
1 1 1 11  3  25 o 223.1113 70.45113 10.48297       6.828058      0.000000       0.000000      10.48297       6.828058  ?        ?        223.1113 70.45113 0.000000       70.45113 
1 1 1 11  3  26 o 453.9221 29.61782 40.85263       5.192492      42.62001       6.978475      38.66044       7.772042  460.0804 39.43822 434.9124 46.74956 25.16800       61.16286 
1 1 1 11  3  27 o 280.5583 53.78748 16.72747       5.647201      12.27926       6.775427      26.84888       10.22033  235.6796 69.37014 343.3667 78.37126 -107.6871      104.6627 
1 1 1 11  3  28 o 115.0828 51.21849 -1.170574      4.611063      -6.475037      6.406025      4.532660       6.642454  114.2792 54.12947 171.5713 67.66184 -57.29209      86.64943 
1 1 1 11  4  0  o 98.42968 43.04682 -0.5487950     3.125852      0.4162138      3.576495      -3.670619      6.432743  112.8008 47.61435 127.1319 58.14477 -14.33108      75.15279 
1 1 1 11  4  1  f 902.3503 16.67996 158.7792       5.845183      152.1403       6.870073      176.1849       11.12393  882.4533 20.04664 945.9306 30.28106 -63.47729      36.31543 
1 1 1 11  4  2  o 805.3449 16.66156 126.4523       5.211055      123.7784       6.309627      132.1893       9.242214  795.9769 20.41151 820.0358 29.02119 -24.05890      35.48041 
1 1 1 11  4  3  o 465.2685 21.35312 42.30111       3.858274      42.90198       4.681015      41.02795       6.813815  467.1707 25.90243 453.2986 39.08813 13.87213       46.89156 
1 1 1 11  4  4  o 593.2745 18.43474 68.64948       4.247377      68.61761       5.191314      68.71400       7.387046  592.4839 22.56174 589.9890 32.36387 2.494995       39.45190 
1 1 1 11  4  5  o 301.1130 25.81734 17.87559       2.989844      16.42032       3.970757      19.78089       4.543423  286.2795 36.54948 314.2623 37.99926 -27.98276      52.72389 
1 1 1 11  4  6  o 479.7682 24.75147 45.11414       4.595982      0.000000       0.000000      45.11414       4.595982  ?        ?        479.7682 24.75147 0.000000       24.75147 
1 1 1 11  4  7  o 400.0796 25.65053 31.41037       3.964392      35.83637       9.709954      30.52500       4.342844  417.7813 61.70364 393.8738 28.58629 23.90750       68.00379 
1 1 1 11  4  8  o 608.7488 19.30725 72.19602       4.564429      75.08776       10.30662      71.49050       5.090882  615.2548 43.41395 605.5095 21.64931 9.745239       48.51251 
1 1 1 11  4  9  o 306.0807 32.42565 18.54290       3.795670      20.54911       8.572009      18.05360       4.233303  313.0869 72.00230 301.1096 36.97869 11.97723       80.94292 
1 1 1 11  4  10 o 964.7236 16.78068 181.0781       6.286957      179.5082       9.013936      182.5652       8.773152  959.5077 24.19012 967.7804 23.34269 -8.272705      33.61611 
1 1 1 11  4  11 f 1304.236 18.83957 331.0432       9.542341      362.9711       18.19020      318.9210       11.20839  1362.128 34.38679 1279.512 22.55646 82.61584       41.12475 
1 1 1 11  4  12 o 1359.745 19.01822 359.7584       10.04281      348.4623       17.31218      365.4877       12.32935  1335.360 33.38302 1369.843 23.17616 -34.48352      40.63939 
1 1 1 11  4  13 o 556.6039 31.96878 60.68518       6.881353      62.94560       9.554234      58.24865       9.919442  564.7762 43.90544 542.3987 47.57182 22.37750       64.73613 
1 1 1 11  4  14 o 204.8239 49.50712 8.579065       3.894368      3.971674       5.639606      12.77859       5.384202  166.6154 63.23970 249.5568 56.82765 -82.94141      85.02142 
1 1 1 11  4  15 o 530.9556 22.12380 54.89165       4.561901      51.15749       6.420678      58.69839       6.482773  510.7476 32.53973 547.5308 30.61026 -36.78317      44.67463 
1 1 1 11  4  16 o 281.1227 38.98864 15.77595       4.141997      17.29466       5.894125      14.29423       5.821879  291.3952 54.07551 263.5947 58.40838 27.80051       79.59711 
1 1 1 11  4  17 o 383.8842 29.24180 28.94086       4.326667      19.34153       5.995801      39.37059       6.249760  308.9098 51.81372 446.9047 36.32410 -137.9949      63.27797 
1 1 1 11  4  18 o 927.6378 20.58935 167.5805       7.417356      170.6723       8.960302      160.8489       13.22119  935.5634 24.66161 905.7399 37.58711 29.82349       44.95538 
1 1 1 11  4  19 o 780.3943 26.53424 118.8526       8.041716      118.8526       8.041716      0.000000       0.000000  780.3943 26.53424 ?        ?        0.000000       26.53424 
1 1 1 11  4  20 o 804.9734 19.37061 126.1897       6.055540      131.6746       8.516040      120.5798       8.612426  821.2095 26.70273 785.5968 28.22915 35.61267       38.85770 
1 1 1 11  4  21 o 1242.151 24.26950 301.1698       11.70747      301.1698       11.70747      0.000000       0.000000  1242.151 24.26950 ?        ?        0.000000       24.26950 
1 1 1 11  4  22 o 657.4350 21.37751 84.32983       5.458055      79.03000       7.350368      90.84386       8.148969  635.0124 29.80567 680.6028 30.83052 -45.59039      42.88239 
1 1 1 11  4  23 o 263.7932 46.68623 14.25333       4.607766      8.168521       6.157272      21.99828       6.946631  202.8378 67.13625 325.9342 56.95342 -123.0964      88.03958 
1 1 1 11  4  24 o 232.7186 57.95423 11.43482       5.217846      9.194899       7.855509      13.20333       6.980113  216.8156 75.76324 248.3547 69.58613 -31.53912      102.8703 
1 1 1 11  4  25 o 343.5284 37.45900 23.71103       4.916429      21.26339       6.667929      26.62687       7.277791  318.6708 55.91865 358.2496 53.98615 -39.57880      77.72645 
1 1 1 11  4  26 o 475.0948 33.56036 45.01829       6.152223      45.71055       7.107687      42.95014       12.28523  476.6883 38.72907 442.6354 74.08585 34.05292       83.59817 
1 1 1 11  4  27 o 371.0876 35.15268 27.72289       5.005569      24.78689       7.042129      30.72109       7.116344  342.2360 54.83623 384.8445 48.70522 -42.60846      73.34309 
1 1 1 11  4  28 o 747.1187 30.77259 110.9781       8.928564      0.000000       0.000000      110.9781       8.928564  ?        ?        747.1187 30.77259 0.000000       30.77259 
1 1 1 11  5  0  o 505.6754 21.49676 50.01126       4.221559      55.14636       5.061506      38.27441       7.652105  530.4194 24.57154 434.6459 46.03394 95.77353       52.18127 
1 1 1 11  5  1  o 553.0630 19.64719 59.73874       4.219909      54.62053       4.966830      73.02151       8.001372  528.0506 24.22009 607.0591 34.07731 -79.00848      41.80761 
1 1 1 11  5  2  o 141.6572 47.89239 3.786597       3.131378      1.932566       3.591951      9.657508       6.391822  126.2645 49.76816 215.9498 68.16067 -89.68526      84.39636 
1 1 1 11  5  3  o 105.0185 44.62447 0.1601640      3.175402      0.6795983      3.898151      -0.8643139     5.474503  119.6464 50.06058 129.8481 56.87277 -10.20169      75.76658 
1 1 1 11  5  4  o 486.8614 19.04556 46.23737       3.601032      46.14881       4.296282      46.44651       6.602517  485.9202 22.76669 484.0389 35.36865 1.881287       42.06261 
1 1 1 11  5  5  o 1356.093 22.58207 359.1968       11.89272      359.1968       11.89272      0.000000       0.000000  1356.093 22.58207 ?        ?        0.000000       22.58207 
1 1 1 11  5  6  o 677.4156 18.12436 89.41616       4.768106      92.51665       10.68590      88.64540       5.327905  683.2281 40.45350 674.1854 20.34928 9.042725       45.28331 
1 1 1 11  5  7  o 457.5511 26.60067 41.05966       4.706322      15.37272       9.046634      50.59110       5.510743  270.4622 80.30210 507.7833 28.05379 -237.3210      85.06140 
1 1 1 11  5  8  o 677.8406 17.82732 89.45811       4.692904      84.37811       9.989533      90.89674       5.316037  653.7399 39.53300 683.0277 20.04111 -29.28778      44.32272 
1 1 1 11  5  9  o 645.8702 23.06693 81.32786       5.785795      72.92988       10.10105      85.42854       7.058420  607.1132 43.12241 661.3953 27.48011 -54.28204      51.13412 
1 1 1 11  5  10 o 107.9286 47.54803 -1.048755      3.876320      1.712935       5.816149      -3.255825      5.199435  151.3477 62.02261 115.0606 52.48846 36.28706       81.25172 
1 1 1 11  5  11 o 262.3857 52.36506 14.05502       5.148969      14.16447       6.310065      13.83692       8.907296  261.8365 62.85207 261.0641 80.15714 0.7723389      101.8604 
1 1 1 11  5  12 o 1021.349 16.60515 202.8703       6.586353      206.1249       9.587483      199.9617       9.063599  1028.644 24.00002 1013.278 23.03267 15.36603       33.26417 
1 1 1 11  5  13 o 1038.911 19.00086 209.9897       7.666187      220.0825       14.12869      205.7784       9.126489  1061.265 34.28074 1027.994 22.86047 33.27075       41.20400 
1 1 1 11  5  14 o 630.2936 22.91991 77.36115       5.610270      74.47612       10.44561      78.53080       6.651001  614.5468 44.05980 634.6916 26.98338 -20.14484      51.66594 
1 1 1 11  5  15 o 485.5697 27.50835 46.12993       5.166017      41.87006       9.258385      48.05584       6.225221  457.7063 53.07074 494.8986 32.57200 -37.19229      62.26908 
1 1 1 11  5  16 o 811.3568 17.81798 128.0838       5.614336      129.0459       7.977472      127.1397       7.902795  813.5753 25.24873 807.5507 25.19898 6.024658       35.67194 
1 1 1 11  5  17 o 789.3917 18.25873 121.2715       5.597461      120.5574       7.982942      121.9621       7.850724  786.1378 26.14787 790.7848 25.56368 -4.646973      36.56792 
1 1 1 11  5  18 o 1153.566 16.93339 258.9118       7.586025      252.5521       10.62447      265.5262       10.83515  1138.156 24.03686 1167.050 23.90659 -28.89392      33.90126 
1 1 1 11  5  19 o 239.5120 55.78506 11.83355       5.092277      5.613460       5.984634      28.15141       9.693282  181.9821 65.86151 368.5972 70.28117 -186.6151      96.31813 
1 1 1 11  5  20 o 341.0379 41.78107 23.22587       5.417893      22.41298       6.354059      25.39105       10.37005  332.7646 50.77679 346.7398 78.79900 -13.97519      93.74200 
1 1 1 11  5  21 o 1068.383 20.14095 222.4775       8.356704      240.2324       10.56909      192.8653       13.64944  1109.189 24.53603 990.8411 35.47176 118.3477       43.13076 
1 1 1 11  5  22 o 410.0655 30.57603 33.16228       4.834248      30.60178       6.498513      36.33495       7.233756  390.6840 43.57351 425.8578 44.39176 -35.17374      62.20353 
1 1 1 11  5  23 o 1014.084 18.19828 200.5289       7.166912      201.5795       9.913952      199.3788       10.37269  1014.794 25.15597 1008.804 26.47626 5.989685       36.52144 
1 1 1 11  5  24 o 428.8929 30.41386 36.38192       5.032954      32.69197       6.612360      41.46376       7.759914  402.7645 42.93629 453.4589 44.64361 -50.69446      61.94011 
1 1 1 11  5  25 o 447.8148 34.43589 39.96252       5.942869      41.76033       6.944416      35.04323       11.48724  455.9833 39.60909 399.7638 76.78267 56.21951       86.39709 
1 1 1 11  5  26 o 446.5993 52.93586 41.42114       9.002413      41.42114       9.002413      0.000000       0.000000  446.5993 52.93586 ?        ?        0.000000       52.93586 
1 1 1 11  5  27 o 350.2510 37.67666 24.86998       5.044230      24.06622       6.937400      25.77158       7.347489  336.8332 54.92716 348.1008 56.27063 -11.26758      78.63445 
1 1 1 11  6  0  f 137.7694 46.94938 3.554193       3.009511      3.785650       4.041305      3.266037       4.509222  148.5840 54.06866 147.8197 56.44205 0.7643585      78.16089 
1 1 1 11  6  1  o 724.6290 16.49444 102.3613       4.641745      100.7669       5.328105      107.3815       9.454395  718.4842 19.09535 737.8563 32.99392 -19.37213      38.12127 
1 1 1 11  6  2  o 292.5841 28.70012 16.96597       3.219104      17.77037       3.692491      14.41826       6.571386  298.7068 32.34749 260.1139 65.18346 38.59293       72.76842 
1 1 1 11  6  3  o 735.9316 16.00419 105.5139       4.574033      102.3822       5.304029      114.6002       9.034600  724.4645 18.85215 763.6635 30.46344 -39.19904      35.82491 
1 1 1 11  6  4  o 728.9325 19.48315 103.6413       5.515368      95.07417       7.004686      117.6177       8.946768  696.9566 25.87945 774.2080 29.75641 -77.25140      39.43589 
1 1 1 11  6  5  o 598.2101 24.60478 69.94962       5.716118      69.94962       5.716118      0.000000       0.000000  598.2101 24.60478 ?        ?        0.000000       24.60478 
1 1 1 11  6  6  f 443.0349 24.08214 38.44438       4.127874      36.98569       9.340704      38.79839       4.601595  425.8608 57.98622 444.6273 26.77407 -18.76654      63.86903 
1 1 1 11  6  7  o 954.4673 16.18160 177.3107       5.998057      174.7043       13.11584      178.0000       6.744654  943.1466 35.80873 956.0303 18.16603 -12.88367      40.15308 
1 1 1 11  6  8  o 408.4428 24.56989 32.66745       3.879154      47.76662       9.409435      29.57572       4.257823  488.5918 50.30870 387.9855 28.45667 100.6063       57.79920 
1 1 1 11  6  9  o 790.4047 17.24823 121.5714       5.294463      133.5270       11.61874      118.4382       5.947886  825.3337 36.24945 779.9047 19.63781 45.42902       41.22701 
1 1 1 11  6  10 o 828.1582 26.08403 133.7678       8.389111      150.4649       12.14760      118.5438       11.59937  876.6358 35.68151 777.6004 38.41048 99.03540       52.42648 
1 1 1 11  6  11 o 373.1076 29.28631 27.33351       4.209433      23.58580       6.288896      30.37539       5.665814  342.8727 48.58923 392.1068 37.67113 -49.23416      61.48193 
1 1 1 11  6  12 f 1243.197 16.21241 300.5449       7.827360      310.9070       11.49996      291.6008       10.68413  1263.446 23.43752 1223.738 22.48137 39.70789       32.47660 
1 1 1 11  6  13 o 525.3960 22.22790 53.74464       4.535374      51.43164       6.771600      55.62628       6.107638  511.9002 34.26040 533.1500 29.61486 -21.24982      45.28592 
1 1 1 11  6  14 o 1172.589 16.41673 267.3895       7.475845      262.2581       10.60941      272.4500       10.53585  1160.359 23.54350 1182.784 22.93698 -22.42529      32.86946 
1 1 1 11  6  15 o 947.3217 19.62567 174.6659       7.220212      170.9897       13.17074      176.2454       8.633037  934.6645 36.28494 951.1310 23.37197 -16.46649      43.16070 
1 1 1 11  6  16 o 595.4225 24.14950 69.10414       5.584206      63.38199       10.35513      71.45058       6.631024  565.2285 47.61761 605.0262 28.22139 -39.79767      55.35236 
1 1 1 11  6  17 o 1041.855 16.81366 211.1831       6.802955      207.1086       9.545004      215.3896       9.698496  1030.741 23.84507 1051.161 23.75786 -20.41931      33.66041 
1 1 1 11  6  18 o 245.5970 46.53542 12.26968       4.276014      16.13360       6.059800      8.437737       6.034673  280.0932 57.63168 207.0486 66.32285 73.04462       87.86428 
1 1 1 11  6  19 o 502.1469 24.47183 49.18280       4.772273      54.71957       6.642790      43.27716       6.860499  527.7656 32.56933 468.0511 38.07279 59.71451       50.10288 
1 1 1 11  6  20 f 645.9800 21.21625 81.33350       5.322501      75.28724       7.206573      88.58956       7.894714  620.3565 29.91296 672.8831 30.21126 -52.52655      42.51477 
1 1 1 11  6  21 o 731.0131 23.49578 104.3233       6.670263      110.6251       7.939765      89.20634       12.29726  752.0863 27.18391 668.8450 47.65451 83.24133       54.86272 
1 1 1 11  6  22 o 364.0566 38.71590 26.45534       5.389769      35.90571       6.373775      2.738696       10.09715  424.6155 39.09105 193.3475 80.70475 231.2680       89.67367 
1 1 1 11  6  23 o 508.8604 29.79620 51.04203       5.862586      49.83955       6.940469      54.03685       10.95306  501.1242 35.90066 514.3723 55.72237 -13.24811      66.28605 
1 1 1 11  6  24 o 432.9601 34.60291 37.29546       5.769585      39.90037       6.777448      30.43839       10.99612  446.3280 39.50889 372.9331 78.41204 73.39490       87.80319 
1 1 1 11  6  25 o 422.5855 31.03858 35.46220       5.058188      34.69770       6.787676      36.41693       7.585321  413.8776 42.85074 422.3628 47.04385 -8.485168      63.63419 
1 1 1 11  6  26 o 518.1083 27.12565 53.08295       5.438960      55.20377       7.341541      50.50280       8.097625  524.7153 36.24989 498.9908 42.18177 25.72458       55.61795 
1 1 1 11  6  27 o 380.2924 39.15448 29.39446       5.699996      30.00968       8.894188      28.96568       7.425239  371.3375 63.98486 370.8179 53.07494 0.5195923      83.13249 
1 1 1 11  7  0  o 207.8028 39.26047 8.836187       3.052251      14.79059       4.210535      2.242007       4.430967  269.7592 41.52315 138.4600 55.05291 131.2992       68.95647 
1 1 1 11  7  1  o 752.4768 16.52893 110.3613       4.830208      110.4780       5.666945      110.0513       9.236012  752.3428 19.39569 747.6369 31.81015 4.705872       37.25693 
1 1 1 11  7  2  o 236.9287 47.41304 11.58591       4.210299      12.26533       5.315544      10.44198       6.897307  241.6222 57.48298 224.6761 70.79277 16.94614       91.19160 
1 1 1 11  7  3  o 688.4811 20.31934 92.49865       5.432874      90.36988       7.001113      95.72093       8.613614  679.3279 26.53748 697.8782 31.78175 -18.55029      41.40431 
1 1 1 11  7  4  o 546.0744 18.20774 58.11835       3.861321      57.66652       4.461246      59.46759       7.709297  543.5983 21.13246 548.1863 36.41974 -4.587952      42.10675 
1 1 1 11  7  5  o 1016.638 15.40336 201.1798       6.081488      193.2835       8.240210      210.6260       9.012650  995.3843 21.31668 1038.845 22.33952 -43.46039      30.87807 
1 1 1 11  7  6  o 785.6152 14.40076 120.0753       4.393630      121.6004       6.694084      118.9212       5.823536  789.6034 21.83002 781.2472 19.19421 8.356201       29.06833 
1 1 1 11  7  7  o 931.0335 16.27621 168.6916       5.885004      178.7682       13.57744      166.3606       6.530313  954.1402 36.64186 924.3229 18.19208 29.81726       40.90939 
1 1 1 11  7  8  o 1268.018 24.57722 313.6437       12.10281      309.7641       16.95719      317.6721       17.27926  1257.293 34.72879 1273.167 34.94714 -15.87476      49.26856 
1 1 1 11  7  9  o 364.5679 26.84932 26.07490       3.774614      24.17504       9.509142      26.43024       4.112488  340.3425 74.04984 366.7312 29.11494 -26.38867      79.56795 
1 1 1 11  7  10 f 489.6721 21.22885 46.69058       4.037010      50.64169       9.627840      45.84772       4.446805  504.4606 49.79410 485.0713 23.60557 19.38925       55.10604 
1 1 1 11  7  11 o 774.2988 15.14470 116.5704       4.554046      111.1901       7.951199      119.1970       5.555541  755.1220 27.11362 782.7382 18.27603 -27.61621      32.69804 
1 1 1 11  7  12 o 942.9248 16.93515 172.9178       6.201461      171.1710       9.159609      174.3962       8.426560  937.2550 25.16467 946.3238 22.92887 -9.068787      34.04399 
1 1 1 11  7  13 o 1442.560 16.61445 404.6972       9.307821      399.9100       13.29507      409.2992       13.03527  1432.833 23.89279 1449.695 23.15343 -16.86206      33.27081 
1 1 1 11  7  14 o 1024.760 16.64349 204.2433       6.623609      207.7543       9.679827      201.1518       9.083026  1032.607 24.13819 1016.224 23.01513 16.38330       33.35188 
1 1 1 11  7  15 o 551.4694 21.63635 59.22873       4.633758      54.73812       6.680501      63.39247       6.432764  528.1491 32.73177 569.0947 29.20453 -40.94562      43.86654 
1 1 1 11  7  16 o 486.9309 27.88922 46.43161       5.251952      46.53817       10.01315      46.39117       6.168555  481.8601 54.46444 485.9192 32.88177 -4.059113      63.62064 
1 1 1 11  7  17 o 331.0042 74.77012 22.92702       9.384603      22.92702       9.384603      0.000000       0.000000  331.0042 74.77012 ?        ?        0.000000       74.77012 
1 1 1 11  7  18 o 525.2726 23.44717 53.79024       4.783031      56.40761       6.840223      51.28604       6.690708  535.8569 33.03052 510.6915 33.92842 25.16534       47.35138 
1 1 1 11  7  19 o 326.2522 34.82110 21.09430       4.343723      20.96669       5.908385      21.24440       6.407875  322.2016 48.74152 323.3284 52.85891 -1.126740      71.90132 
1 1 1 11  7  20 o 444.2769 27.82826 38.73776       4.777174      45.36325       6.567927      31.29532       6.961092  479.3966 35.53104 395.2046 46.22875 84.19196       58.30568 
1 1 1 11  7  21 o 128.1051 53.14293 0.9630600      4.339787      2.253327       5.802411      -0.6750838     6.537996  153.8285 62.36127 144.0185 62.63467 9.809967       88.38568 
1 1 1 11  7  22 f 311.6123 51.87504 19.93370       6.057003      19.93370       6.057003      0.000000       0.000000  311.6123 51.87504 ?        ?        0.000000       51.87504 
1 1 1 11  7  23 o 353.2169 39.91800 25.05795       5.379596      24.82870       6.292519      25.68055       10.37008  349.1740 47.64777 342.8127 79.44587 6.361328       92.63885 
1 1 1 11  7  24 o 361.6075 39.54461 26.32034       5.462801      26.35364       6.398142      26.23076       10.49361  359.2932 46.97900 344.0999 80.03606 15.19330       92.80517 
1 1 1 11  7  25 o 353.6203 35.72581 25.10707       4.838942      27.33137       6.408696      22.15720       7.380293  365.2470 46.21500 322.0562 61.24673 43.19077       76.72672 
1 1 1 11  7  26 o 433.8910 30.72458 37.50119       5.143717      45.41449       6.901917      27.61535       7.714321  474.7567 37.74601 360.8385 56.93817 113.9182       68.31337 
1 1 1 11  7  27 o 252.1882 56.55357 13.77847       5.402128      9.136905       8.286504      17.20916       7.124103  211.5463 77.35551 277.7163 66.85748 -66.16997      102.2438 
1 1 1 11  8  0  o 1103.204 15.67564 237.1043       6.715975      233.4748       7.798890      247.5193       13.21107  1094.061 18.35538 1122.132 30.31559 -28.07141      35.43946 
1 1 1 11  8  1  o 748.4146 20.03644 109.3188       5.823589      108.9958       7.447148      109.8272       9.343276  746.0854 25.70238 747.1544 32.20037 -1.068970      41.20044 
1 1 1 11  8  2  o 449.8480 22.63268 39.63408       3.941304      34.12499       4.454475      59.49671       8.458145  416.4040 27.70380 546.8952 40.10345 -130.4912      48.74205 
1 1 1 11  8  3  o 373.6278 24.60514 27.40600       3.550226      25.67896       4.101070      32.57078       7.092042  360.7291 29.53327 402.3299 46.23002 -41.60080      54.85826 
1 1 1 11  8  4  o 289.4755 32.91428 16.65702       3.634404      14.26949       4.703352      20.19544       5.725819  264.2491 47.58162 315.3770 48.28696 -51.12790      67.79116 
1 1 1 11  8  5  o 734.0888 16.79860 104.9176       4.789054      99.68629       6.354333      111.7963       7.286437  714.7416 22.89248 756.5891 24.79860 -41.84741      33.74961 
1 1 1 11  8  6  o 498.9292 24.12022 48.57900       4.673563      47.23958       5.212826      54.06650       10.55121  490.8900 27.45397 518.8958 53.10767 -28.00577      59.78415 
1 1 1 11  8  7  o 553.7467 35.72555 60.38049       7.641788      52.86331       10.59506      68.53114       11.03245  513.3022 53.95753 586.6864 48.86586 -73.38422      72.79620 
1 1 1 11  8  8  o 614.5102 18.70336 73.50983       4.463511      66.26117       10.62099      75.06464       4.918975  577.5658 47.78079 620.8273 20.40215 -43.26154      51.95432 
1 1 1 11  8  9  f 582.4837 19.13451 66.03932       4.328418      62.99131       10.67719      66.63875       4.734940  563.0544 49.32648 584.9911 20.84189 -21.93677      53.54891 
1 1 1 11  8  10 o 454.4304 22.19987 40.21699       3.917833      37.94601       9.627688      40.66768       4.289014  433.9518 58.62947 456.1969 24.29657 -22.24518      63.46447 
1 1 1 11  8  11 o 315.8440 29.96894 19.64172       3.631955      7.914693       9.182729      21.81646       3.954408  220.1561 81.28499 332.8762 30.94359 -112.7201      86.97560 
1 1 1 11  8  12 o 853.5096 17.10655 141.6854       5.670207      135.7075       8.239197      147.0640       7.815348  834.4865 25.42363 868.9680 23.15882 -34.48151      34.39029 
1 1 1 11  8  13 o 594.4738 20.41682 68.78697       4.713557      62.95108       7.017227      73.58494       6.362687  566.8198 32.00901 614.3369 26.66895 -47.51709      41.66306 
1 1 1 11  8  14 o 1344.058 16.58417 351.3791       8.656444      334.6866       12.02424      369.3384       12.47216  1310.593 23.62446 1376.828 23.32566 -66.23560      33.19942 
1 1 1 11  8  15 o 698.2326 18.97328 94.89420       5.144823      95.95640       7.525422      93.96209       7.049619  701.1885 27.63555 694.0471 26.15464 7.141357       38.04982 
1 1 1 11  8  16 o 565.2058 21.54677 62.23331       4.729516      60.00518       6.845368      64.26834       6.542030  553.0087 32.01093 572.8133 29.50867 -19.80457      43.53689 
1 1 1 11  8  17 o 802.6688 18.19658 125.4025       5.672235      125.5420       8.127860      125.2701       7.919692  802.1069 26.09252 801.3334 25.44879 0.7734985      36.44805 
1 1 1 11  8  18 o 412.7867 33.68770 33.58567       5.353301      42.27373       9.873600      29.96834       6.371004  457.8287 56.74847 387.8767 43.01931 69.95197       71.21130 
1 1 1 11  8  19 o 582.5778 26.32776 66.27961       5.956565      70.89906       11.17953      64.44833       7.038902  596.5915 48.67661 572.8752 31.76295 23.71631       58.12312 
1 1 1 11  8  20 o 735.1328 19.77519 105.3276       5.645656      101.9493       7.794078      109.0568       8.188871  721.9427 27.79931 746.5966 28.24295 -24.65387      39.62910 
1 1 1 11  8  21 o 482.2790 28.73260 45.73509       5.357069      39.79249       6.508447      58.21830       9.433055  447.6385 37.79211 539.6315 45.43463 -91.99304      59.09779 
1 1 1 11  8  22 o 279.1555 47.03920 15.94997       4.918279      14.30339       5.807396      20.12660       9.249169  260.8861 58.73478 304.6169 77.88236 -43.73077      97.54710 
1 1 1 11  8  23 o 536.8107 27.80225 56.74353       5.776142      62.94730       6.904490      42.27760       10.54332  564.3377 31.63138 450.5124 61.89734 113.8253       69.51133 
1 1 1 11  8  24 o 494.4239 29.59894 48.35116       5.657207      55.22638       6.782219      32.62825       10.25640  527.2805 33.29184 388.9093 70.50386 138.3712       77.96885 
1 1 1 11  8  25 o 501.9808 30.66821 50.04108       5.949975      52.18139       6.966818      44.27210       11.43788  510.8111 35.33648 453.7464 66.91763 57.06467       75.67454 
1 1 1 11  8  26 o 434.0824 34.11725 37.79603       5.705065      54.88187       8.704058      24.92704       7.553981  518.6215 43.62098 340.7924 59.22617 177.8291       73.55630 
1 1 1 11  8  27 o 213.5642 60.07008 9.979883       5.191092      22.13280       7.947860      0.9384512      6.855331  315.3582 66.96500 151.1386 64.92552 164.2196       93.27184 
1 1 1 11  9  0  o 83.56264 39.85908 -4.641961      3.597803      -5.121159      4.214086      -3.353554      6.909913  91.54403 43.51744 134.8939 61.13583 -43.34988      75.04237 
1 1 1 11  9  1  o 361.1763 27.31617 25.69140       3.803157      26.20912       4.399603      24.16083       7.564706  363.9981 31.43167 341.5345 59.17743 22.46365       67.00685 
1 1 1 11  9  2  o 340.3231 26.99870 22.80728       3.539012      19.81628       4.082289      31.85480       7.100032  315.7565 33.81667 397.7476 46.86419 -81.99103      57.79117 
1 1 1 11  9  3  o 513.6569 19.73627 51.43656       3.937008      50.35558       4.545276      54.68401       7.878120  507.8646 23.04540 525.2537 38.89770 -17.38910      45.21196 
1 1 1 11  9  4  f 867.5684 16.26915 146.5167       5.481464      148.2661       7.388645      144.3753       8.174747  871.8664 21.82161 859.8542 24.48057 12.01221       32.79453 
1 1 1 11  9  5  o 607.0978 21.81999 71.86475       5.144475      68.78934       5.707095      85.19616       11.88235  593.6129 24.75619 654.4974 47.06255 -60.88452      53.17662 
1 1 1 11  9  6  o 404.6214 23.83892 32.04435       3.729413      35.31224       4.841908      27.27783       5.847686  423.9512 29.59413 370.0688 41.39791 53.88245       50.88811 
1 1 1 11  9  7  o 535.2863 21.48690 55.82692       4.466712      60.62974       10.16788      54.67842       4.972172  552.1725 47.89058 529.5129 24.17918 22.65967       53.64830 
1 1 1 11  9  8  o 1357.982 16.01094 358.7028       8.443817      338.4173       17.75269      364.6338       9.599149  1314.823 34.76713 1368.842 18.05724 -54.01880      39.17675 
1 1 1 11  9  9  o 961.8651 15.81113 179.9270       5.906158      154.4603       12.75190      186.8820       6.664023  888.1448 36.97118 980.1081 17.50792 -91.96332      40.90715 
1 1 1 11  9  10 o 965.8373 15.74990 181.3988       5.907583      170.5961       12.98283      184.2195       6.634186  933.8286 35.79928 973.1473 17.55420 -39.31873      39.87152 
1 1 1 11  9  11 f 402.1608 23.77460 31.61524       3.696636      42.25299       9.825493      29.86121       3.989778  459.1077 56.28661 390.4860 26.46594 68.62170       62.19830 
1 1 1 11  9  12 o 435.7349 22.72696 37.07735       3.832519      46.55168       9.511891      35.24117       4.187466  483.3374 51.46606 424.4587 25.52179 58.87875       57.44665 
1 1 1 11  9  13 o 568.8909 27.80923 63.14175       6.143924      0.000000       0.000000      63.14175       6.143924  ?        ?        568.8909 27.80923 0.000000       27.80923 
1 1 1 11  9  14 o 1675.395 24.21909 547.1547       15.75807      0.000000       0.000000      547.1547       15.75807  ?        ?        1675.395 24.21909 0.000000       24.21909 
1 1 1 11  9  15 o 956.2160 16.75335 177.8935       6.221365      175.0392       8.967253      180.5424       8.638625  947.4806 24.37031 962.4593 23.11183 -14.97870      33.58673 
1 1 1 11  9  16 o 1062.875 16.77678 219.8088       6.924986      200.7035       9.457354      241.8935       10.16804  1014.556 24.00301 1113.904 23.50508 -99.34778      33.59514 
1 1 1 11  9  17 o 1132.620 16.84338 249.6210       7.408686      261.4327       10.80978      239.1577       10.17403  1157.844 24.04024 1107.495 23.65500 50.34875       33.72673 
1 1 1 11  9  18 o 649.8204 20.01416 82.25502       5.050784      87.76231       7.184311      76.87294       7.102172  670.2654 27.60008 627.0869 29.16322 43.17853       40.15293 
1 1 1 11  9  19 o 578.2636 26.36948 65.33008       5.921823      60.38824       10.97287      67.36088       7.034120  548.8285 52.10687 585.6944 31.03579 -36.86591      60.64938 
1 1 1 11  9  20 o 780.0089 26.99486 119.0252       8.177276      132.5321       13.28656      110.7894       10.37499  817.7623 41.97816 750.4803 35.59756 67.28192       55.03955 
1 1 1 11  9  21 o 385.7614 34.52708 29.52911       5.117869      28.56234       6.280702      31.43956       8.829043  376.9145 43.71989 390.0981 60.21766 -13.18359      74.41502 
1 1 1 11  9  22 f 328.0269 35.46299 21.48835       4.445751      21.36822       5.946408      21.64060       6.694316  323.1974 48.90471 323.1194 55.33802 0.7794189E-01  73.85098 
1 1 1 11  9  23 o 680.6031 20.83293 90.56588       5.506456      90.66620       7.419583      90.44287       8.215747  679.0708 28.13432 677.2578 31.23669 1.812988       42.03892 
1 1 1 11  9  24 o 353.3305 38.75485 25.18527       5.230545      25.69732       6.158971      23.86045       9.906694  354.3799 45.82523 326.4112 79.00172 27.96866       91.33031 
1 1 1 11  9  25 o 398.1357 40.81464 32.18216       6.221468      43.45894       7.900442      13.77300       10.09429  461.3592 44.65312 249.6413 85.95939 211.7179       96.86546 
1 1 1 11  9  26 o 244.1937 64.87817 13.21968       6.257187      9.730455       7.763870      19.68642       10.56954  214.5582 75.30058 287.8766 87.10094 -73.31841      115.1380 
1 1 1 11  10 0  o 505.5274 23.68879 49.93288       4.650671      52.78943       5.692908      44.20180       8.063640  518.3322 28.38915 469.9380 44.72315 48.39420       52.97267 
1 1 1 11  10 1  o 365.0078 26.54025 26.19678       3.736391      23.06242       4.339736      35.17695       7.345668  341.1027 33.18045 418.6624 45.93385 -77.55972      56.66446 
1 1 1 11  10 2  o 720.6094 17.41706 101.1352       4.874194      100.7782       5.625790      102.2099       9.761120  718.9719 20.14854 721.1868 34.85170 -2.214905      40.25673 
1 1 1 11  10 3  o 353.8253 31.21629 24.71538       4.245446      24.71538       4.245446      0.000000       0.000000  353.8253 31.21629 ?        ?        0.000000       31.21629 
1 1 1 11  10 4  o 238.9764 41.48603 11.56457       3.710562      15.38276       4.804402      5.920390       5.841314  275.2958 46.60056 183.0872 65.20884 92.20862       80.14864 
1 1 1 11  10 5  o 655.3815 18.14661 83.62489       4.618678      89.70599       6.238640      76.24940       6.870589  678.1622 23.68800 624.6291 28.32330 53.53314       36.92330 
1 1 1 11  10 6  o 445.5459 22.05970 38.68586       3.816981      32.82347       4.815910      48.59016       6.259693  408.6053 30.57065 497.2330 32.59682 -88.62769      44.68912 
1 1 1 11  10 7  o 341.0759 31.39659 22.93007       4.112047      28.01539       9.586564      21.78346       4.552080  368.2471 69.58399 331.5853 35.92427 36.66174       78.31019 
1 1 1 11  10 8  o 258.7287 40.47846 13.43785       3.933897      0.2967646      9.357903      16.25866       4.335604  178.5375 76.25215 285.1797 40.26773 -106.6422      86.23155 
1 1 1 11  10 9  o 723.0709 16.79889 101.6938       4.717257      103.3505       11.27399      101.3422       5.193765  724.9636 40.20111 721.6876 18.53127 3.276001       44.26666 
1 1 1 11  10 10 o 1152.792 15.47134 258.4083       6.926387      263.7260       15.99234      257.1804       7.684520  1161.150 35.46467 1149.859 17.20854 11.29041       39.41924 
1 1 1 11  10 11 o 1068.930 15.61515 222.1871       6.482216      212.9645       14.41196      224.5260       7.257789  1043.388 35.56717 1074.356 17.39514 -30.96875      39.59311 
1 1 1 11  10 12 o 329.1306 27.24777 21.27362       3.451468      26.95133       8.923586      20.27482       3.742760  362.5530 65.80163 320.8058 30.40450 41.74725       72.48647 
1 1 1 11  10 13 o 519.7924 18.22854 52.57859       3.679677      50.95747       6.815885      53.24543       4.371461  509.1075 34.68004 522.8524 21.52878 -13.74493      40.81904 
1 1 1 11  10 14 o 284.4702 36.80877 16.11833       3.971093      17.01904       6.208802      15.49480       5.165880  287.9172 57.54026 276.0237 50.03386 11.89352       76.25136 
1 1 1 11  10 15 o 769.0558 18.16580 115.1210       5.425508      112.3873       7.898535      117.5631       7.465425  758.8019 26.80342 776.3735 24.76029 -17.57159      36.48966 
1 1 1 11  10 16 f 220.6228 48.80199 9.983853       4.070486      11.92245       5.950259      8.278657       5.580581  239.9297 63.03932 203.7703 63.59322 36.15938       89.54358 
1 1 1 11  10 17 o 438.0798 25.98544 37.59057       4.401155      36.27818       6.363523      38.79398       6.093593  428.0660 38.69725 443.3915 35.69044 -15.32550      52.64299 
1 1 1 11  10 18 o 996.8156 17.08849 193.4187       6.615255      187.4010       9.223902      199.7923       9.492653  979.9661 24.23682 1011.863 24.15672 -31.89667      34.21944 
1 1 1 11  10 19 o 636.7874 23.05425 79.14343       5.701295      77.82993       7.250086      81.27192       9.229160  630.4335 29.61255 641.6342 37.19754 -11.20068      47.54535 
1 1 1 11  10 20 o 384.8047 44.44566 29.75000       6.519799      29.30982       10.33671      30.04082       8.401885  371.5800 74.22852 382.2098 58.46245 -10.62982      94.48668 
1 1 1 11  10 21 o 545.0502 29.36080 58.49202       6.191954      60.50872       11.76678      57.71972       7.281685  544.5671 56.45926 539.8973 34.91602 4.669739       66.38355 
1 1 1 11  10 22 o 554.9402 23.46763 60.28687       5.057587      55.93678       6.683562      66.11541       7.736402  531.6180 32.52930 577.4114 34.66095 -45.79346      47.53459 
1 1 1 11  10 23 o 591.7012 22.33125 68.56349       5.131491      78.10143       6.947401      57.11311       7.612114  629.8743 28.40145 534.9703 36.86434 94.90393       46.53624 
1 1 1 11  10 24 o 607.6862 25.20855 72.61704       5.949154      72.75751       8.740473      72.49580       8.120450  602.6305 37.53329 602.8212 34.83521 -0.1907349     51.20781 
1 1 1 11  10 25 o 231.1964 62.31901 11.69984       5.722365      13.08743       7.131025      9.190337       9.589935  242.2808 71.12580 217.7342 82.50792 24.54659       108.9332 
1 1 1 11  10 26 o 361.6498 35.32434 26.42702       4.897895      35.30004       6.568920      15.31828       7.350054  415.6830 41.23562 259.9804 70.85954 155.7025       81.98445 
1 1 1 11  11 0  o 451.2510 24.00709 39.87909       4.191994      40.31637       4.946802      38.76511       7.895554  452.9889 28.26058 439.6371 46.97153 13.35175       54.81775 
1 1 1 11  11 1  o 343.2567 30.53846 23.26012       4.028413      25.62251       4.747806      17.18793       7.611846  359.6365 34.41409 285.5890 69.32856 74.04752       77.40012 
1 1 1 11  11 2  o 429.0845 28.19053 36.15881       4.671439      36.15881       4.671439      0.000000       0.000000  429.0845 28.19053 ?        ?        0.000000       28.19053 
1 1 1 11  11 3  o 188.9606 50.14402 7.331750       3.740704      5.170188       4.909921      10.32217       5.775062  170.1752 59.87245 223.7054 63.51221 -53.53018      87.28409 
1 1 1 11  11 4  o 156.0098 50.98295 4.659369       3.554956      7.856325       4.515221      -0.5541559     5.766022  196.2850 56.30435 136.4123 59.07285 59.87267       81.60748 
1 1 1 11  11 5  o 1134.107 15.58135 250.1995       6.862574      246.8065       9.330620      254.1978       10.12872  1125.505 21.34692 1141.956 22.83902 -16.45093      31.26198 
1 1 1 11  11 6  o 644.1748 18.12461 80.75874       4.534198      76.46358       5.794160      87.54436       7.282770  626.2950 23.82229 669.6414 28.00440 -43.34631      36.76613 
1 1 1 11  11 7  o 959.1112 14.15047 178.8531       5.270693      190.4381       8.227981      170.7910       6.863864  988.8624 21.42542 936.7754 18.86710 52.08698       28.54849 
1 1 1 11  11 8  o 467.9611 24.18605 42.78845       4.380420      51.87295       10.73116      40.97210       4.798388  509.3036 55.13544 457.5223 27.12670 51.78134       61.44734 
1 1 1 11  11 9  o 600.4372 18.86646 70.15536       4.399323      62.52417       10.44680      71.80041       4.850377  561.5214 48.37814 607.3141 20.56525 -45.79272      52.56780 
1 1 1 11  11 10 o 1074.327 19.00287 224.6033       7.928370      222.7972       14.95562      225.3093       9.350392  1066.981 36.09274 1075.562 22.38549 -8.580933      42.47112 
1 1 1 11  11 11 o 168.0253 47.78410 5.700830       3.266127      -12.01821      9.231175      8.236403       3.492006  133.1272 63.59671 200.7237 45.80745 -67.59648      78.37642 
1 1 1 11  11 12 o 397.2166 23.27843 30.85263       3.575268      22.65828       9.380715      32.24523       3.867155  329.2950 75.02749 405.9449 24.64658 -76.64996      78.97201 
1 1 1 11  11 13 f 202.1585 44.13445 8.349833       3.367770      13.80621       9.555215      7.575878       3.598701  261.5897 83.42023 192.2469 48.27080 69.34283       96.37948 
1 1 1 11  11 14 o 744.0369 18.20616 107.7564       5.260668      101.2606       7.808092      113.1561       7.118985  720.0814 27.92128 761.7605 24.06421 -41.67908      36.86033 
1 1 1 11  11 15 o 529.0972 22.38674 54.56324       4.599962      55.55521       6.918774      53.77740       6.158122  531.5877 33.68814 523.5786 30.41685 8.009155       45.38806 
1 1 1 11  11 16 o 418.3825 26.60237 34.31162       4.299915      25.97489       6.364690      41.31162       5.832145  359.8803 46.63654 458.1644 32.99869 -98.28415      57.13038 
1 1 1 11  11 17 o 483.4607 24.53977 45.72807       4.592331      40.80669       6.483941      50.68175       6.505185  454.3834 37.06715 507.5219 33.18753 -53.13855      49.75325 
1 1 1 11  11 18 o 674.1823 21.88051 88.64855       5.728787      90.38209       7.461228      86.15880       8.941723  679.7411 28.26434 661.5026 34.93044 18.23846       44.93337 
1 1 1 11  11 19 o 639.6555 22.47021 79.87703       5.581891      80.39779       7.022183      78.98322       9.199679  640.7478 28.22000 631.9444 37.65659 8.803406       47.05728 
1 1 1 11  11 20 o 373.2633 31.20000 27.55969       4.481230      19.76831       6.037673      37.11633       6.686748  310.1988 51.95631 431.1397 40.40780 -120.9409      65.81982 
1 1 1 11  11 21 o 625.2587 26.51063 76.66118       6.437359      84.44418       12.24150      73.68627       7.568298  646.9460 49.08949 610.8441 32.01502 36.10193       58.60665 
1 1 1 11  11 22 o 142.4326 59.42950 1.303356       5.472263      -9.962537      10.17148      5.892518       6.491843  144.7439 68.45498 184.0543 68.26770 -39.31041      96.67762 
1 1 1 11  11 23 o 197.0840 57.34900 8.199007       4.654305      9.889957       6.561258      6.486313       6.603305  216.3058 69.14208 188.1917 69.01745 28.11411       97.69358 
1 1 1 11  11 24 o 366.9865 35.97344 27.11707       5.061044      23.83759       7.180819      30.35411       7.134203  334.9514 57.26042 382.8881 49.11032 -47.93668      75.43592 
1 1 1 11  11 25 o 220.7493 52.83648 10.47465       4.469282      10.61837       5.804734      10.26542       7.003835  219.8766 64.06411 217.2563 71.58826 2.620300       96.06815 
1 1 1 11  12 0  o 732.9536 21.62293 104.7633       6.154873      104.7633       6.154873      0.000000       0.000000  732.9536 21.62293 ?        ?        0.000000       21.62293 
1 1 1 11  12 1  o 385.8509 27.16967 29.23652       4.045295      26.23221       4.775368      36.87099       7.612432  364.1500 34.16698 429.3891 46.38743 -65.23917      57.61229 
1 1 1 11  12 2  o 794.3581 17.18621 122.8256       5.301812      121.5205       6.327018      125.9026       9.715159  789.7032 20.63038 802.0112 31.19188 -12.30804      37.39713 
1 1 1 11  12 3  o 1879.578 17.92621 687.7117       13.08510      668.7146       17.78485      710.1313       19.32064  1851.344 24.73632 1907.307 26.08392 -55.96301      35.94797 
1 1 1 11  12 4  o 246.0541 41.88496 12.22659       3.858972      15.59170       5.030230      7.413454       6.015916  277.1383 48.50422 197.6150 66.38400 79.52325       82.21614 
1 1 1 11  12 5  o 192.6812 48.04635 7.607781       3.582919      8.762945       4.676009      5.965159       5.575996  206.8406 56.57779 182.4100 63.82605 24.43059       85.29250 
1 1 1 11  12 6  f 90.58173 41.23171 -1.973636      3.186376      -3.124797      3.926572      0.2462652      5.452711  96.70092 44.66123 137.7496 58.50316 -41.04870      73.60194 
1 1 1 11  12 7  o 269.3803 33.45598 14.40355       3.424632      14.36994       4.308870      14.46119       5.642931  267.2403 42.97415 265.4004 56.48299 1.839844       70.97257 
1 1 1 11  12 8  o 552.2579 21.39187 59.39006       4.587950      58.78049       11.28931      59.51066       5.021307  542.6965 54.29365 552.6649 23.39521 -9.968323      59.11968 
1 1 1 11  12 9  o 85.38184 40.41608 -4.187603      3.560095      6.290231       9.133285      -6.064815      3.865876  209.1846 80.21956 82.75510 39.95009 126.4295       89.61689 
1 1 1 11  12 10 o 1017.791 19.31690 201.6338       7.635266      182.7376       14.12222      209.4388       9.076165  965.6732 37.65693 1036.851 22.54021 -71.17786      43.88742 
1 1 1 11  12 11 o 663.2892 17.16387 85.60106       4.421261      63.66504       10.78030      90.03684       4.847715  565.8056 49.56057 680.1597 18.35263 -114.3541      52.84949 
1 1 1 11  12 12 o 402.9414 22.97513 31.74845       3.580346      36.88626       9.825679      30.96182       3.844676  426.1883 61.11456 397.6422 25.02420 28.54605       66.03939 
1 1 1 11  12 13 o 834.9910 16.00388 135.6413       5.189614      142.5117       13.26755      134.4003       5.638884  851.5887 40.11740 831.0099 17.47265 20.57874       43.75728 
1 1 1 11  12 14 o 186.8680 46.00740 7.159654       3.316506      8.291600       9.885737      7.016097       3.520535  225.1716 84.09972 185.0656 48.42466 40.10599       97.04489 
1 1 1 11  12 15 o 347.9536 30.70068 23.86243       4.106024      36.24519       6.738745      16.55045       5.178309  427.3350 41.11266 285.6064 48.41602 141.7286       63.51662 
1 1 1 11  12 16 o 354.0349 33.55469 24.77805       4.558383      41.14104       6.619080      10.01667       6.286800  456.1256 37.70480 221.8361 67.18778 234.2895       77.04446 
1 1 1 11  12 17 o 282.8949 41.49001 16.09945       4.422776      22.10293       6.037147      9.145021       6.497717  330.6249 48.45655 214.2005 68.84208 116.4245       84.18592 
1 1 1 11  12 18 o 1061.576 16.80866 219.4626       6.929666      226.7585       9.988561      212.6926       9.621781  1077.491 23.87048 1043.571 23.74137 33.92078       33.66678 
1 1 1 11  12 19 o 126.9458 51.96456 1.273485       4.077026      5.750889       5.597988      -3.784103      5.949637  178.9259 63.82455 121.6409 55.73806 57.28501       84.73668 
1 1 1 11  12 20 o 336.5536 34.87223 22.58126       4.491729      19.15879       6.185454      26.39954       6.533341  304.0240 54.38499 360.3437 47.87120 -56.31967      72.45260 
1 1 1 11  12 21 o 923.7419 18.15951 166.5294       6.514523      172.9389       9.066541      159.6886       9.366639  939.2883 24.85506 901.9212 26.74159 37.36707       36.50872 
1 1 1 11  12 22 o 154.4748 64.16532 1.894506       6.338482      0.000000       0.000000      1.894506       6.338482  ?        ?        154.4748 64.16532 0.000000       64.16532 
1 1 1 11  12 23 o 223.8043 64.32742 10.84780       5.888351      17.99915       12.58494      8.843428       6.662634  279.9808 96.00441 206.6668 69.85896 73.31407       118.7313 
1 1 1 11  12 24 o 260.7018 45.57415 14.18057       4.446146      17.05008       5.772631      9.995771       6.971191  282.6726 54.56124 215.5208 71.44077 67.15187       89.89278 
1 1 1 11  12 25 o 393.3437 31.54302 30.99573       4.777873      37.16441       6.345348      22.91910       7.260633  427.7903 38.61024 325.0338 59.72062 102.7565       71.11472 
1 1 1 11  13 0  o 968.4787 16.59016 182.5464       6.239770      179.0938       7.329230      191.6399       11.89453  958.8290 19.68291 989.5022 30.95299 -30.67322      36.68112 
1 1 1 11  13 1  o 250.2687 41.86005 12.65109       3.924806      15.61777       4.716080      5.967316       7.078754  277.9392 45.24893 192.0312 71.27490 85.90802       84.42498 
1 1 1 11  13 2  o 925.7303 17.75628 166.8039       6.383584      166.8914       7.942580      166.6442       10.72849  925.3658 22.10142 923.2596 29.92174 2.106201       37.19923 
1 1 1 11  13 3  o 246.0225 42.99867 12.24399       3.958702      15.39139       5.598846      9.097477       5.598052  274.0242 54.52962 211.8802 63.22803 62.14406       83.49409 
1 1 1 11  13 4  o 352.3042 44.75227 24.80916       5.984810      0.000000       0.000000      24.80916       5.984810  ?        ?        352.3042 44.75227 0.000000       44.75227 
1 1 1 11  13 5  o 277.2059 34.69904 15.27036       3.653653      15.22798       4.766743      15.33071       5.688762  274.4568 46.37420 273.4745 55.46130 0.9822693      72.29469 
1 1 1 11  13 6  o 557.0613 24.76814 60.49786       5.358268      60.49786       5.358268      0.000000       0.000000  557.0613 24.76814 ?        ?        0.000000       24.76814 
1 1 1 11  13 7  o 1062.985 15.55175 219.7513       6.419990      209.6566       8.530345      232.9385       9.749845  1037.592 21.16957 1093.408 22.96083 -55.81604      31.23060 
1 1 1 11  13 8  o 779.8802 17.77894 118.3454       5.384703      115.0834       12.61667      119.0719       5.954228  764.1583 42.68475 782.0961 19.60367 -17.93781      46.97118 
1 1 1 11  13 9  o 899.8079 16.64600 157.5126       5.816847      142.2458       13.29176      161.1291       6.469229  851.2285 40.20761 909.8998 18.30758 -58.67133      44.17940 
1 1 1 11  13 10 o 1484.862 16.39115 428.9443       9.451997      418.8307       20.80847      431.5736       10.60973  1461.676 36.65735 1489.047 18.34712 -27.37073      40.99242 
1 1 1 11  13 11 o 481.7832 20.94247 45.21824       3.918390      56.78098       10.65376      43.40944       4.213743  533.0161 52.13520 471.8915 22.99312 61.12457       56.98037 
1 1 1 11  13 12 o 771.3007 16.17350 115.7486       4.844575      124.1720       12.54379      114.2719       5.252087  793.6025 40.83875 766.2184 17.65027 27.38409       44.48972 
1 1 1 11  13 13 o 732.2449 16.64411 104.3399       4.733090      82.34058       12.02774      108.3707       5.148477  643.5795 48.47916 746.1423 17.76761 -102.5629      51.63252 
1 1 1 11  13 14 o 1107.702 15.51293 238.7122       6.673362      220.4582       15.34120      242.9724       7.411287  1059.682 37.27827 1117.316 17.08007 -57.63379      41.00486 
1 1 1 11  13 15 o 431.3363 22.01261 36.36606       3.675086      43.48814       6.631640      33.20935       4.415045  469.2391 36.68320 411.3086 27.80336 57.93051       46.02917 
1 1 1 11  13 16 o 1042.206 18.16381 211.5404       7.351710      215.0056       9.787555      207.0544       11.13632  1049.546 24.01291 1029.035 27.86656 20.51062       36.78539 
1 1 1 11  13 17 o 709.3990 18.90135 98.07326       5.207286      94.25341       7.579178      101.4885       7.166562  693.9268 28.12422 720.5582 25.61025 -26.63141      38.03757 
1 1 1 11  13 18 o 186.4489 52.69413 7.158720       3.984651      9.489927       5.679722      4.899284       5.591606  214.1674 63.63694 171.7175 63.42395 42.44992       89.84574 
1 1 1 11  13 19 o 465.5969 25.46375 42.57508       4.586819      37.55818       6.285058      48.29191       6.709177  434.2424 37.64147 493.5005 35.23861 -59.25815      51.56200 
1 1 1 11  13 20 o 212.2268 55.49781 9.476130       4.625940      12.93271       6.788363      6.479339       6.320772  245.6888 68.54762 188.1619 67.74531 57.52692       96.37533 
1 1 1 11  13 21 o 400.1557 31.55805 31.80119       4.864386      41.79417       7.041942      22.68100       6.727394  456.1420 40.16210 329.9183 54.40297 126.2237       67.62157 
1 1 1 11  13 22 f 170.1213 55.45160 5.841846       4.206457      4.860447       5.513777      7.208378       6.506332  168.2496 62.81423 193.0438 68.81373 -24.79419      93.17165 
1 1 1 11  13 23 o 166.9043 63.76450 4.605110       5.757109      -12.59793      11.42825      10.45550       6.664531  146.6099 70.23212 219.5233 69.63276 -72.91339      98.90031 
1 1 1 11  13 24 o 518.0651 31.97199 53.64112       6.401096      58.60587       12.92408      52.02737       7.368331  519.2962 65.54494 507.4085 37.66108 11.88773       75.59429 
1 1 1 11  14 0  o 1144.153 16.49146 254.7363       7.327759      253.1658       8.682790      258.6232       13.66007  1140.119 19.61015 1149.870 30.58977 -9.750488      36.33582 
1 1 1 11  14 1  o 742.0911 18.32420 107.2050       5.280927      107.3250       6.359581      106.9387       9.477889  742.0825 22.06726 739.0653 33.02180 3.017151       39.71654 
1 1 1 11  14 2  o 394.4025 28.90314 30.54963       4.396201      30.19525       6.252757      30.89606       6.182178  389.6639 41.98215 394.4294 40.95650 -4.765533      58.65097 
1 1 1 11  14 3  o 834.2410 17.78002 135.4427       5.760388      134.4896       8.138664      136.3995       8.154196  830.3564 25.23833 836.2509 25.10826 -5.894409      35.60053 
1 1 1 11  14 4  o 516.9615 22.29931 52.07284       4.476902      49.60706       6.274410      54.63010       6.389758  502.6078 32.31649 527.7120 31.31900 -25.10419      45.00261 
1 1 1 11  14 5  o 845.6266 16.79070 139.1212       5.514110      127.2407       7.425632      153.7255       8.232969  807.9464 23.66589 888.0306 23.87265 -80.08429      33.61514 
1 1 1 11  14 6  o 226.8195 41.16014 10.40900       3.492118      10.82804       4.700074      9.892615       5.217566  229.4133 53.70304 219.4343 59.65740 9.978928       80.26843 
1 1 1 11  14 7  o 838.5342 21.38837 136.9695       6.965086      136.9695       6.965086      0.000000       0.000000  838.5342 21.38837 ?        ?        0.000000       21.38837 
1 1 1 11  14 8  o 1487.908 14.30940 430.5195       8.268479      403.7567       12.21521      453.1522       11.23321  1439.503 21.85045 1525.666 18.95905 -86.16296      28.92901 
1 1 1 11  14 9  o 1055.619 16.01930 216.7943       6.567179      201.5686       14.71315      220.5823       7.338781  1013.558 37.37912 1064.569 17.75097 -51.01068      41.37989 
1 1 1 11  14 10 o 319.4397 29.48917 20.11373       3.617004      17.27027       10.23973      20.51909       3.866238  287.4204 85.45537 322.3731 31.27523 -34.95273      90.99868 
1 1 1 11  14 11 o 936.0637 18.88196 170.6224       6.864051      144.1645       13.40769      180.0197       7.990599  856.1412 40.32557 961.1089 21.40813 -104.9678      45.65589 
1 1 1 11  14 12 o 372.0020 24.28470 27.11214       3.489125      38.77936       10.17852      25.55861       3.714162  436.3318 61.79510 360.7973 26.69708 75.53452       67.31544 
1 1 1 11  14 13 o 804.7844 17.22537 126.0690       5.383640      128.0419       13.31188      125.6833       5.886515  804.9722 42.73552 803.3581 18.86779 1.614075       46.71529 
1 1 1 11  14 14 o 121.5273 47.74258 1.734974       3.295287      -1.448616      9.610765      2.159109       3.507934  171.9245 75.32709 128.3225 49.58220 43.60204       90.18073 
1 1 1 11  14 15 o 1153.724 16.94464 259.1402       7.592104      294.6819       17.99625      251.4451       8.373747  1223.949 37.86087 1136.088 18.97929 87.86133       42.35161 
1 1 1 11  14 16 o 583.9604 16.89419 66.40815       3.831324      61.97101       6.879604      68.40304       4.612871  561.2083 31.69505 592.3168 20.05346 -31.10852      37.50623 
1 1 1 11  14 17 o 415.2560 27.44068 33.91634       4.400312      31.94212       6.445583      35.63958       6.021956  399.4397 42.18954 423.5678 36.97972 -24.12811      56.10220 
1 1 1 11  14 18 o 263.5796 41.08307 14.08919       4.068272      16.18817       5.711365      11.92726       5.796389  279.0133 54.66446 237.6207 62.11604 41.39265       82.74422 
1 1 1 11  14 19 f 493.2308 26.56171 47.85958       5.069097      46.32848       7.560522      49.10992       6.832242  481.0172 40.85952 497.1100 35.62642 -16.09280      54.21017 
1 1 1 11  14 20 o 160.0877 56.53537 4.717415       4.381822      3.482767       6.264751      5.899936       6.131074  164.6009 65.45654 181.7319 66.52569 -17.13107      93.32858 
1 1 1 11  14 21 o 540.0179 22.97295 57.18884       4.817846      56.15525       6.583508      58.38061       7.069330  531.7457 32.03000 541.5454 33.78212 -9.799683      46.55269 
1 1 1 11  14 22 o 248.0390 46.33210 12.85200       4.298911      14.11951       5.516029      10.89114       6.860800  256.3886 56.88602 223.8896 70.61162 32.49899       90.67535 
1 1 1 11  14 23 o 454.9074 26.28619 40.99193       4.624066      39.99298       6.119479      42.32141       7.059665  445.6503 35.65699 456.3276 40.24864 -10.67731      53.77149 
1 1 1 11  14 24 o 167.2467 62.20316 5.106803       5.396939      2.063990       11.30165      6.005663       6.142571  188.6645 82.19793 178.7085 66.38188 9.956055       105.6553 
1 1 1 11  15 0  o 1009.948 16.96906 198.5083       6.655567      191.7148       7.759270      217.4230       12.94717  992.0587 20.13982 1054.028 31.62968 -61.96954      37.49732 
1 1 1 11  15 1  o 149.2482 53.95705 3.717965       4.015157      3.879553       4.986892      3.420165       6.769985  159.3753 59.69110 171.8190 68.13378 -12.44371      90.58278 
1 1 1 11  15 2  o 606.6330 21.61732 71.70851       5.092792      72.12604       7.311496      71.31503       7.097845  606.4761 31.14816 603.1877 30.39793 3.288391       43.52289 
1 1 1 11  15 3  o 709.2039 19.08217 97.92844       5.255655      101.4592       7.493420      94.51004       7.373275  720.9391 26.76415 695.7394 27.28889 25.19971       38.22307 
1 1 1 11  15 4  o 496.4489 23.54510 48.05275       4.539447      52.12858       6.556182      44.29939       6.291492  515.0455 32.95032 474.3635 34.38531 40.68201       47.62429 
1 1 1 11  15 5  o 774.8841 17.53772 116.8596       5.277617      111.0100       7.342072      123.1134       7.591535  754.3441 25.06231 794.4703 24.60503 -40.12628      35.12160 
1 1 1 11  15 6  o 394.4110 24.41295 30.45786       3.720978      32.18137       5.022384      28.36067       5.540146  404.2472 32.26019 378.2081 38.24477 26.03909       50.03381 
1 1 1 11  15 7  o 237.6455 36.06068 11.32033       3.223556      10.81899       4.154166      12.07910       5.110624  229.8521 48.08315 241.8672 55.57576 -12.01517      73.48915 
1 1 1 11  15 8  o 423.9930 18.85410 35.00626       3.104505      34.88113       4.468758      35.12298       4.316088  421.6925 27.43678 423.3192 26.38519 -1.626770      38.06515 
1 1 1 11  15 9  o 886.5403 19.88155 153.1059       6.845053      132.5908       13.29527      160.5051       7.984609  819.4633 41.91751 907.2739 22.66143 -87.81067      47.65100 
1 1 1 11  15 10 o 699.9231 19.98352 95.44016       5.431882      89.04453       12.34504      96.97566       6.048899  669.2725 47.81120 705.2740 22.08465 -36.00153      52.66539 
1 1 1 11  15 11 o 1318.030 15.55305 338.0040       7.961019      329.1914       18.39315      340.0355       8.831076  1294.853 36.57697 1321.687 17.20509 -26.83484      40.42141 
1 1 1 11  15 12 o 717.2792 17.05931 100.1478       4.752015      114.1556       12.75779      97.89120       5.120482  759.5300 43.43191 708.9883 18.59704 50.54169       47.24596 
1 1 1 11  15 13 o 370.4649 25.07669 26.91755       3.586574      43.39136       11.20393      25.03664       3.785790  460.4492 64.41946 356.8511 27.53031 103.5981       70.05558 
1 1 1 11  15 14 o 247.4332 35.25380 12.25884       3.291804      11.21413       10.35462      12.37629       3.471920  244.4223 86.84470 248.2360 37.15700 -3.813705      94.45975 
1 1 1 11  15 15 o 408.2546 22.47951 32.63016       3.550334      29.67616       10.46479      33.01439       3.774177  374.6039 74.55519 410.4622 23.77856 -35.85825      78.25533 
1 1 1 11  15 16 o 153.3139 49.64263 4.578924       3.374029      11.32485       10.05619      3.723189       3.581643  242.0226 85.62762 144.8323 51.11703 97.19023       99.72482 
1 1 1 11  15 17 o 303.7592 35.75666 18.45167       4.137305      23.17602       6.253375      14.77374       5.517533  337.0121 49.23175 266.1046 55.20029 70.90759       73.96511 
1 1 1 11  15 18 o 240.7631 50.16762 12.06630       4.538557      7.163004       7.175143      15.33660       5.859767  198.2756 72.06065 269.9120 57.65376 -71.63640      92.28593 
1 1 1 11  15 19 o 559.7286 23.94333 61.40517       5.204631      71.55802       7.856105      53.46349       6.948158  600.5671 33.82122 518.5481 34.70298 82.01898       48.45793 
1 1 1 11  15 20 o 477.8067 24.44341 44.93433       4.520491      41.90454       6.103693      48.61522       6.727634  458.2936 34.54826 493.5113 35.33628 -35.21771      49.41897 
1 1 1 11  15 21 o 770.9717 18.83341 116.2844       5.638913      118.1615       7.744956      114.1669       8.226023  774.6680 25.74396 760.5660 27.84999 14.10199       37.92589 
1 1 1 11  15 22 o 436.0412 26.18185 37.65410       4.413058      37.52472       5.765756      37.83710       6.857200  432.1543 34.64627 430.8772 41.49232 1.277100       54.05531 
1 1 1 11  15 23 o 287.4448 37.88489 16.90163       4.126063      24.55215       5.575642      7.640313       6.134594  345.2414 42.48199 192.1903 66.96371 153.0511       79.30232 
1 1 1 11  16 0  o 418.8658 27.50290 34.43027       4.448992      34.17067       5.381103      34.99104       7.908974  416.2054 33.57743 417.3946 49.77326 -1.189178      60.04017 
1 1 1 11  16 1  o 446.5280 26.17620 39.06788       4.519405      40.12763       5.501299      36.86798       7.926200  451.6540 31.56242 429.0236 48.41954 22.63043       57.79826 
1 1 1 11  16 2  o 835.7208 18.58641 136.0053       6.032325      144.3515       8.712180      128.3190       8.360665  859.7972 26.09173 810.5635 26.55986 49.23376       37.23177 
1 1 1 11  16 3  o 568.3188 31.51603 63.41953       6.928617      0.000000       0.000000      63.41953       6.928617  ?        ?        568.3188 31.51603 0.000000       31.51603 
1 1 1 11  16 4  o 700.5947 19.30840 95.60285       5.253408      98.23162       7.543391      93.12714       7.320505  709.0567 27.39414 690.4025 27.30302 18.65424       38.67679 
1 1 1 11  16 5  o 341.1266 31.31189 22.96764       4.101834      22.59224       6.019051      23.29315       5.604815  334.7891 47.63811 341.0969 43.28552 -6.307800      64.36634 
1 1 1 11  16 6  o 922.6321 16.25929 165.6625       5.825833      163.5201       8.108621      167.9485       8.375819  915.6605 22.80261 927.8973 23.24339 -12.23676      32.56092 
1 1 1 11  16 7  o 248.4696 35.27472 12.34866       3.308236      12.15647       4.309906      12.62432       5.161515  243.9501 47.19891 247.1352 55.17546 -3.185104      72.60902 
1 1 1 11  16 8  o 410.5413 27.32796 33.08097       4.332151      33.08097       4.332151      0.000000       0.000000  410.5413 27.32796 ?        ?        0.000000       27.32796 
1 1 1 11  16 9  o 882.4276 15.48340 151.5154       5.306074      131.8715       13.58192      155.0536       5.764151  816.5075 42.98384 892.5293 16.62972 -76.02179      46.08859 
1 1 1 11  16 10 o 990.7556 15.48937 191.0005       5.959752      190.0598       15.10007      191.1741       6.486331  982.6875 39.56722 991.0164 16.85351 -8.328918      43.00704 
1 1 1 11  16 11 o 455.0400 63.94162 42.37029       10.98775      42.37029       10.98775      0.000000       0.000000  455.0400 63.94162 ?        ?        0.000000       63.94162 
1 1 1 11  16 12 o 716.0955 45.15538 101.8133       12.49334      101.8133       12.49334      0.000000       0.000000  716.0955 45.15538 ?        ?        0.000000       45.15538 
1 1 1 11  16 13 o 708.5256 33.53830 98.55096       9.228362      119.1740       13.44780      80.19495       12.68714  774.5920 44.89696 632.3258 52.12946 142.2662       68.79838 
1 1 1 11  16 14 o 425.3549 50.07766 36.53044       8.113787      35.76904       11.24614      37.35701       11.71763  412.4442 72.87717 421.0750 74.37576 -8.630829      104.1289 
1 1 1 11  16 15 o 94.23096 41.84098 -1.018714      3.059795      2.862467       10.18668      -1.403615      3.207931  194.2977 81.07819 94.15509 42.25184 100.1427       91.42697 
1 1 1 11  16 16 o 707.4056 16.82145 97.53574       4.621254      92.54948       13.09546      98.24502       4.939006  677.4982 50.12777 709.7942 17.91757 -32.29596      53.23375 
1 1 1 11  16 17 o 195.5645 46.73792 7.960230       3.501310      0.000000       0.000000      7.960230       3.501310  ?        ?        195.5645 46.73792 0.000000       46.73792 
1 1 1 11  16 18 o 285.1270 40.70038 16.51315       4.378863      25.39413       7.064704      10.97275       5.580003  349.9625 53.69550 226.8184 61.70707 123.1441       81.79834 
1 1 1 11  16 19 o 182.8488 52.76653 6.997842       3.954905      6.077995       5.461740      8.011814       5.734374  178.7001 63.11765 197.4281 64.76299 -18.72795      90.43275 
1 1 1 11  16 20 o 354.9360 30.23699 25.10039       4.128159      23.10228       5.491472      27.69683       6.259911  336.0453 43.06992 367.6711 44.76497 -31.62579      62.12021 
1 1 1 11  16 21 o 506.1611 22.38723 50.34081       4.400653      47.33625       5.854870      54.24228       6.671769  487.2448 31.10385 520.7937 33.15989 -33.54892      45.46458 
1 1 1 11  16 22 o 250.6104 40.57548 13.00057       3.814039      12.72453       5.129218      13.34196       5.704216  242.0454 55.72024 246.1911 60.17017 -4.145706      82.00728 
1 1 1 11  17 0  o 171.6792 57.35734 5.618947       4.490860      5.374836       5.499935      6.107288       7.779029  175.7788 63.20341 196.9354 74.38628 -21.15657      97.61142 
1 1 1 11  17 1  o 348.5635 33.47810 24.05224       4.476051      25.76568       5.460928      20.54454       7.813461  359.5090 39.78034 313.4518 66.25943 46.05722       77.28381 
1 1 1 11  17 2  o 462.7831 27.59194 42.02647       4.936387      40.78423       6.987090      43.26445       6.975136  453.2266 40.11080 467.2287 38.79185 -14.00214      55.80040 
1 1 1 11  17 3  o 525.5540 24.41808 53.92809       4.983757      52.01640       7.066548      55.81995       7.029789  513.3741 35.66557 532.2361 34.19119 -18.86194      49.40718 
1 1 1 11  17 4  o 1206.191 16.94404 283.2530       7.937081      272.4111       11.03023      294.8948       11.42989  1181.306 24.04329 1229.116 23.94535 -47.80994      33.93316 
1 1 1 11  17 5  f 712.4659 18.93490 98.89013       5.239082      88.76469       7.431149      108.8967       7.387407  673.6262 28.40593 746.6528 25.47683 -73.02661      38.15712 
1 1 1 11  17 6  o 294.5575 34.70333 17.26051       3.893628      15.11158       5.818247      19.00346       5.239897  270.1435 57.23795 306.8494 45.33657 -36.70596      73.01772 
1 1 1 11  17 7  o 646.9148 17.43043 81.48848       4.379082      81.18380       6.054332      81.82276       6.341563  644.8804 24.17459 647.2601 25.22839 -2.379700      34.94112 
1 1 1 11  17 8  o 525.7337 18.20677 53.83156       3.717293      48.72648       4.815304      61.36108       5.847990  499.5399 24.82136 560.3066 26.87527 -60.76669      36.58388 
1 1 1 11  17 9  o 347.8673 24.59773 23.74380       3.301625      15.46788       10.96696      24.56862       3.462246  274.5345 89.53873 353.7727 25.36872 -79.23825      93.06319 
1 1 1 11  17 10 o 379.0344 75.49123 30.27391       10.72186      30.27391       10.72186      0.000000       0.000000  379.0344 75.49123 ?        ?        0.000000       75.49123 
1 1 1 11  17 11 o 569.2584 38.80608 64.12766       8.527846      49.51165       11.17683      84.49142       13.19270  493.3352 59.54155 648.9261 52.80726 -155.5910      79.58519 
1 1 1 11  17 12 o 830.2271 30.68302 135.1495       9.892886      121.7537       13.51307      150.6218       14.52274  782.5991 44.64679 872.4565 42.86244 -89.85742      61.89124 
1 1 1 11  17 13 f 195.4548 72.93233 6.349004       7.431226      0.9674068E-02  10.15806      13.64792       10.89979  181.4006 78.48102 260.0993 89.33680 -78.69868      118.9131 
1 1 1 11  17 14 o 687.1791 34.12641 93.02839       9.107276      95.99385       12.99693      90.16763       12.76545  691.3634 48.71843 669.6259 49.43766 21.73755       69.40870 
1 1 1 11  17 15 f 450.3199 70.70985 42.86944       11.95859      0.000000       0.000000      42.86944       11.95859  ?        ?        450.3199 70.70985 0.000000       70.70985 
1 1 1 11  17 16 o 349.2171 83.40218 27.07940       11.15536      0.000000       0.000000      27.07940       11.15536  ?        ?        349.2171 83.40218 0.000000       83.40218 
1 1 1 11  17 17 o 194.9846 43.53674 7.899834       3.213360      4.175768       10.73529      8.266335       3.367770  201.0926 83.51537 199.3050 44.62195 1.787598       94.68862 
1 1 1 11  17 18 o 301.7177 29.45126 18.12558       3.406899      30.48258       10.89964      16.78758       3.586607  370.1233 78.27507 289.4855 32.46199 80.63782       84.73941 
1 1 1 11  17 19 o 184.5268 51.95328 7.195178       3.881037      12.82809       5.548763      1.800052       5.430382  243.6552 59.21900 144.0255 59.57210 99.62978       83.99836 
1 1 1 11  17 20 o 466.7645 23.56808 42.96933       4.258370      41.61763       5.773182      44.58236       6.306598  456.0556 32.81575 471.2843 34.70164 -15.22876      47.76062 
1 1 1 11  17 21 o 148.7410 52.00122 4.252422       3.700921      3.880308       4.947057      4.725373       5.577208  154.0138 59.04464 165.3737 62.86006 -11.35991      86.24184 
1 1 1 11  17 22 o 93.58076 43.09148 -2.378776      3.616207      -1.359506      4.816599      -3.695517      5.474522  116.1681 51.97645 113.1261 52.41828 3.042007       73.81889 
1 1 1 11  18 0  o 105.2400 47.85597 -2.464136      4.278807      0.7032954      5.286241      -8.482087      7.286479  137.7486 58.00216 120.7991 57.36572 16.94942       81.57864 
1 1 1 11  18 1  o 361.8340 37.20664 26.04668       5.153778      26.60542       7.067526      25.41213       7.531683  361.8126 51.77478 351.8166 57.08104 9.996002       77.06409 
1 1 1 11  18 2  o 946.2407 18.43749 174.4634       6.775345      158.2289       9.270965      193.0736       9.926121  899.4755 26.54041 993.8077 25.71871 -94.33215      36.95734 
1 1 1 11  18 3  o 586.5281 23.46341 67.16942       5.344510      63.19733       7.445350      71.39198       7.676505  566.2253 34.01627 602.2064 32.94881 -35.98102      47.35748 
1 1 1 11  18 4  o 457.9545 27.42929 41.17052       4.855800      42.70881       6.904690      39.66524       6.830194  464.0233 38.66772 446.7906 39.78031 17.23267       55.47672 
1 1 1 11  18 5  o 275.9732 63.38758 15.94172       6.650514      15.94172       6.650514      0.000000       0.000000  275.9732 63.38758 ?        ?        0.000000       63.38758 
1 1 1 11  18 6  o 402.1086 27.46577 31.77012       4.263415      27.93927       6.284162      35.03710       5.803269  373.3517 44.19915 420.6961 35.86269 -47.34439      56.91835 
1 1 1 11  18 7  o 462.7900 22.69827 41.79532       4.079479      40.67965       5.553881      43.10256       6.011799  454.4357 31.66789 467.4865 33.33204 -13.05078      45.97695 
1 1 1 11  18 8  o 292.8014 26.66045 16.89879       2.998365      20.26163       4.155792      13.24770       4.330242  319.4753 34.01899 255.0368 45.38348 64.43855       56.71818 
1 1 1 11  18 9  f 169.0860 71.84364 0.8422338      8.229633      12.76635       11.29422      -12.65517      12.01623  257.0533 90.76698 156.7455 74.21254 100.3078       117.2439 
1 1 1 11  18 10 o 213.4781 75.13192 8.524199       7.732205      4.543272       10.05166      14.29423       12.10138  202.7369 82.11697 268.5090 94.02313 -65.77208      124.8341 
1 1 1 11  18 11 f 155.1167 67.37679 -0.5378687     7.546614      -12.89398      10.21292      14.32299       11.20034  139.1595 66.59170 265.4035 90.57210 -126.2441      112.4178 
1 1 1 11  18 12 o 569.2213 41.04214 64.51838       9.011889      66.69957       11.99085      61.68710       13.66140  573.4951 54.49319 546.1461 65.73069 27.34900       85.38168 
1 1 1 11  18 13 o 777.1002 32.36969 118.8968       9.768853      119.9231       13.71438      117.8397       13.91837  773.8763 45.83699 766.5174 46.98279 7.358887       65.63849 
1 1 1 11  18 14 o 627.1613 50.47147 79.64883       12.18880      0.000000       0.000000      79.64883       12.18880  ?        ?        627.1613 50.47147 0.000000       50.47147 
1 1 1 11  18 15 o 337.1555 82.94175 25.33734       10.78539      0.000000       0.000000      25.33734       10.78539  ?        ?        337.1555 82.94175 0.000000       82.94175 
1 1 1 11  18 16 f 238.6734 74.63344 12.26202       7.682156      -1.419178      10.80717      26.23590       10.92216  177.3420 78.69458 341.5098 83.13429 -164.1678      114.4734 
1 1 1 11  18 17 o 381.6669 55.75582 30.48277       8.020436      21.67962       11.32887      39.32875       11.35640  306.0699 89.59087 425.5672 71.23138 -119.4973      114.4571 
1 1 1 11  18 18 o 211.9791 74.37419 9.241132       7.573757      5.736600       10.79311      12.64091       10.63057  205.5643 84.39418 243.3440 87.82359 -37.77975      121.8005 
1 1 1 11  18 19 o 615.8358 15.05552 74.04575       3.600714      64.43412       6.701116      77.94734       4.269427  568.9554 30.43814 631.2712 17.41508 -62.31586      35.06801 
1 1 1 11  18 20 o 359.2006 28.13115 25.72754       3.892855      23.08779       5.379974      28.62851       5.639874  334.6576 42.34272 374.5177 39.36568 -39.86017      57.81490 
1 1 1 11  18 21 o 216.8980 44.22249 9.945070       3.598700      12.85950       4.897934      6.525981       5.305072  243.6472 53.25040 178.6643 62.27074 64.98299       81.93443 
1 1 1 11  19 0  f 701.8290 21.28703 96.13741       5.801954      93.26876       7.061944      102.0952       10.17721  690.3395 26.34108 718.7727 36.58019 -28.43323      45.07730 
1 1 1 11  19 1  o 176.8345 59.48069 5.986569       4.829839      0.6265791      6.835835      11.32962       6.825025  154.0435 65.46555 233.3275 69.85634 -79.28406      95.73738 
1 1 1 11  19 2  o 515.6322 26.02450 52.13560       5.194522      48.38686       7.339969      55.89702       7.352376  493.7881 38.58242 531.6927 35.81591 -37.90460      52.64392 
1 1 1 11  19 3  f 508.6642 26.08885 50.73541       5.136301      47.82693       7.312353      53.56795       7.216253  490.9473 38.66549 520.4808 35.92076 -29.53345      52.77613 
1 1 1 11  19 4  f 730.8331 21.47837 104.2172       6.096037      101.4509       8.217971      107.6017       9.090035  719.5481 29.40877 740.5212 31.60822 -20.97314      43.17355 
1 1 1 11  19 5  o 522.5684 24.80970 53.36782       5.034922      46.32618       7.125367      60.39008       7.115551  483.3006 38.27622 553.5131 33.25616 -70.21249      50.70543 
1 1 1 11  19 6  o 99.82223 45.46688 -2.333556      3.882426      -0.1399315     5.848262      -4.062091      5.191402  139.1051 59.86612 110.6336 51.18621 28.47155       78.76536 
1 1 1 11  19 7  o 201.2101 46.25600 8.351217       3.538857      9.594817       5.725508      7.582421       4.501729  215.5980 63.85437 192.4367 56.51740 23.16133       85.27365 
1 1 1 11  19 8  o 183.7421 39.13396 6.911675       2.706935      -1.095477      4.220448      12.50768       3.528245  112.2296 49.51942 249.1985 37.62952 -136.9688      62.19449 
1 1 1 11  19 9  o 380.6754 59.42802 29.89577       8.498593      31.75920       11.32501      27.49369       12.85809  385.0183 78.40465 352.6120 92.67941 32.40634       121.3951 
1 1 1 11  19 10 o 879.2393 30.90360 151.8902       10.55223      157.0769       14.68819      146.3579       15.16967  889.4841 42.52085 855.9783 45.79969 33.50580       62.49508 
1 1 1 11  19 11 o 405.3070 54.73196 33.69039       8.394631      25.46134       11.34237      43.65779       12.48303  339.4952 85.94653 453.6204 73.36431 -114.1252      113.0006 
1 1 1 11  19 12 o 371.8033 85.88837 30.65905       12.15179      0.000000       0.000000      30.65905       12.15179  ?        ?        371.8033 85.88837 0.000000       85.88837 
1 1 1 11  19 13 o 524.5363 60.87164 57.11860       12.16938      0.000000       0.000000      57.11860       12.16938  ?        ?        524.5363 60.87164 0.000000       60.87164 
1 1 1 11  19 14 o 379.0196 79.03711 31.68841       11.25703      0.000000       0.000000      31.68841       11.25703  ?        ?        379.0196 79.03711 0.000000       79.03711 
1 1 1 11  19 15 f 206.0528 73.49395 8.297591       7.422491      3.086212       10.66810      13.18753       10.33385  194.5274 82.17972 249.1107 86.90508 -54.58324      119.6077 
1 1 1 11  19 16 o 686.9662 34.29261 93.81213       9.148795      91.07063       12.86679      96.61548       13.01112  666.5843 50.06930 687.3824 49.06258 -20.79810      70.10044 
1 1 1 11  19 17 o 278.4880 69.65083 17.28032       7.513507      20.38831       10.73119      14.29159       10.52327  294.6998 87.45070 252.9519 87.72879 41.74785       123.8708 
1 1 1 11  19 18 o 608.1392 37.08427 74.51596       8.716464      81.69702       12.85880      68.41120       11.85605  624.9575 53.49683 571.1228 54.09928 53.83466       76.08313 
1 1 1 11  19 19 o 307.1066 65.05763 20.99628       7.517856      13.61725       10.83098      27.85655       10.44332  244.5264 88.58646 344.9007 79.58609 -100.3743      119.0861 
1 1 1 11  19 20 o 172.7161 39.65617 6.279224       2.603768      6.393332       4.984333      6.236398       3.053534  176.0542 60.41553 171.1093 45.25611 4.944962       75.48611 
1 1 1 11  20 0  o 522.5930 26.55189 53.62212       5.371029      55.73717       6.667044      49.71130       9.065825  531.3931 32.46216 497.0649 47.54408 34.32813       57.56936 
1 1 1 11  20 1  o 289.1932 48.93282 17.12440       5.299587      18.37652       7.054110      15.50195       8.029828  295.4823 63.37332 269.3037 74.33950 26.17859       97.68592 
1 1 1 11  20 2  o 276.4209 49.85603 15.69948       5.155100      15.44716       7.045308      15.99024       7.563019  269.7966 67.42850 273.9171 70.63846 -4.120483      97.65447 
1 1 1 11  20 3  o 649.2054 23.40290 82.36515       5.900376      82.59975       7.955301      82.07830       8.796796  648.4299 31.59116 644.5424 35.27736 3.887512       47.35498 
1 1 1 11  20 4  o 388.7343 33.15717 29.92821       4.957764      40.23878       7.146074      20.36018       6.883945  448.9260 41.45704 312.9632 58.79796 135.9628       71.94363 
1 1 1 11  20 5  o 816.7164 18.49369 130.0452       5.865740      127.6187       8.499314      132.2520       8.105509  807.1935 27.11304 822.1531 25.38631 -14.95959      37.14272 
1 1 1 11  20 6  o 296.2308 35.71424 17.54013       4.025800      9.392581       6.578148      22.41905       5.090403  215.1418 69.27968 334.3235 40.00071 -119.1817      79.99831 
1 1 1 11  20 7  o 147.5507 49.43763 4.133904       3.336408      -1.253619      5.610913      7.080818       4.149757  129.5723 57.13810 185.5806 54.19445 -56.00829      78.75150 
1 1 1 11  20 8  o 508.3153 23.64300 50.54186       4.667279      0.000000       0.000000      50.54186       4.667279  ?        ?        508.3153 23.64300 0.000000       23.64300 
1 1 1 11  20 9  o 211.4075 77.22139 8.168521       8.254601      6.581650       11.34309      9.954936       12.03516  218.8121 87.72092 239.8546 92.06100 -21.04254      127.1621 
1 1 1 11  20 10 o 172.8382 73.05648 1.639716       8.438263      14.42239       11.24321      -14.84742      12.76886  262.4138 90.69883 155.7001 74.49445 106.7136       117.3699 
1 1 1 11  20 11 o 861.1268 45.65535 149.0972       15.21363      0.000000       0.000000      149.0972       15.21363  ?        ?        861.1268 45.65535 0.000000       45.65535 
1 1 1 11  20 12 o 265.1092 91.61764 15.12622       11.47197      0.000000       0.000000      15.12622       11.47197  ?        ?        265.1092 91.61764 0.000000       91.61764 
1 1 1 11  20 13 o 174.1424 71.77693 3.065242       7.845489      -2.383528      10.67596      9.462664       11.56805  172.3142 77.21949 231.1982 89.84078 -58.88391      118.4661 
1 1 1 11  20 14 o 273.8267 71.98963 16.60616       7.756747      23.43094       10.83351      9.427078       11.11115  319.2587 85.61656 227.8242 88.18277 91.43446       122.9081 
1 1 1 11  20 15 o 141.3341 63.64131 -2.358328      7.348780      -11.05616      10.60996      5.661970       10.18834  143.8260 68.56142 201.9299 82.34349 -58.10390      107.1500 
1 1 1 11  20 16 o 787.9493 31.85037 123.4431       9.746324      106.6698       13.43398      142.0824       14.16154  720.2580 48.30716 835.7180 43.78611 -115.4600      65.19820 
1 1 1 11  20 17 o 165.6262 69.68259 2.451752       7.619424      -0.1782434     10.85103      5.009769       10.70151  177.4771 78.79954 198.4232 82.97640 -20.94608      114.4310 
1 1 1 11  20 18 o 348.0100 59.53270 26.36242       7.756721      27.82699       10.71772      24.75156       11.24025  342.2467 81.75798 317.6847 88.05402 24.56204       120.1577 
1 1 1 11  20 19 o 153.4778 65.94479 1.277980       7.075029      0.6270278      9.915327      1.953190       10.09839  172.1239 75.92639 178.8369 77.81023 -6.713028      108.7164 
1 1 1 11  21 0  o 188.5836 63.89408 6.931428       5.573564      8.251693       7.481836      5.285177       8.354603  208.3527 73.84325 193.1158 75.97030 15.23692       105.9449 
1 1 1 11  21 1  o 123.9524 58.59506 -7.812161      7.437030      0.000000       0.000000      -7.812161      7.437030  ?        ?        123.9524 58.59506 0.000000       58.59506 
1 1 1 11  21 2  o 376.9451 54.41681 29.21481       7.735299      0.000000       0.000000      29.21481       7.735299  ?        ?        376.9451 54.41681 0.000000       54.41681 
1 1 1 11  21 3  o 370.4881 34.20226 27.29793       4.865488      29.74825       7.110880      25.14089       6.671771  382.3687 49.01484 350.5664 50.45912 31.80228       70.34612 
1 1 1 11  21 4  o 268.7896 44.08072 14.75044       4.441834      12.72115       6.597949      16.43248       6.006966  244.3309 67.36169 280.0428 57.16779 -35.71184      88.35017 
1 1 1 11  21 5  o 522.1235 23.46424 53.34891       4.757817      51.87793       7.202144      54.48794       6.337602  510.8313 36.54554 525.2169 31.21158 -14.38556      48.05975 
1 1 1 11  21 6  o 290.5669 36.57864 16.96132       4.036163      24.34067       6.367731      12.00554       5.218328  345.0181 48.89235 238.5053 57.09689 106.5128       75.16992 
1 1 1 11  21 7  o 175.1055 49.13217 6.351458       3.477186      4.298255       6.254567      7.269919       4.183231  170.7913 66.14606 187.1286 54.34561 -16.33733      85.60809 
1 1 1 11  21 8  o 280.2582 29.22300 15.61810       3.133835      20.64368       5.663825      13.40066       3.762209  317.3525 47.40925 256.9555 38.91992 60.39700       61.33838 
1 1 1 11  21 9  o 625.1357 60.97418 81.18264       14.61449      0.000000       0.000000      81.18264       14.61449  ?        ?        625.1357 60.97418 0.000000       60.97418 
1 1 1 11  21 10 o 457.6331 80.04198 46.10966       13.70731      0.000000       0.000000      46.10966       13.70731  ?        ?        457.6331 80.04198 0.000000       80.04198 
1 1 1 11  21 11 o 662.4397 57.23859 90.93438       14.58062      0.000000       0.000000      90.93438       14.58062  ?        ?        662.4397 57.23859 0.000000       57.23859 
1 1 1 11  21 12 o 269.8953 73.46277 16.19430       7.906288      15.89130       11.05939      16.51103       11.30708  266.4531 90.00491 270.6606 91.00928 -4.207581      127.9983 
1 1 1 11  21 13 o 512.1900 43.92564 53.36862       8.652759      50.98221       11.91922      56.02751       12.58131  488.2011 64.44173 511.8585 64.73936 -23.65741      91.34508 
1 1 1 11  21 14 o 399.3096 55.02583 33.59794       8.306394      37.01751       11.61030      30.01242       11.88868  405.6539 76.50414 357.4543 86.56245 48.19965       115.5246 
1 1 1 11  21 15 f 344.8074 60.09346 25.71596       7.754440      18.38204       11.22846      32.40313       10.72194  277.0951 90.61098 377.4796 75.77277 -100.3846      118.1180 
1 1 1 11  21 16 o 514.3702 42.26085 54.19328       8.367297      59.94859       11.97332      48.69980       11.69778  528.3382 59.38330 470.7554 65.78239 57.58282       88.62110 
1 1 1 11  21 17 o 372.2020 57.86192 30.01796       8.092070      16.50222       11.19237      44.82088       11.71321  260.6010 90.46957 446.4147 69.85322 -185.8137      114.2988 
1 1 1 11  21 18 o 172.9368 71.04688 4.065529       7.655532      -7.504224      10.38210      17.85283       11.33347  147.8223 69.68028 267.6299 91.10986 -119.8076      114.7011 
1 1 1 11  22 0  o 258.6350 61.22423 14.31212       6.054097      14.31212       6.054097      0.000000       0.000000  258.6350 61.22423 ?        ?        0.000000       61.22423 
1 1 1 11  22 1  o 758.9906 22.04034 112.7669       6.496550      120.2195       9.311267      105.6978       9.068558  780.7159 30.71056 731.5916 31.91843 49.12433       44.29362 
1 1 1 11  22 2  o 283.4329 46.50401 16.53324       4.941225      20.58587       7.253415      13.02399       6.749644  311.0280 62.22316 245.5716 68.29408 65.45639       92.38940 
1 1 1 11  22 3  o 544.7018 25.09375 58.21931       5.308263      55.22995       7.543092      61.15218       7.471456  526.0565 37.16140 554.5447 34.87047 -28.48816      50.95998 
1 1 1 11  22 4  o 680.4868 21.34383 90.60950       5.640533      89.59628       8.151806      91.54022       7.812825  673.7630 31.15435 681.5976 29.51563 -7.834595      42.91580 
1 1 1 11  22 5  o 275.9116 41.55977 15.52692       4.315023      3.807646       6.446745      25.03850       5.807866  168.0770 66.53875 350.9935 43.54298 -182.9165      79.51978 
1 1 1 11  22 6  o 455.3389 24.72568 40.80998       4.355917      41.70844       6.712419      40.15639       5.725107  456.1266 38.24665 449.2994 33.04288 6.827179       50.54343 
1 1 1 11  22 7  o 724.1201 18.95086 102.4852       5.329268      105.1164       8.919903      101.0246       6.645800  729.1769 31.49918 717.5770 23.84793 11.59991       39.50850 
1 1 1 11  22 8  o 392.9637 23.45564 30.40185       3.563218      29.18224       6.504624      30.92474       4.259110  378.0532 45.20007 395.2207 27.92907 -17.16757      53.13265 
1 1 1 11  22 9  o 457.5142 80.20186 46.64371       13.73056      0.000000       0.000000      46.64371       13.73056  ?        ?        457.5142 80.20186 0.000000       80.20186 
1 1 1 11  22 10 o 507.0779 48.18509 52.72908       9.374858      53.01378       12.56058      52.37102       14.08631  496.8394 66.78943 486.3547 77.15479 10.48471       102.0475 
1 1 1 11  22 11 o 329.2934 68.87476 23.90725       8.524722      16.84855       11.51393      32.47095       12.68212  270.5851 91.83374 371.7381 89.02315 -101.1530      127.9006 
1 1 1 11  22 12 o 384.8235 58.82084 31.61337       8.511489      35.40222       12.14680      27.95843       11.93024  391.7760 82.44541 342.6505 88.89374 49.12558       121.2408 
1 1 1 11  22 13 o 189.8095 73.67247 6.268081       7.772051      7.418149       10.76006      5.013529       11.23821  211.0389 85.14266 201.8160 84.75320 9.222916       120.1348 
1 1 1 11  22 14 o 213.5883 75.49731 9.806408       7.815764      6.057498       10.86666      13.82420       11.24961  203.2857 84.19218 246.2400 90.11747 -42.95430      123.3267 
1 1 1 11  22 15 o 149.6150 65.80823 -0.8538327E-01 7.398488      3.937988       10.66118      -3.822960      10.27555  191.1357 81.50465 158.7522 72.92964 32.38342       109.3697 
1 1 1 11  22 16 o 310.9897 66.89480 21.95200       7.839368      29.23818       11.37682      15.36475       10.81740  345.3989 85.31642 251.9719 88.84565 93.42700       123.1765 
1 1 1 11  23 0  o 162.9175 68.10744 2.189977       7.206654      2.189977       7.206654      0.000000       0.000000  162.9175 68.10744 ?        ?        0.000000       68.10744 
1 1 1 11  23 1  o 656.3163 33.81503 85.79925       8.589588      0.000000       0.000000      85.79925       8.589588  ?        ?        656.3163 33.81503 0.000000       33.81503 
1 1 1 11  23 2  o 630.6828 23.67309 78.11214       5.798211      74.26524       8.210461      81.93932       8.189397  610.0825 34.79801 641.7899 32.96854 -31.70734      47.93565 
1 1 1 11  23 3  o 311.7777 41.34075 19.82967       4.882107      17.55387       7.056343      21.91942       6.761759  283.6492 65.39601 322.0316 56.10629 -38.38245      86.16586 
1 1 1 11  23 4  o 491.1119 26.74211 47.65334       5.081182      44.19201       7.280473      50.94044       7.094873  467.7081 40.48186 504.1605 36.48314 -36.45245      54.49587 
1 1 1 11  23 5  o 960.4454 19.25756 180.4985       7.182934      175.7830       11.33613      183.6617       9.284657  942.1179 30.98359 966.4279 24.73822 -24.31000      39.64798 
1 1 1 11  23 6  o 784.5313 19.71648 120.4973       6.007140      107.1530       9.443622      129.5665       7.785283  734.3811 33.11228 811.6362 24.69932 -77.25507      41.30956 
1 1 1 11  23 7  o 655.7908 19.87530 84.22688       5.061823      71.99561       8.024673      92.30951       6.523307  600.2258 34.57207 685.0114 24.52122 -84.78552      42.38535 
1 1 1 11  23 8  o 168.2291 56.47318 5.679146       4.353680      0.000000       0.000000      5.679146       4.353680  ?        ?        168.2291 56.47318 0.000000       56.47318 
1 1 1 11  23 9  o 174.4721 51.59005 6.414361       3.739770      6.682891       3.906635      3.470893       12.93409  177.8820 52.75953 205.8528 88.80939 -27.97079      103.2990 
1 1 1 11  23 10 o 300.4748 73.75588 20.56570       8.542869      26.59296       11.25357      12.36863       13.12380  334.4655 86.12110 244.6440 95.51706 89.82141       128.6093 
1 1 1 11  23 11 o 179.0263 74.00586 3.948862       8.373558      10.85500       11.57296      -3.638988      12.13071  231.1555 89.84992 174.2710 79.75636 56.88448       120.1419 
1 1 1 11  23 12 o 180.9338 72.74931 5.025273       7.826658      6.034826       10.77577      3.898022       11.38660  202.1960 83.79819 195.7453 83.86989 6.450775       118.5592 
1 1 1 11  23 13 o 165.7654 69.84417 2.691832       7.673083      -9.577970      10.53755      16.54052       11.19503  143.9028 68.52319 260.3979 90.47569 -116.4950      113.4957 
1 1 1 11  23 14 o 397.8253 54.05747 33.97629       8.135437      34.65593       11.39632      33.27003       11.61735  382.0280 79.40549 371.1377 82.71539 10.89029       114.6607 
1 1 1 11  23 15 o 201.5085 74.73512 8.563753       7.779799      7.804837       11.32832      9.241183       10.70289  209.5699 86.29920 214.6231 85.49081 -5.053146      121.4752 
1 1 1 11  24 0  o 199.4690 73.07424 7.891660       7.399538      7.891660       7.399538      0.000000       0.000000  199.4690 73.07424 ?        ?        0.000000       73.07424 
1 1 1 11  24 1  o 136.8627 57.05374 1.464584       5.036997      3.276449       7.015759      -0.4628924     7.236129  166.2844 68.12862 147.8582 65.05773 18.42625       94.20200 
1 1 1 11  24 2  o 137.5854 57.34854 1.486236       5.088367      7.884548       8.029816      -2.807024      6.577586  202.2541 75.74517 130.4955 59.33818 71.75865       96.22033 
1 1 1 11  24 3  o 544.8853 27.48090 58.85425       5.796456      60.09865       9.192439      58.03286       7.468369  542.1066 44.04427 537.1558 36.00962 4.950867       56.89104 
1 1 1 11  24 4  o 193.8269 58.99392 8.051715       4.838206      8.586527       7.816587      7.719564       6.160046  206.2763 75.17542 193.7210 67.12476 12.55530       100.7823 
1 1 1 11  24 5  f 698.8891 21.59482 95.94563       5.861191      103.7293       9.302244      90.82093       7.547952  721.0566 33.21929 676.9951 28.70884 44.06158       43.90579 
1 1 1 11  24 6  o 357.5156 29.94297 25.54968       4.119077      19.47223       6.164901      30.45075       5.536193  301.7266 54.62296 387.6332 37.23393 -85.90668      66.10622 
1 1 1 11  24 7  o 190.6525 48.21801 7.763766       3.572468      7.987525       5.632106      7.613132       4.621063  193.9416 64.21020 188.4479 57.71420 5.493683       86.33584 
1 1 1 11  24 8  o 315.7812 37.87530 20.36686       4.552159      0.000000       0.000000      20.36686       4.552159  ?        ?        315.7812 37.87530 0.000000       37.87530 
1 1 1 11  24 9  o 272.1784 34.01504 15.06270       3.516942      14.98720       3.647395      16.06190       13.26883  270.9481 35.51870 259.6766 97.34528 11.27151       103.6228 
1 1 1 11  24 10 o 226.6523 78.66196 11.65325       8.461201      8.835834       11.22567      15.35943       12.87509  216.4928 87.09795 253.9531 95.75249 -37.46033      129.4395 
1 1 1 11  24 11 o 206.8127 77.65620 8.937666       8.450930      9.373813       11.34675      8.394345       12.66436  218.4103 87.67312 218.2039 90.67274 0.2064056      126.1274 
1 1 1 11  24 12 o 626.9644 38.50707 80.27838       9.330491      68.27525       12.64990      94.60049       13.81794  559.8674 59.07182 665.5142 53.92726 -105.6468      79.98518 
1 1 1 11  24 13 o 433.4608 51.59982 40.15452       8.515440      31.92362       11.62332      49.69048       12.51091  359.0695 84.72155 464.5233 71.65592 -105.4537      110.9609 
1 1 1 11  25 0  o 205.8597 67.93629 9.366716       6.306596      9.829648       8.467798      8.790080       9.450679  213.5001 78.17783 209.7674 81.28979 3.732712       112.7821 
1 1 1 11  25 1  o 410.2228 49.78584 35.47632       7.768950      32.23048       8.957053      45.33472       15.61005  382.4945 62.45504 422.0208 97.24394 -39.52628      115.5726 
1 1 1 11  25 2  o 226.1455 58.24552 11.31674       5.146537      4.655512       8.104056      15.81890       6.662484  179.6751 73.37328 264.4964 65.26258 -84.82137      98.19798 
1 1 1 11  25 3  o 387.4190 35.82636 30.47779       5.329246      27.85157       8.182973      32.41209       7.022752  355.8685 61.43007 393.7397 46.84673 -37.87122      77.25458 
1 1 1 11  25 4  o 99.72076 46.23706 -3.066989      4.269766      -1.988927      6.069992      -4.122870      6.007221  127.3957 57.55795 117.4380 54.58613 9.957695       79.32568 
1 1 1 11  25 5  o 269.6165 43.11383 15.21157       4.362208      9.473501       6.146508      21.03476       6.191929  206.6456 67.01260 312.9203 52.83373 -106.2746      85.33517 
1 1 1 11  25 6  o 116.1714 49.27446 0.6270952      3.859981      -3.242235      5.607198      4.112382       5.321661  116.2065 53.56464 157.3605 60.99449 -41.15395      81.17572 
1 1 1 11  25 7  o 250.1891 40.06359 13.04076       3.761305      15.32297       5.528046      11.07344       5.132524  264.2007 55.63589 222.8411 58.54670 41.35968       80.76552 
1 1 1 11  25 8  o 459.9666 21.30217 41.69424       3.805205      37.75010       5.389444      45.61485       5.373337  432.4792 32.32225 477.2574 29.13050 -44.77820      43.51222 
1 1 1 11  25 9  o 243.2558 31.52619 12.05191       2.908211      9.759902       3.843298      15.12246       4.448395  212.4673 47.74213 267.4276 44.38852 -54.96033      65.18935 
1 1 1 11  25 10 f 264.7978 79.66559 17.23251       8.860422      29.77039       12.08853      2.677170       13.02485  339.8024 90.12807 194.4687 86.33868 145.3337       124.8096 
1 1 1 11  25 11 o 209.4255 77.11358 9.787260       8.255164      12.91307       11.11188      5.937048       12.33242  233.0509 88.69367 202.9515 87.12937 30.09944       124.3306 
1 1 1 11  26 0  o 255.0934 58.48030 14.68159       5.669710      13.19934       8.345797      15.95197       7.726346  233.1984 78.18987 256.8645 73.64447 -23.66605      107.4112 
1 1 1 11  26 1  f 129.2355 58.23597 -1.488387      6.166590      -0.4925028     6.765369      -6.379054      14.99240  139.7393 62.12389 177.7236 83.76264 -37.98424      104.2859 
1 1 1 11  26 2  o 280.7810 45.94928 16.80423       4.837067      24.86982       6.641231      7.691545       7.059174  338.7661 52.15321 191.1963 71.13442 147.5698       88.20467 
1 1 1 11  26 3  o 416.5246 31.38387 35.06454       5.039326      43.67426       7.123538      26.43960       7.129833  459.4583 40.33086 347.8736 54.57066 111.5848       67.85673 
1 1 1 11  26 4  o 257.6913 46.86811 14.25353       4.517565      7.582922       6.244936      21.57630       6.543092  187.9402 67.37222 312.7580 55.92265 -124.8178      87.55775 
1 1 1 11  26 5  o 96.28117 44.81370 -3.034366      4.071135      -4.681367      5.792938      -1.427110      5.722615  111.5705 52.42305 124.8432 56.19311 -13.27270      76.84947 
1 1 1 11  26 6  o 345.3762 31.86081 24.21238       4.225259      20.65070       5.981426      27.75978       5.969429  308.1259 51.82564 363.7823 43.09108 -55.65640      67.39984 
1 1 1 11  26 7  o 95.80992 43.77254 -1.867433      3.633231      -12.85057      5.125952      9.221000       5.150465  79.78978 39.88340 201.5666 60.76065 -121.7769      72.68110 
1 1 1 11  26 8  o 493.6656 21.07238 48.12050       4.039935      38.44459       5.623877      58.43747       5.807192  434.6129 33.58051 540.0741 27.78167 -105.4612      43.58293 
1 1 1 11  26 9  o 295.0856 28.55554 17.58175       3.231476      18.08671       4.454488      17.02080       4.694985  294.1143 40.03965 283.0842 44.14632 11.03003       59.59926 
1 1 1 11  27 0  o 315.5451 43.12199 21.21919       5.145990      35.39075       7.174698      6.205031       7.384913  406.0120 46.33242 178.3393 71.02126 227.6727       84.79807 
1 1 1 11  27 1  o 172.5327 60.46344 6.492518       5.004864      1.810992       6.782644      12.08844       7.415514  149.3430 64.37108 221.5162 73.69449 -72.17319      97.84944 
1 1 1 11  27 2  o 522.3687 32.86488 55.64397       6.633114      60.61757       7.396466      35.21078       14.99191  543.3700 35.24115 341.4608 103.8288 201.9092       109.6465 
1 1 1 11  27 3  o 231.5749 51.86543 11.96787       4.548501      12.81775       6.261577      11.01838       6.618344  231.6455 66.26117 214.3502 69.53986 17.29527       96.05381 
1 1 1 11  27 4  o 199.0439 67.53546 9.208264       6.227038      9.208264       6.227038      0.000000       0.000000  199.0439 67.53546 ?        ?        0.000000       67.53546 
1 1 1 11  27 5  o 462.1215 25.93901 42.76688       4.636370      37.31089       6.453979      48.58503       6.664734  422.9745 39.75685 486.3264 35.53399 -63.35193      53.32233 
1 1 1 11  27 6  o 198.7669 50.17263 8.781765       3.873298      2.856556       5.556639      14.38172       5.401975  146.8056 60.44559 251.8128 56.61461 -105.0072      82.81838 
1 1 1 11  28 0  f 233.5137 57.25056 12.74252       5.151861      15.73791       7.212083      9.621398       7.361890  249.2336 71.05076 198.8667 72.88288 50.36688       101.7847 
1 1 1 12  0  0  o 126.9201 66.98747 4.667706       4.405287      4.667706       4.405287      4.667706       4.405287  126.9201 66.98747 126.9201 66.98747 0.000000       0.000000 
1 1 1 12  0  1  o 148.1987 68.02346 6.354915       4.283294      6.354915       4.283294      6.354915       4.283294  148.1987 68.02346 148.1987 68.02346 0.000000       0.000000 
1 1 1 12  0  2  o 56.67924 40.44420 -5.812744      3.976561      -5.812744      3.976561      -5.812744      3.976561  56.67924 40.44420 56.67924 40.44420 0.000000       0.000000 
1 1 1 12  0  3  o 379.3800 32.05772 28.70498       4.645596      28.70498       4.645596      28.70498       4.645596  379.3800 32.05772 379.3800 32.05772 0.000000       0.000000 
1 1 1 12  0  4  o 273.3884 57.43826 16.50272       5.369882      16.50272       5.369882      16.50272       5.369882  273.3884 57.43826 273.3884 57.43826 0.000000       0.000000 
1 1 1 12  0  5  o 1576.790 23.65676 484.5384       14.47894      484.5384       14.47894      484.5384       14.47894  1576.790 23.65676 1576.790 23.65676 0.000000       0.000000 
1 1 1 12  0  6  o 103.4013 63.67025 1.722733       4.979388      1.722733       4.979388      1.722733       4.979388  103.4013 63.67025 103.4013 63.67025 0.000000       0.000000 
1 1 1 12  0  7  o 853.1044 23.91224 142.0304       7.908207      142.0304       7.908207      142.0304       7.908207  853.1044 23.91224 853.1044 23.91224 0.000000       0.000000 
1 1 1 12  0  8  o 291.4691 41.12767 17.56379       4.388529      17.56379       4.388529      17.56379       4.388529  291.4691 41.12767 291.4691 41.12767 0.000000       0.000000 
1 1 1 12  0  9  o 149.6421 90.71643 4.489493       9.762110      4.489493       9.762110      4.489493       9.762110  149.6421 90.71643 149.6421 90.71643 0.000000       0.000000 
1 1 1 12  0  10 o 1180.986 35.70912 272.9137       16.34378      272.9137       16.34378      272.9137       16.34378  1180.986 35.70912 1180.986 35.70912 0.000000       0.000000 
1 1 1 12  0  11 o 437.3409 70.88601 40.53867       11.09095      40.53867       11.09095      40.53867       11.09095  437.3409 70.88601 437.3409 70.88601 0.000000       0.000000 
1 1 1 12  0  12 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 12  0  13 o 78.18282 54.40126 -5.273419      5.885351      -5.273419      5.885351      -5.273419      5.885351  78.18282 54.40126 78.18282 54.40126 0.000000       0.000000 
1 1 1 12  0  14 o 964.9018 25.32195 181.6599       9.473964      181.6599       9.473964      181.6599       9.473964  964.9018 25.32195 964.9018 25.32195 0.000000       0.000000 
1 1 1 12  0  15 f 1354.787 24.58712 357.8104       12.92659      357.8104       12.92659      357.8104       12.92659  1354.787 24.58712 1354.787 24.58712 0.000000       0.000000 
1 1 1 12  0  16 o 1163.354 24.94805 264.0528       11.25966      264.0528       11.25966      264.0528       11.25966  1163.354 24.94805 1163.354 24.94805 0.000000       0.000000 
1 1 1 12  0  17 o 1272.950 34.27094 317.5201       16.91426      317.5201       16.91426      317.5201       16.91426  1272.950 34.27094 1272.950 34.27094 0.000000       0.000000 
1 1 1 12  0  18 o 898.8524 26.28177 157.9792       9.156510      157.9792       9.156510      157.9792       9.156510  898.8524 26.28177 898.8524 26.28177 0.000000       0.000000 
1 1 1 12  0  19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 12  0  20 o 118.5297 72.35468 2.749118       6.306271      2.749118       6.306271      2.749118       6.306271  118.5297 72.35468 118.5297 72.35468 0.000000       0.000000 
1 1 1 12  0  21 o 393.1881 46.20906 31.87436       6.800674      31.87436       6.800674      31.87436       6.800674  393.1881 46.20906 393.1881 46.20906 0.000000       0.000000 
1 1 1 12  0  22 o 206.8169 82.50735 12.17244       6.415325      12.17244       6.415325      12.17244       6.415325  206.8169 82.50735 206.8169 82.50735 0.000000       0.000000 
1 1 1 12  0  23 o 283.7615 68.22898 18.96086       6.520360      18.96086       6.520360      18.96086       6.520360  283.7615 68.22898 283.7615 68.22898 0.000000       0.000000 
1 1 1 12  0  24 o 127.4151 74.41477 4.643966       6.126544      4.643966       6.126544      4.643966       6.126544  127.4151 74.41477 127.4151 74.41477 0.000000       0.000000 
1 1 1 12  0  25 o 178.4776 82.03587 10.20249       6.230622      10.20249       6.230622      10.20249       6.230622  178.4776 82.03587 178.4776 82.03587 0.000000       0.000000 
1 1 1 12  0  26 o 442.7169 39.51530 40.63791       6.669420      40.63791       6.669420      40.63791       6.669420  442.7169 39.51530 442.7169 39.51530 0.000000       0.000000 
1 1 1 12  0  27 o 450.0187 39.93655 42.31393       6.853148      42.31393       6.853148      42.31393       6.853148  450.0187 39.93655 450.0187 39.93655 0.000000       0.000000 
1 1 1 12  1  0  o 501.6753 22.07465 49.24049       4.300753      46.80007       5.083697      55.38396       8.065926  487.4676 26.95855 526.2447 39.76083 -38.77707      48.03839 
1 1 1 12  1  1  o 422.1530 21.35449 34.92531       3.489578      34.21162       4.775852      35.74274       5.111216  416.0132 29.75725 424.9001 31.19288 -8.886871      43.11020 
1 1 1 12  1  2  o 487.6625 18.83392 46.40562       3.566877      50.32136       5.064267      42.55096       5.024618  506.0832 25.85344 464.7869 27.96713 41.29630       38.08622 
1 1 1 12  1  3  o 270.1450 30.11516 14.50711       3.105667      15.36169       4.439063      13.68778       4.346551  274.9705 42.97633 258.7238 44.88693 16.24677       62.14339 
1 1 1 12  1  4  o 287.6382 28.49407 16.37453       3.141070      11.32175       3.886522      25.89063       5.333666  235.1499 44.18085 359.9794 38.76347 -124.8295      58.77546 
1 1 1 12  1  5  o 508.5243 23.90277 50.52368       4.720500      52.08563       7.462005      49.48156       6.095098  512.6594 37.74540 501.1710 31.47588 11.48840       49.14719 
1 1 1 12  1  6  o 588.0797 21.69721 67.46375       4.955278      64.01669       8.001246      69.60847       6.311299  569.3837 36.37461 596.5649 27.24163 -27.18127      45.44468 
1 1 1 12  1  7  o 559.0046 22.55383 60.94915       4.896252      75.45531       8.350533      53.34917       6.044270  619.1150 34.87282 521.2606 29.98439 97.85443       45.99106 
1 1 1 12  1  8  o 546.3641 25.05957 58.25291       5.317210      0.000000       0.000000      58.25291       5.317210  ?        ?        546.3641 25.05957 0.000000       25.05957 
1 1 1 12  1  9  o 972.2779 20.91673 184.1358       7.897910      185.9416       14.07973      183.3068       9.540208  973.7393 37.23261 969.3781 25.34175 4.361206       45.03856 
1 1 1 12  1  10 o 688.1226 28.74522 92.43610       7.681737      0.000000       0.000000      92.43610       7.681737  ?        ?        688.1226 28.74522 0.000000       28.74522 
1 1 1 12  1  11 o 1008.173 17.92423 197.7404       7.017844      187.0991       9.536458      210.3103       10.36465  979.7807 25.06284 1038.681 25.69476 -58.89996      35.89382 
1 1 1 12  1  12 o 765.5027 23.13211 114.1328       6.876858      110.4917       8.328589      121.9334       12.19042  752.6027 28.49559 787.8754 39.97220 -35.27264      49.08946 
1 1 1 12  1  13 o 846.3328 26.13834 139.6268       8.591067      139.6268       8.591067      0.000000       0.000000  846.3328 26.13834 ?        ?        0.000000       26.13834 
1 1 1 12  1  14 o 483.3372 30.70220 45.80137       5.733090      48.14877       6.975220      40.91363       10.06513  494.6471 36.56993 450.7576 58.90633 43.88943       69.33481 
1 1 1 12  1  15 o 826.3859 19.15011 132.9233       6.145853      129.2188       8.577406      136.8317       8.810371  813.8109 27.13967 837.4480 27.08996 -23.63715      38.34615 
1 1 1 12  1  16 o 440.8880 33.94421 38.26546       5.767265      36.13866       6.861157      43.38631       10.64646  426.8371 41.93243 463.1992 60.64105 -36.36209      73.72697 
1 1 1 12  1  17 o 381.3384 31.82186 28.63556       4.669590      25.98274       6.659210      31.20188       6.549746  359.5890 48.95841 395.9414 43.30154 -36.35245      65.36015 
1 1 1 12  1  18 o 507.2624 29.60292 50.45689       5.806372      47.53389       9.738819      52.06894       7.232387  487.2390 52.28521 514.0537 36.46468 -26.81467      63.74493 
1 1 1 12  1  19 o 1409.050 17.79531 386.4966       9.737779      398.8634       14.24235      375.6406       13.34410  1429.476 25.65528 1387.485 24.76468 41.99060       35.65786 
1 1 1 12  1  20 o 347.7836 35.01336 23.97713       4.664714      27.98601       6.553384      19.85997       6.641299  373.4020 46.17615 310.7578 57.13588 62.64423       73.46255 
1 1 1 12  1  21 o 500.4960 37.71917 49.63718       7.277577      0.000000       0.000000      49.63718       7.277577  ?        ?        500.4960 37.71917 0.000000       37.71917 
1 1 1 12  1  22 o 389.2168 31.62096 29.96508       4.738311      28.87633       6.598172      31.12444       6.808755  378.2395 45.85619 392.9997 45.45010 -14.76025      64.56393 
1 1 1 12  1  23 o 480.8735 38.10378 46.09383       7.057593      0.000000       0.000000      46.09383       7.057593  ?        ?        480.8735 38.10378 0.000000       38.10378 
1 1 1 12  1  24 o 131.4589 53.54502 1.604636       4.301838      -10.94345      5.914956      15.69443       6.267800  96.12400 47.07164 271.2856 60.97613 -175.1616      77.03134 
1 1 1 12  1  25 f 430.1134 28.46999 36.63715       4.728628      36.79830       6.661274      36.47345       6.713613  426.7976 40.68147 424.6755 41.22663 2.122101       57.91906 
1 1 1 12  1  26 o 526.0767 25.04946 54.49675       5.117706      47.48489       7.148671      61.86841       7.329786  485.2545 38.24390 556.2883 34.09285 -71.03387      51.23396 
1 1 1 12  1  27 o 303.0570 39.70922 18.80453       4.561066      16.28600       6.356819      21.47690       6.548077  272.4911 61.52637 317.2145 55.15603 -44.72339      82.62979 
1 1 1 12  2  0  o 624.3262 19.64387 76.13577       4.762847      71.84631       5.664871      86.48073       8.797374  605.5861 24.08719 660.5282 34.41430 -54.94208      42.00639 
1 1 1 12  2  1  o 300.0767 31.78911 17.93193       3.648166      19.51275       4.355225      14.21400       6.679137  311.9445 36.64888 257.6174 66.35497 54.32715       75.80318 
1 1 1 12  2  2  o 662.5187 18.64382 85.63451       4.796903      85.08621       5.866213      86.74101       8.333451  659.6029 22.90062 663.6484 32.33396 -4.045471      39.62226 
1 1 1 12  2  3  o 352.2326 27.80091 24.47354       3.772001      27.34713       4.483616      17.51410       6.977547  371.7019 31.35297 287.7845 64.07800 83.91748       71.33722 
1 1 1 12  2  4  o 606.5742 19.13135 71.75073       4.506689      72.94522       5.597700      69.55004       7.597972  610.9227 23.59366 593.7936 33.07974 17.12903       40.63164 
1 1 1 12  2  5  o 516.3820 23.68469 52.08647       4.749706      61.84631       7.943829      46.65595       5.925561  559.1927 36.78505 486.6248 31.52454 72.56784       48.44519 
1 1 1 12  2  6  o 1366.967 18.26814 364.0015       9.697956      366.6384       16.78901      362.6812       11.88048  1367.560 31.61190 1363.378 22.43828 4.182129       38.76582 
1 1 1 12  2  7  o 1052.164 19.47506 215.6731       7.957752      232.9873       12.99811      205.2926       10.06438  1090.928 30.68006 1025.378 25.27406 65.54968       39.74977 
1 1 1 12  2  8  o 200.6770 51.15213 8.281888       3.998336      -1.677898      9.591125      10.37686       4.398793  171.1153 75.10431 224.5128 51.54013 -53.39755      91.08810 
1 1 1 12  2  9  o 515.1697 22.42283 51.71826       4.486098      51.35722       9.892167      51.81173       5.033455  507.2437 50.90317 515.3992 25.14748 -8.155426      56.77613 
1 1 1 12  2  10 o 480.1332 26.47694 45.09926       4.917852      46.71729       7.085608      43.59535       6.831156  486.8552 37.77134 470.2171 37.72594 16.63809       53.38464 
1 1 1 12  2  11 o 881.4467 18.47572 151.1696       6.324487      147.9587       8.785738      154.6232       9.111506  871.1808 25.96821 890.5332 26.34584 -19.35236      36.99258 
1 1 1 12  2  12 o 1451.098 17.24027 409.5676       9.715584      404.9604       13.75344      414.1567       13.72641  1441.660 24.56521 1458.003 24.24213 -16.34253      34.51276 
1 1 1 12  2  13 o 1113.337 17.32741 241.1012       7.491838      239.4321       10.45129      242.8653       10.74493  1108.559 24.27633 1116.399 24.78312 -7.839966      34.69212 
1 1 1 12  2  14 o 866.9650 21.62473 146.3658       7.280821      152.1833       8.817410      133.8988       12.90784  883.5080 25.69819 826.3318 40.22268 57.17615       47.73114 
1 1 1 12  2  15 o 824.4169 26.51095 132.5860       8.487899      132.5860       8.487899      0.000000       0.000000  824.4169 26.51095 ?        ?        0.000000       26.51095 
1 1 1 12  2  16 o 1670.487 17.82180 543.0573       11.56173      568.7802       17.04357      521.1295       15.73609  1707.554 25.70148 1634.725 24.78700 72.82910       35.70660 
1 1 1 12  2  17 o 323.9702 37.26903 20.84690       4.603574      20.74395       6.557546      20.94694       6.464328  319.1727 54.88250 321.0440 53.74780 -1.871338      76.81741 
1 1 1 12  2  18 o 1347.498 17.37834 353.3710       9.094198      369.5211       13.26031      339.0290       12.49597  1376.343 24.80842 1318.431 24.40533 57.91187       34.80054 
1 1 1 12  2  19 o 663.9684 31.64254 86.29369       8.159185      0.000000       0.000000      86.29369       8.159185  ?        ?        663.9684 31.64254 0.000000       31.64254 
1 1 1 12  2  20 f 525.2437 47.26809 55.07534       9.538498      55.07534       9.538498      0.000000       0.000000  525.2437 47.26809 ?        ?        0.000000       47.26809 
1 1 1 12  2  21 o 298.8635 41.72288 17.98654       4.710504      15.23172       6.510341      21.01325       6.824041  269.2599 63.32211 319.0701 57.17146 -49.81018      85.31275 
1 1 1 12  2  22 o 394.9225 31.87897 30.85825       4.847602      33.55422       6.712286      27.91917       7.008386  408.9590 42.90230 370.4565 49.99051 38.50250       65.87608 
1 1 1 12  2  23 o 632.9373 22.28596 78.34432       5.477974      78.71169       7.523698      77.92984       7.991498  632.4300 30.63310 627.8275 32.89071 4.602539       44.94647 
1 1 1 12  2  24 o 221.3611 52.72027 10.32814       4.467309      14.30657       6.212880      6.069347       6.428071  258.3079 62.59063 184.7700 68.04512 73.53789       92.45390 
1 1 1 12  2  25 o 655.1229 22.13569 84.13845       5.631757      87.78239       7.876092      80.32617       8.055968  666.3424 30.43584 635.7408 32.74062 30.60156       44.70222 
1 1 1 12  2  26 o 354.4261 35.15800 25.29778       4.775396      19.49685       6.762157      31.06886       6.744737  300.5162 60.04197 388.7097 45.54308 -88.19351      75.36053 
1 1 1 12  2  27 o 650.6666 25.25252 83.51588       6.381035      77.19853       7.589816      98.74752       11.78521  622.1287 31.51684 695.4482 43.86064 -73.31952      54.00988 
1 1 1 12  3  0  o 413.9334 25.15556 33.70743       4.024656      37.21670       4.791415      25.29850       7.416955  434.2274 28.57269 348.7759 56.70653 85.45151       63.49826 
1 1 1 12  3  1  o 547.1952 21.24879 58.51354       4.515486      60.43491       5.404384      54.07069       8.218110  555.4168 25.05527 520.0184 41.02675 35.39844       48.07246 
1 1 1 12  3  2  o 792.4526 21.76476 122.7084       6.698156      122.7084       6.698156      0.000000       0.000000  792.4526 21.76476 ?        ?        0.000000       21.76476 
1 1 1 12  3  3  o 195.3979 54.94725 7.911597       4.343983      7.911597       4.343983      0.000000       0.000000  195.3979 54.94725 ?        ?        0.000000       54.94725 
1 1 1 12  3  4  o 477.6840 25.38663 44.75606       4.692582      44.75606       4.692582      0.000000       0.000000  477.6840 25.38663 ?        ?        0.000000       25.38663 
1 1 1 12  3  5  o 667.3751 22.67669 86.94510       5.877296      90.50848       7.059204      78.89471       10.61043  680.2137 26.72282 629.8139 43.64958 50.39978       51.18003 
1 1 1 12  3  6  o 1210.281 19.16728 285.4054       9.008964      283.1284       10.95968      290.1495       15.81981  1204.423 23.43099 1216.023 33.49896 -11.59998      40.88021 
1 1 1 12  3  7  o 614.3169 26.39247 73.71276       6.296519      59.97965       10.67207      81.04592       7.798480  547.6371 50.75663 643.3967 31.21067 -95.75964      59.58474 
1 1 1 12  3  8  o 392.4946 36.04657 30.45847       5.433069      20.66231       9.498282      35.22239       6.623676  312.9733 78.33183 421.2729 41.00603 -108.2996      88.41589 
1 1 1 12  3  9  o 467.7577 24.90826 42.78778       4.508424      40.15950       9.132007      43.63483       5.184270  447.3289 53.63629 471.8798 28.42233 -24.55096      60.70157 
1 1 1 12  3  10 o 1372.951 17.06736 366.6955       9.100167      363.8011       12.93613      369.5312       12.80404  1366.217 24.38129 1377.026 23.94291 -10.80896      34.17178 
1 1 1 12  3  11 o 1543.756 17.49848 463.5916       10.49076      461.9219       14.90441      465.2310       14.76888  1539.552 24.92828 1545.128 24.61248 -5.575439      35.03131 
1 1 1 12  3  12 o 598.7882 23.05579 69.83311       5.361437      75.03839       7.609597      64.70209       7.555130  619.0643 31.75866 574.3607 34.02271 44.70367       46.54200 
1 1 1 12  3  13 f 833.1573 22.03704 135.1687       7.130308      138.2032       8.702451      128.9705       12.43728  841.9143 26.61618 811.3134 39.47380 30.60089       47.60884 
1 1 1 12  3  14 o 641.9633 21.04467 80.24443       5.246628      79.21379       7.525285      81.21927       7.318732  636.8728 30.42582 645.0285 29.21655 -8.155701      42.18219 
1 1 1 12  3  15 o 289.2412 49.18773 16.94474       5.327346      22.55697       6.456024      4.968595       9.430965  334.2246 51.38455 203.1770 80.46480 131.0476       95.47227 
1 1 1 12  3  16 o 961.7508 25.31335 180.4191       9.454535      180.4191       9.454535      0.000000       0.000000  961.7508 25.31335 ?        ?        0.000000       25.31335 
1 1 1 12  3  17 o 678.0995 25.00759 89.69167       6.585567      86.34734       7.932669      97.10785       11.81286  664.5709 30.73619 701.0566 43.60446 -36.48578      53.34850 
1 1 1 12  3  18 f 620.1762 22.26957 74.96354       5.363582      79.05423       7.622658      70.95217       7.548387  635.7812 30.87243 601.2434 32.44792 34.53778       44.78810 
1 1 1 12  3  19 o 838.9008 27.06196 137.4719       8.816532      137.4719       8.816532      0.000000       0.000000  838.9008 27.06196 ?        ?        0.000000       27.06196 
1 1 1 12  3  20 o 346.6762 36.82900 23.88916       4.882471      33.16582       6.864176      14.38927       6.946269  407.3322 44.09616 261.7854 67.78873 145.5468       80.86893 
1 1 1 12  3  21 f 519.3196 29.30839 53.02353       5.886765      64.22581       9.662118      46.41047       7.423704  567.4783 44.19093 483.1298 39.92432 84.34848       59.55492 
1 1 1 12  3  22 o 671.3854 30.42473 88.55631       7.932803      88.55631       7.932803      0.000000       0.000000  671.3854 30.42473 ?        ?        0.000000       30.42473 
1 1 1 12  3  23 o 612.0062 22.99346 73.29211       5.464975      68.05991       7.380661      79.64222       8.130990  586.6496 32.52309 634.5371 33.11057 -47.88751      46.41186 
1 1 1 12  3  24 o 443.7847 29.02627 38.94836       4.974991      43.69792       6.874709      33.72630       7.208557  467.1683 38.22727 407.0198 46.43538 60.14844       60.14623 
1 1 1 12  3  25 o 111.4619 50.05116 -1.702063      4.509402      -1.284918      6.080273      -2.211983      6.722496  133.2109 59.07337 135.8265 61.04251 -2.615540      84.94617 
1 1 1 12  3  26 o 192.3244 63.08409 7.737071       5.440951      2.834869       6.608470      18.05306       9.586514  160.9167 66.04765 279.1758 82.61199 -118.2591      105.7688 
1 1 1 12  3  27 o 469.2115 28.22730 43.75390       5.119651      55.98311       7.254240      31.61837       7.226402  527.5038 35.61969 389.5297 48.84377 137.9741       60.45226 
1 1 1 12  4  0  o 419.3846 24.35146 34.55881       3.949041      31.06171       4.723480      42.67887       7.197598  396.0602 30.95561 461.7060 40.55247 -65.64575      51.01717 
1 1 1 12  4  1  o 857.7270 17.50856 143.4541       5.832133      146.6293       7.111895      136.9343       10.19092  866.3405 21.13824 834.1382 31.45918 32.20221       37.90126 
1 1 1 12  4  2  o 139.4777 52.83193 2.910722       3.931023      2.910722       3.931023      0.000000       0.000000  139.4777 52.83193 ?        ?        0.000000       52.83193 
1 1 1 12  4  3  o 429.9580 25.93765 36.31300       4.310688      36.31300       4.310688      0.000000       0.000000  429.9580 25.93765 ?        ?        0.000000       25.93765 
1 1 1 12  4  4  o 671.7208 20.30996 88.01000       5.298170      88.01000       5.298170      0.000000       0.000000  671.7208 20.30996 ?        ?        0.000000       20.30996 
1 1 1 12  4  5  o 522.6054 27.04631 53.55986       5.470415      58.62590       6.623820      42.69188       9.701716  545.9202 31.37481 458.8450 55.57820 87.07520       63.82253 
1 1 1 12  4  6  o 241.8470 50.76669 12.03630       4.616209      12.97071       5.297628      9.088811       9.408903  250.2375 55.92070 226.6107 82.49426 23.62683       99.66156 
1 1 1 12  4  7  o 318.3969 46.31986 20.42665       5.559568      12.99614       9.139573      24.79107       7.004533  253.5841 81.66171 349.5487 53.28452 -95.96465      97.50833 
1 1 1 12  4  8  o 991.8832 36.46165 192.9393       14.04510      192.9393       14.04510      0.000000       0.000000  991.8832 36.46165 ?        ?        0.000000       36.46165 
1 1 1 12  4  9  o 488.1697 29.76412 46.72205       5.615808      51.16895       9.746876      44.51225       6.870889  506.6755 50.19489 475.0794 37.54676 31.59616       62.68402 
1 1 1 12  4  10 o 1164.458 19.82348 263.9362       8.964614      272.3377       16.17513      260.2114       10.77000  1179.746 35.30459 1155.560 23.99911 24.18579       42.68924 
1 1 1 12  4  11 o 1120.622 25.20195 244.7533       10.96784      248.4247       15.40949      240.9837       15.61428  1127.010 35.20729 1109.768 36.22946 17.24243       50.51858 
1 1 1 12  4  12 o 1122.970 17.18486 245.2857       7.494490      236.3079       10.50241      254.6008       10.69791  1101.253 24.55692 1143.157 24.09712 -41.90369      34.40514 
1 1 1 12  4  13 o 284.4112 41.02573 16.18025       4.400340      16.60698       6.596317      15.83809       5.906680  284.0187 61.57839 278.1374 56.60865 5.881256       83.64471 
1 1 1 12  4  14 o 1568.263 17.40190 478.4929       10.59848      470.2829       14.79951      487.1361       15.18494  1553.269 24.53424 1580.806 24.73469 -27.53699      34.83869 
1 1 1 12  4  15 o 525.7822 24.18170 53.89415       4.937654      47.48719       6.944121      60.44624       7.022329  490.9410 36.68679 554.9642 32.72763 -64.02319      49.16318 
1 1 1 12  4  16 o 129.6678 53.26135 1.154474       4.301435      5.150553       6.277336      -2.382733      5.905934  180.4598 67.09153 128.6041 57.54666 51.85564       88.39056 
1 1 1 12  4  17 f 682.8804 25.23274 90.97275       6.691710      89.35256       7.967957      94.85049       12.32692  676.0707 30.34778 692.0622 46.12931 -15.99146      55.21685 
1 1 1 12  4  18 f 855.9560 26.56248 143.0374       8.829743      143.0374       8.829743      0.000000       0.000000  855.9560 26.56248 ?        ?        0.000000       26.56248 
1 1 1 12  4  19 o 906.0223 18.74529 159.8660       6.595672      160.3391       9.337216      159.3948       9.318190  906.0240 26.53687 903.3472 26.56127 2.676819       37.54606 
1 1 1 12  4  20 o 656.0905 21.96814 83.97507       5.597384      86.56585       7.974620      81.45923       7.858450  664.6243 30.89626 644.6276 31.39063 19.99670       44.04487 
1 1 1 12  4  21 o 358.0896 35.62386 25.49355       4.888291      23.08386       6.602478      28.41681       7.272110  336.0388 52.29340 373.8264 51.45506 -37.78754      73.36363 
1 1 1 12  4  22 o 315.8248 40.16866 20.07111       4.815283      20.93261       6.560328      19.06483       7.090172  318.0452 55.11071 300.7145 62.74121 17.33069       83.50838 
1 1 1 12  4  23 o 823.0994 22.42927 132.5478       7.169607      137.7510       11.54606      129.2824       9.146718  834.3443 35.63367 810.8407 29.04703 23.50360       45.97269 
1 1 1 12  4  24 o 160.9388 57.77086 4.684402       4.593278      6.364604       6.119158      2.515707       6.952005  185.0376 66.65235 163.8412 67.55280 21.19640       94.89951 
1 1 1 12  4  25 o 293.9446 51.45324 18.11786       5.659640      26.75779       6.564570      -6.900114      11.17062  360.0292 48.15718 160.2765 74.47729 199.7527       88.69037 
1 1 1 12  4  26 o 456.7481 29.27612 41.48080       5.165657      46.05722       7.297657      36.88505       7.313051  476.7936 39.77476 423.7986 45.12778 52.99496       60.15437 
1 1 1 12  5  0  f 701.6288 18.81055 96.05830       5.125509      100.3434       6.293926      87.62122       8.831561  716.3284 22.62463 665.5124 34.28718 50.81604       41.07900 
1 1 1 12  5  1  o 598.9682 19.77415 70.02090       4.599701      67.50856       5.498134      75.87990       8.396300  587.3972 24.10213 619.2048 35.06004 -31.80762      42.54549 
1 1 1 12  5  2  o 434.4835 26.56255 37.10749       4.460464      37.10749       4.460464      0.000000       0.000000  434.4835 26.56255 ?        ?        0.000000       26.56255 
1 1 1 12  5  3  o 97.78075 43.51195 -1.170761      3.326596      -0.4206559     3.825048      -3.499350      6.739419  110.8197 48.05180 132.5535 60.19284 -21.73379      77.02048 
1 1 1 12  5  4  o 497.4082 25.74670 48.50287       4.956469      49.52220       6.518449      47.10576       7.631398  500.9448 33.70231 486.7014 40.75011 14.24335       52.88116 
1 1 1 12  5  5  o 740.7842 16.50479 106.8339       4.748206      104.0537       5.563062      114.2938       9.112699  730.6928 19.60429 763.7745 30.72231 -33.08173      36.44432 
1 1 1 12  5  6  o 202.3796 50.59564 8.442680       3.965883      -7.046651      9.305652      11.88039       4.383943  147.8621 68.45275 240.7821 48.55859 -92.92000      83.92685 
1 1 1 12  5  7  o 235.2619 46.38984 11.29617       4.087777      10.77202       9.456026      11.41663       4.533246  238.9858 83.14561 235.6912 51.00698 3.294617       97.54437 
1 1 1 12  5  8  o 927.6385 16.92255 167.4373       6.096387      153.6773       12.79425      171.4792       6.934194  885.2091 37.21696 938.5128 19.02514 -53.30371      41.79782 
1 1 1 12  5  9  o 738.2748 29.39595 106.4375       8.428174      92.48719       11.23261      124.4098       12.74943  684.8336 42.44367 794.9177 41.44262 -110.0841      59.32079 
1 1 1 12  5  10 f 1359.488 25.27215 360.2762       13.34275      353.0853       18.36485      368.3158       19.41818  1343.406 35.20077 1371.702 36.45195 -28.29651      50.67385 
1 1 1 12  5  11 o 216.3697 59.09244 9.575303       5.105551      -7.326818      8.836078      18.04646       6.255475  143.0491 66.39330 297.4630 56.20988 -154.4139      86.99208 
1 1 1 12  5  12 o 146.6911 58.25584 2.317254       4.956066      12.29491       9.251440      -1.698657      5.869310  250.6700 82.26152 131.9241 58.29350 118.7459       100.8221 
1 1 1 12  5  13 o 986.1671 20.16055 189.3124       7.721129      174.2810       13.41756      196.7542       9.440913  943.5168 36.61810 1004.814 24.19359 -61.29736      43.88866 
1 1 1 12  5  14 o 889.9135 18.14431 154.1119       6.270704      146.4085       8.929646      161.6066       8.807837  866.3168 26.54175 910.4223 24.91142 -44.10553      36.40114 
1 1 1 12  5  15 o 340.7716 34.59241 22.96556       4.514503      21.57117       6.564122      24.21710       6.218809  325.9950 53.72026 347.3961 47.32672 -21.40109      71.59388 
1 1 1 12  5  16 o 527.3601 23.91305 54.22717       4.897453      51.33397       6.989181      57.01815       6.864588  510.6363 35.46405 538.7719 32.96673 -28.13559      48.42008 
1 1 1 12  5  17 o 712.2326 20.19616 98.80071       5.586229      87.54890       7.760823      110.8982       8.047199  669.2493 29.86014 753.6037 27.49627 -84.35437      40.59154 
1 1 1 12  5  18 o 930.3316 21.30783 168.6654       7.698481      166.3972       9.119400      174.2906       14.36154  923.3561 25.43133 941.7006 39.26992 -18.34448      46.78546 
1 1 1 12  5  19 o 685.6612 29.62192 91.98782       7.887705      91.98782       7.887705      0.000000       0.000000  685.6612 29.62192 ?        ?        0.000000       29.62192 
1 1 1 12  5  20 o 386.0189 33.10568 29.46173       4.914918      33.68666       6.984455      25.31740       6.917516  410.1569 44.56561 352.8315 52.04712 57.32544       68.52004 
1 1 1 12  5  21 o 293.6693 43.51303 17.46062       4.812393      19.02043       6.568192      15.65279       7.071102  302.4992 58.02133 271.6523 67.35863 30.84695       88.90253 
1 1 1 12  5  22 o 488.2951 27.38497 46.90987       5.172096      47.38538       7.103694      46.37342       7.545147  487.9291 37.78320 481.7201 40.71282 6.208954       55.54371 
1 1 1 12  5  23 o 341.0992 37.98000 23.36290       4.945680      28.38686       6.628727      17.05472       7.427773  373.4583 46.72743 281.0134 68.64948 92.44492       83.04339 
1 1 1 12  5  24 o 154.7420 63.59493 2.262078       6.136566      -1.175795      7.562793      8.888080       10.49937  149.8073 66.18453 223.4384 85.93307 -73.63106      108.4661 
1 1 1 12  5  25 o 124.6591 53.45877 0.2340359      4.633422      -2.812598      6.133462      4.283813       7.071492  126.2277 57.35988 174.4083 69.48458 -48.18059      90.10140 
1 1 1 12  5  26 o 740.4037 21.35558 107.6125       6.140560      103.6663       8.544117      111.8283       8.831120  722.6746 30.44363 750.6654 30.29294 -27.99084      42.94738 
1 1 1 12  6  0  o 481.9679 23.75264 45.43924       4.445883      49.46050       5.491408      37.78898       7.574265  501.2951 28.32327 433.0516 45.72895 68.24350       53.78982 
1 1 1 12  6  1  o 464.9644 25.53586 42.44141       4.593371      42.44141       4.593371      0.000000       0.000000  464.9644 25.53586 ?        ?        0.000000       25.53586 
1 1 1 12  6  2  o 170.2249 56.18093 5.619820       4.312868      15.84555       5.468547      -11.20644      7.014853  277.0348 52.75554 109.5336 53.10244 167.5012       74.85329 
1 1 1 12  6  3  o 344.0108 28.69097 23.33886       3.798089      26.03272       4.404335      15.52411       7.501529  362.8885 31.56655 270.6374 70.62431 92.25107       77.35786 
1 1 1 12  6  4  f 436.9727 22.65349 37.36346       3.831110      36.50847       4.411706      39.98564       7.726024  431.3241 26.46542 447.1902 45.10332 -15.86609      52.29462 
1 1 1 12  6  5  o 318.0080 28.27807 19.93205       3.455894      21.67014       4.030670      15.10801       6.715011  331.0789 31.73749 268.6714 65.05171 62.40756       72.38089 
1 1 1 12  6  6  o 431.9684 27.04277 36.59284       4.513751      18.14482       10.34170      40.93418       5.016822  293.3192 85.52428 456.7440 28.42406 -163.4248      90.12396 
1 1 1 12  6  7  o 1001.740 16.93872 195.2789       6.589666      175.8368       13.66268      201.1726       7.522451  946.6401 37.16405 1016.450 19.05660 -69.80981      41.76507 
1 1 1 12  6  8  f 1224.495 25.78117 292.4897       12.25992      291.2589       17.14297      293.7783       17.54015  1219.198 36.20626 1224.249 36.89228 -5.050659      51.69075 
1 1 1 12  6  9  o 484.2107 23.69165 45.68948       4.455101      41.51121       10.07522      46.70500       4.967087  453.9478 58.51274 488.6661 26.26990 -34.71826      64.13929 
1 1 1 12  6  10 o 1105.520 16.56706 237.7115       7.112790      209.4550       14.82474      246.1613       8.106830  1034.352 36.90548 1124.760 18.55937 -90.40820      41.30938 
1 1 1 12  6  11 o 762.5961 18.39922 113.1499       5.449065      111.7490       12.15579      113.5022       6.095842  753.6427 41.69473 763.5934 20.55623 -9.950745      46.48666 
1 1 1 12  6  12 o 987.3581 20.37906 189.7711       7.814239      184.4269       14.05543      192.1619       9.401043  970.5225 37.29155 993.0256 24.37741 -22.50311      44.55241 
1 1 1 12  6  13 o 843.5032 20.92809 138.5443       6.855580      142.7244       12.45524      136.7275       8.211361  853.4808 37.57771 837.4203 25.24897 16.06049       45.27245 
1 1 1 12  6  14 o 519.3566 27.62663 52.79607       5.552095      71.79945       10.76157      45.90322       6.481266  601.9512 46.39247 482.9898 34.78657 118.9614       57.98592 
1 1 1 12  6  15 o 295.3763 46.01864 17.58801       5.106868      16.99650       9.286688      17.84443       6.114384  285.1270 80.39649 295.3908 55.33346 -10.26373      97.59809 
1 1 1 12  6  16 o 385.0611 30.68526 29.17175       4.550584      36.99445       6.681476      22.40360       6.214828  432.0901 40.28146 333.2354 49.52953 98.85474       63.84177 
1 1 1 12  6  17 o 696.9391 20.29436 94.61259       5.492856      87.28380       7.659535      102.3720       7.881354  668.2374 29.51506 723.9271 28.03355 -55.68970      40.70649 
1 1 1 12  6  18 o 538.9766 24.34916 56.68061       5.096616      57.80388       7.198244      55.55141       7.217200  541.9389 34.37976 531.0613 35.19366 10.87762       49.19920 
1 1 1 12  6  19 o 547.3282 24.36690 58.48558       5.179361      55.32628       7.085379      62.11100       7.590084  529.7899 34.62799 561.3782 34.98878 -31.58826      49.22715 
1 1 1 12  6  20 o 418.7407 36.78812 34.79020       5.921809      29.19907       6.943796      49.70210       11.34001  380.3517 48.08343 493.1993 60.47257 -112.8476      77.25897 
1 1 1 12  6  21 o 457.7730 38.89585 41.72596       6.849335      41.72596       6.849335      0.000000       0.000000  457.7730 38.89585 ?        ?        0.000000       38.89585 
1 1 1 12  6  22 f 1045.200 20.80175 213.4203       8.443593      218.2441       10.44525      204.3243       14.34328  1055.346 25.48567 1016.388 36.33798 38.95758       44.38433 
1 1 1 12  6  23 o 265.1889 54.09142 14.76263       5.381976      12.85097       6.321637      19.79768       10.25949  244.5504 65.32493 297.4900 84.71992 -52.93958      106.9804 
1 1 1 12  6  24 o 176.0179 57.70349 6.255268       4.552621      17.00615       6.004442      -8.282944      6.982422  283.1678 56.58020 116.2096 55.45822 166.9583       79.22710 
1 1 1 12  6  25 o 331.2599 39.45385 22.31277       4.975742      17.88211       6.576339      28.24533       7.609758  287.4387 60.81107 366.0368 55.25265 -78.59811      82.16351 
1 1 1 12  6  26 o 810.8384 23.03150 129.3315       7.252447      120.9690       11.46037      134.9175       9.366550  775.5853 38.04882 824.9172 29.23757 -49.33197      47.98487 
1 1 1 12  7  0  o 467.9470 42.12376 43.76536       7.573069      0.000000       0.000000      43.76536       7.573069  ?        ?        467.9470 42.12376 0.000000       42.12376 
1 1 1 12  7  1  o 592.0275 23.80908 68.50423       5.474097      70.47004       6.873639      65.09550       9.051335  599.4133 29.52789 572.0800 41.01279 27.33325       50.53658 
1 1 1 12  7  2  o 605.2899 19.27980 71.42702       4.532043      72.82029       5.212288      67.10978       9.175159  610.8003 21.97360 581.3055 40.90325 29.49475       46.43183 
1 1 1 12  7  3  o 261.7655 35.15694 13.70145       3.483630      12.53587       3.966552      17.63297       7.284894  248.5143 42.63427 289.6635 66.20428 -41.14926      78.74445 
1 1 1 12  7  4  o 1372.739 16.04223 366.7850       8.552256      356.1706       9.725609      402.9846       17.96058  1352.193 18.52038 1433.689 32.25800 -81.49573      37.19654 
1 1 1 12  7  5  o 414.5714 25.24014 33.67752       4.044327      31.78883       5.377830      36.13625       6.135942  401.0578 34.87525 427.2728 37.35382 -26.21500      51.10373 
1 1 1 12  7  6  o 429.0790 29.48591 36.16190       4.883552      37.61678       5.450572      30.24043       10.99618  437.1695 32.33375 379.6335 77.21355 57.53598       83.71024 
1 1 1 12  7  7  o 311.0433 38.24221 19.26121       4.522160      19.86152       9.977888      19.10603       5.073101  306.9984 82.09739 308.6583 43.53084 -1.659912      92.92424 
1 1 1 12  7  8  o 171.2301 53.35212 5.772614       3.929684      -3.681221      9.177819      7.894873       4.348452  159.5164 71.53263 196.7868 54.84812 -37.27045      90.14008 
1 1 1 12  7  9  o 386.3022 28.15124 29.27250       4.194242      23.98195       9.725448      30.48131       4.648774  339.1408 75.75339 393.8821 30.63188 -54.74124      81.71223 
1 1 1 12  7  10 o 184.1191 51.95917 6.869616       3.877231      -2.487839      9.345229      8.815248       4.261292  166.2673 73.50827 207.3917 52.77685 -41.12440      90.49232 
1 1 1 12  7  11 o 710.3470 18.84823 98.19030       5.199591      83.28366       11.44855      102.0642       5.836238  649.2881 45.69437 724.0595 20.75538 -74.77142      50.18726 
1 1 1 12  7  12 o 823.9424 15.85927 132.0312       5.074674      128.5347       8.705624      133.8308       6.245521  811.6606 27.61833 829.2150 19.39428 -17.55432      33.74774 
1 1 1 12  7  13 o 508.7821 24.93533 50.47456       4.926912      46.41560       7.472552      53.59607       6.553055  484.7063 40.05634 522.5401 32.45252 -37.83377      51.55266 
1 1 1 12  7  14 o 541.3101 26.66441 57.18473       5.605393      47.54286       10.39320      61.13980       6.656503  486.4213 56.04347 558.4134 30.81388 -71.99213      63.95597 
1 1 1 12  7  15 o 932.4582 21.06633 169.3870       7.628625      147.0185       13.34705      180.2397       9.296841  865.1010 39.72743 961.2410 24.90434 -96.14008      46.88811 
1 1 1 12  7  16 o 320.5067 42.61783 20.55922       5.173133      34.56844       10.05218      15.51238       6.033416  410.8405 65.17886 274.1878 58.44750 136.6527       87.54652 
1 1 1 12  7  17 o 535.7159 24.42535 55.98893       5.081634      39.31810       7.138175      73.11913       7.235853  445.0569 41.78876 611.4131 30.47383 -166.3562      51.71996 
1 1 1 12  7  18 o 570.3344 23.58131 63.46191       5.223064      59.64629       7.458948      67.13287       7.316179  550.2678 35.08689 584.5109 32.35627 -34.24304      47.72859 
1 1 1 12  7  19 o 541.0548 24.25582 57.16936       5.096654      55.78432       7.085333      58.65445       7.336755  531.8376 34.49072 545.3223 34.82536 -13.48462      49.01444 
1 1 1 12  7  20 o 331.1309 37.37947 21.88646       4.722721      16.39765       6.570120      27.75457       6.793344  279.5077 62.13704 370.3337 48.39206 -90.82602      78.75787 
1 1 1 12  7  21 o 247.5431 64.65481 12.99633       6.283371      12.99633       6.283371      0.000000       0.000000  247.5431 64.65481 ?        ?        0.000000       64.65481 
1 1 1 12  7  22 o 395.2554 43.84759 31.54759       6.617146      31.54759       6.617146      0.000000       0.000000  395.2554 43.84759 ?        ?        0.000000       43.84759 
1 1 1 12  7  23 o 517.3857 26.02679 52.70923       5.212835      55.05740       7.062892      49.89963       7.725746  525.9926 34.77221 498.5816 40.24321 27.41092       53.18480 
1 1 1 12  7  24 o 288.7718 43.31606 17.12312       4.707878      20.14155       6.282142      13.25628       7.110415  309.3134 54.27714 245.5589 70.71956 63.75458       89.14743 
1 1 1 12  7  25 o 792.0397 20.33475 122.9700       6.254807      120.8876       8.356709      125.6228       9.431816  782.2547 27.50800 795.8610 30.51618 -13.60632      41.08439 
1 1 1 12  7  26 o 174.8757 60.80168 6.116640       5.056237      -0.7025887     7.559129      11.63803       6.801868  149.5248 66.10861 228.5143 70.02654 -78.98955      96.30194 
1 1 1 12  8  0  o 564.0117 21.38911 62.08854       4.684991      63.52180       5.467757      58.13007       9.086785  569.9961 24.70070 539.6928 43.73062 30.30328       50.22441 
1 1 1 12  8  1  o 792.1567 17.29947 122.2381       5.321962      125.8124       6.265950      112.9835       10.08261  803.2089 20.08771 758.0607 34.24845 45.14819       39.70481 
1 1 1 12  8  2  o 550.9348 20.58244 59.18972       4.403774      60.81822       5.135555      54.66557       8.559786  558.0770 23.69547 524.2444 42.40693 33.83258       48.57801 
1 1 1 12  8  3  o 1177.452 15.89409 269.8445       7.267864      261.6188       8.246757      298.4541       15.37984  1158.916 18.32328 1233.812 32.09778 -74.89600      36.95957 
1 1 1 12  8  4  o 625.5874 20.35575 76.26817       4.945420      80.96680       5.874744      64.84000       9.162027  644.1854 23.48281 572.1302 41.51799 72.05524       47.69891 
1 1 1 12  8  5  o 262.3713 46.26341 13.98001       4.541646      14.10648       4.954123      13.31400       11.36882  262.6647 50.39959 262.7553 91.18201 -0.9057617E-01 104.1839 
1 1 1 12  8  6  o 817.3282 17.13506 130.0000       5.438889      131.7799       7.404673      127.9146       8.015034  822.1559 23.19123 809.6712 25.48993 12.48468       34.46113 
1 1 1 12  8  7  o 993.2342 21.26620 192.1569       8.202942      164.6772       13.63772      207.7346       10.26804  916.2743 38.32555 1031.984 25.62043 -115.7098      46.10048 
1 1 1 12  8  8  o 861.4559 17.99884 144.4015       6.021512      131.6225       12.85140      147.9962       6.816002  819.0090 40.40488 871.8840 20.12997 -52.87500      45.14167 
1 1 1 12  8  9  f 1022.566 16.74718 203.3932       6.650604      196.9745       14.79592      205.0184       7.445102  1002.693 37.99673 1026.426 18.67734 -23.73279      42.33904 
1 1 1 12  8  10 o 925.3201 16.84875 166.5473       6.054633      177.0632       13.63949      163.9665       6.756845  950.9462 36.93296 917.9110 18.95463 33.03522       41.51291 
1 1 1 12  8  11 o 284.8071 36.80731 16.14149       3.975857      31.39481       9.986393      13.26834       4.334162  391.2297 68.20765 256.1104 45.23015 135.1193       81.84161 
1 1 1 12  8  12 o 379.6993 28.27592 28.29700       4.139627      35.39771       10.14387      26.87816       4.534385  416.6749 64.79221 369.4496 31.91689 47.22522       72.22685 
1 1 1 12  8  13 o 599.5153 21.77880 70.02486       5.070633      74.20621       7.649876      66.74812       6.772019  615.1255 32.13458 583.6953 29.97586 31.43018       43.94523 
1 1 1 12  8  14 o 626.4608 21.43909 76.46420       5.215888      80.84502       7.850080      73.00143       6.979235  642.9059 31.44117 611.2009 29.40328 31.70496       43.04765 
1 1 1 12  8  15 o 538.0897 23.89793 56.46562       4.993935      55.59546       7.420279      57.18608       6.751921  531.2562 36.18114 539.5967 32.36993 -8.340515      48.54778 
1 1 1 12  8  16 o 225.0257 58.34143 10.46412       5.140924      16.27699       10.09398      8.428198       5.973752  280.0034 85.20848 206.4531 65.97198 73.55032       107.7626 
1 1 1 12  8  17 o 600.6876 26.52243 70.46946       6.187141      61.42265       11.32087      74.32252       7.388138  553.6152 53.31467 615.4810 31.00909 -61.86584      61.67672 
1 1 1 12  8  18 o 619.6258 25.57173 74.99467       6.153435      63.57405       11.15048      79.99578       7.378742  563.2474 51.54773 639.2906 29.72050 -76.04315      59.50190 
1 1 1 12  8  19 o 309.9667 38.87309 19.23158       4.576500      17.06674       6.446190      21.43164       6.498423  286.2230 59.91462 323.4972 53.60285 -37.27426      80.39296 
1 1 1 12  8  20 o 862.0522 20.91953 145.0581       7.003474      144.5121       8.781612      146.0123       11.60865  859.1196 26.32041 860.9422 34.71999 -1.822571      43.56882 
1 1 1 12  8  21 o 384.9456 36.62447 29.55361       5.409191      31.55052       6.604006      25.48298       9.428880  395.7102 43.70295 344.3792 72.77924 51.33102       84.89266 
1 1 1 12  8  22 o 488.8744 60.80721 49.71015       11.29520      0.000000       0.000000      49.71015       11.29520  ?        ?        488.8744 60.80721 0.000000       60.80721 
1 1 1 12  8  23 o 589.7314 31.88870 68.96916       7.276159      68.96916       7.276159      0.000000       0.000000  589.7314 31.88870 ?        ?        0.000000       31.88870 
1 1 1 12  8  24 o 216.6412 55.33887 10.05787       4.672649      6.786647       6.012882      15.04510       7.424336  186.5924 66.19127 260.0954 71.35216 -73.50294      97.32632 
1 1 1 12  8  25 o 583.0836 26.45994 67.12634       5.991666      60.43914       8.702422      73.15343       8.261735  545.4317 41.39260 603.8428 35.38503 -58.41107      54.45592 
1 1 1 12  8  26 f 428.3900 32.87425 36.82917       5.427478      31.39548       8.123199      41.21099       7.294697  383.6657 56.18360 448.6449 42.36906 -64.97919      70.36856 
1 1 1 12  9  0  o 778.1152 19.80005 118.0494       5.983262      116.7166       7.173319      121.0967       10.84683  772.9898 23.89563 784.5236 35.60154 -11.53375      42.87738 
1 1 1 12  9  1  o 246.1084 43.57838 12.31885       4.012663      9.558775       4.580578      21.42521       8.320178  214.6559 54.76884 319.0979 69.13776 -104.4420      88.20235 
1 1 1 12  9  2  o 329.4182 31.10502 21.44545       3.932195      22.50612       4.535585      18.23561       7.890139  336.7354 35.20340 294.2003 70.06192 42.53506       78.40888 
1 1 1 12  9  3  o 856.3757 19.53470 142.8835       6.496794      142.8835       6.496794      0.000000       0.000000  856.3757 19.53470 ?        ?        0.000000       19.53470 
1 1 1 12  9  4  o 607.7964 19.24387 71.94955       4.542329      77.48509       5.197285      54.04496       9.347130  630.5381 21.22449 520.9658 46.69548 109.5723       51.29276 
1 1 1 12  9  5  o 234.5366 42.98103 11.15854       3.770582      10.70569       4.658253      12.01904       6.421278  227.8964 53.54176 240.9654 66.46189 -13.06905      85.34579 
1 1 1 12  9  6  o 485.7906 22.76403 45.99224       4.294634      40.78688       5.504895      54.08728       6.864884  455.6833 31.29671 524.5836 33.87797 -68.90033      46.12159 
1 1 1 12  9  7  o 254.4417 45.85922 13.12216       4.364818      10.39385       9.899821      13.78049       4.862998  239.4332 84.93271 260.0585 49.96668 -20.62531      98.54052 
1 1 1 12  9  8  o 699.4863 19.46312 95.23751       5.287127      71.84789       11.37281      101.6863       5.971674  601.7547 49.09322 722.6098 21.27964 -120.8551      53.50670 
1 1 1 12  9  9  o 1409.880 16.77252 386.6606       9.183504      377.8285       19.24201      389.2658       10.45052  1389.371 35.66189 1414.263 19.02742 -24.89233      40.42045 
1 1 1 12  9  10 o 689.5600 18.83012 92.53835       5.042585      83.89078       11.43336      94.62667       5.618562  651.4904 45.47476 697.1287 20.75316 -45.63824      49.98647 
1 1 1 12  9  11 o 193.9319 50.47328 7.700719       3.838119      -5.842960      9.433051      10.38773       4.201638  154.0074 70.42705 225.2045 49.39979 -71.19710      86.02505 
1 1 1 12  9  12 o 917.7639 16.88117 163.8833       6.016744      136.0912       13.07296      171.3525       6.777193  832.3713 40.44166 938.2429 18.59973 -105.8716      44.51379 
1 1 1 12  9  13 o 994.4915 16.59186 192.4355       6.408022      195.2174       14.40731      191.7495       7.154670  997.5755 37.18855 992.4628 18.56297 5.112732       41.56407 
1 1 1 12  9  14 o 742.3881 19.80413 107.3399       5.709719      103.9023       8.518749      110.1438       7.693666  728.9785 30.09076 751.1536 26.37404 -22.17511      40.01304 
1 1 1 12  9  15 o 431.5637 43.12177 37.03546       7.130440      37.03546       7.130440      0.000000       0.000000  431.5637 43.12177 ?        ?        0.000000       43.12177 
1 1 1 12  9  16 o 659.2902 31.11013 85.06199       7.965379      85.06199       7.965379      0.000000       0.000000  659.2902 31.11013 ?        ?        0.000000       31.11013 
1 1 1 12  9  17 o 671.1837 20.70038 87.80064       5.395698      96.82388       7.994956      80.25307       7.312033  703.5255 29.26229 640.4785 29.39717 63.04700       41.47861 
1 1 1 12  9  18 o 947.7721 21.49302 175.2163       7.910962      166.6983       14.24524      179.0147       9.512679  919.3765 39.89775 957.0861 25.59316 -37.70966      47.40084 
1 1 1 12  9  19 o 705.3776 28.18458 97.48005       7.720782      98.68734       12.45819      96.72722       9.837764  703.2183 45.86923 699.6990 36.32905 3.519348       58.51313 
1 1 1 12  9  20 o 715.3881 22.78914 100.0417       6.331370      96.27382       7.884850      106.8810       10.62298  700.3474 28.99025 734.4242 37.36864 -34.07678      47.29535 
1 1 1 12  9  21 o 675.4297 21.30797 89.17590       5.589208      93.18343       7.857547      85.07148       7.951966  688.3825 29.39200 657.2282 31.15518 31.15430       42.83147 
1 1 1 12  9  22 o 1064.287 17.87276 221.1270       7.387174      216.8276       10.11228      226.0468       10.81741  1051.308 24.76803 1072.884 25.96225 -21.57654      35.88166 
1 1 1 12  9  23 o 470.2469 31.50981 43.95207       5.721114      48.92379       6.805573      31.97313       10.56381  494.6775 35.66461 381.1180 74.04106 113.5594       82.18298 
1 1 1 12  9  24 o 141.0408 59.87333 0.9571341      5.706783      -0.5286604     7.018262      3.856619       9.804166  146.1343 64.19028 189.8952 79.41672 -43.76089      102.1147 
1 1 1 12  9  25 o 355.1733 45.95248 26.14017       6.189753      21.76803       7.608497      34.69701       10.64408  314.3979 64.47860 393.6473 72.29021 -79.24939      96.86776 
1 1 1 12  10 0  o 647.1292 23.67496 81.75893       5.949879      74.02402       7.406312      95.83556       9.991339  613.7732 31.17414 696.9576 37.04689 -83.18445      48.41796 
1 1 1 12  10 1  o 1214.446 19.47431 287.3879       9.184772      287.3879       9.184772      0.000000       0.000000  1214.446 19.47431 ?        ?        0.000000       19.47431 
1 1 1 12  10 2  o 242.9407 48.71914 12.09239       4.436540      12.09239       4.436540      0.000000       0.000000  242.9407 48.71914 ?        ?        0.000000       48.71914 
1 1 1 12  10 3  o 321.2001 31.08502 20.37552       3.829027      18.08359       4.324948      28.68546       8.235279  301.1365 37.81591 375.0803 58.44000 -73.94382      69.60802 
1 1 1 12  10 4  o 693.6801 18.65968 93.68578       5.026797      92.26531       6.584855      95.66975       7.782135  687.7191 24.65512 699.7258 28.63801 -12.00671      37.78902 
1 1 1 12  10 5  o 830.4367 17.49043 134.2040       5.640725      137.7301       7.588075      129.8489       8.433043  840.5688 23.24504 815.6733 26.62196 24.89551       35.34205 
1 1 1 12  10 6  o 442.8798 24.59211 38.36038       4.213060      42.16796       5.261270      31.55507       7.033798  463.7284 29.36615 397.6259 46.42384 66.10245       54.93217 
1 1 1 12  10 7  o 1022.496 16.34696 203.3696       6.491223      196.1010       8.617326      212.9042       9.869508  1003.324 22.11584 1045.075 24.31757 -41.75085      32.87027 
1 1 1 12  10 8  o 873.3516 17.90952 148.4156       6.074368      171.6330       14.41409      143.4019       6.698196  935.3912 39.67947 858.2423 20.09648 77.14886       44.47841 
1 1 1 12  10 9  o 671.1858 19.68978 87.69685       5.132296      118.1979       12.77475      81.82626       5.604485  774.4722 42.63780 648.1028 22.26711 126.3694       48.10204 
1 1 1 12  10 10 o 1376.791 16.64393 368.7686       8.899224      343.1669       18.34697      376.6451       10.17652  1323.657 35.69117 1391.049 18.83775 -67.39148      40.35741 
1 1 1 12  10 11 o 554.6424 21.23024 59.92759       4.572945      56.61084       11.15739      60.59724       5.013373  531.6058 54.83087 557.5625 23.15306 -25.95673      59.51881 
1 1 1 12  10 12 o 171.4438 51.88633 5.869503       3.750373      9.281288       9.696711      5.269362       4.066868  230.5105 83.77199 166.0707 54.54291 64.43976       99.96337 
1 1 1 12  10 13 o 850.8525 17.17790 140.8958       5.676132      136.2425       12.98816      141.9944       6.310669  832.4512 40.17547 853.9419 19.02914 -21.49066      44.45421 
1 1 1 12  10 14 o 545.9450 23.32478 58.12353       4.945319      48.99933       7.338969      65.71233       6.693050  498.0650 38.23384 578.9484 29.87024 -80.88345      48.51863 
1 1 1 12  10 15 o 940.0174 18.10950 172.0353       6.611048      160.1802       9.439242      183.4498       9.262140  905.6219 26.83875 969.6212 24.59695 -63.99933      36.40506 
1 1 1 12  10 16 o 453.1444 27.34846 40.27058       4.790245      36.34694       7.213729      43.36543       6.406707  426.9422 44.14489 468.7693 35.45445 -41.82709      56.61969 
1 1 1 12  10 17 o 316.5977 41.39244 20.09462       4.967435      20.23164       6.751499      19.93291       7.334714  313.4097 57.59251 309.4833 63.16436 3.926361       85.47885 
1 1 1 12  10 18 o 397.9034 33.67818 31.33125       5.155355      31.36496       6.740257      31.28373       8.002773  395.3393 44.68586 391.9786 54.00540 3.360718       70.09571 
1 1 1 12  10 19 o 904.4399 22.21709 159.7994       7.803596      147.8896       13.88485      165.2983       9.434639  863.6929 41.39555 918.7203 26.44320 -55.02740      49.12061 
1 1 1 12  10 20 o 218.8313 61.27591 10.08037       5.414240      16.08817       10.43577      7.867658       6.333287  273.0918 87.18893 200.2007 68.10830 72.89116       110.6375 
1 1 1 12  10 21 o 390.7896 31.30672 30.29680       4.711367      25.71262       6.368545      35.83860       7.002198  354.8568 47.39709 421.3511 43.41364 -66.49432      64.27464 
1 1 1 12  10 22 o 329.6996 37.19406 21.88837       4.679105      28.06194       6.311089      14.35237       6.972789  371.1153 44.68760 256.5092 68.64442 114.6061       81.90872 
1 1 1 12  10 23 o 1049.747 20.23357 215.8176       8.248695      203.9682       12.53446      224.8692       10.95522  1014.169 31.82492 1068.338 26.40490 -54.16864      41.35268 
1 1 1 12  10 24 o 211.1064 64.20489 9.685503       5.732249      14.46299       7.132506      0.9710460      9.633021  253.9413 70.04805 174.6148 75.98476 79.32651       103.3461 
1 1 1 12  10 25 o 471.1970 30.91068 44.35835       5.625035      43.98720       6.601429      45.34208       10.74732  466.5385 36.73242 457.9653 62.02398 8.573273       72.08498 
1 1 1 12  11 0  o 347.4859 39.36341 24.06189       5.218293      24.06189       5.218293      0.000000       0.000000  347.4859 39.36341 ?        ?        0.000000       39.36341 
1 1 1 12  11 1  o 128.9014 52.13787 1.491470       4.046013      4.676888       4.649363      -8.448015      8.212817  163.6253 58.18727 131.8647 62.10221 31.76065       85.10254 
1 1 1 12  11 2  o 268.2487 41.42636 14.48362       4.176595      14.58139       4.855694      14.20554       8.188567  267.5730 48.51496 261.3616 76.07241 6.211334       90.22590 
1 1 1 12  11 3  o 592.7886 20.41996 68.45181       4.700919      69.88307       5.453622      64.31373       9.273113  598.6487 23.45768 570.1340 42.18073 28.51465       48.26465 
1 1 1 12  11 4  o 997.8865 16.71581 193.7522       6.477934      194.5399       8.753619      192.7985       9.631547  999.0764 22.56114 994.1847 24.94600 4.891724       33.63492 
1 1 1 12  11 5  o 450.9065 24.76348 39.76778       4.319759      40.13989       5.480500      39.15738       7.019291  452.0276 31.41473 444.5986 41.11914 7.429016       51.74620 
1 1 1 12  11 6  o 476.8314 23.17433 44.31161       4.291411      42.18661       5.437047      47.82291       6.989045  463.6779 30.36151 492.6636 36.79468 -28.98563      47.70398 
1 1 1 12  11 7  o 831.9707 17.39721 134.6789       5.621026      138.8672       7.462997      129.1879       8.545092  844.1962 22.76365 813.6615 27.04238 30.53473       35.34790 
1 1 1 12  11 8  o 619.9438 21.68305 74.86677       5.220364      62.10961       11.45088      78.21383       5.865345  557.7439 53.52328 633.4391 23.84299 -75.69519      58.59377 
1 1 1 12  11 9  o 1204.012 20.03956 282.2849       9.370157      269.8902       16.93214      287.7563       11.24978  1173.248 37.16157 1214.911 23.84358 -41.66284      44.15313 
1 1 1 12  11 10 o 653.0829 19.73275 83.05770       5.004769      96.13519       11.94182      80.27135       5.512212  697.2436 44.33227 641.7996 22.11559 55.44397       49.54240 
1 1 1 12  11 11 o 538.9527 21.55064 56.60358       4.510648      48.94086       11.16161      58.09927       4.931258  492.0838 59.62337 545.8670 23.26178 -53.78317      64.00044 
1 1 1 12  11 12 o 357.2646 29.03248 25.11076       3.993276      15.74488       9.622161      27.05950       4.389094  275.3016 83.06310 370.6703 30.76825 -95.36877      88.57857 
1 1 1 12  11 13 o 539.6861 21.12769 56.75902       4.428138      64.12289       11.17013      55.38598       4.823331  566.5191 51.32834 532.9121 23.30577 33.60699       56.37160 
1 1 1 12  11 14 o 789.5933 21.89239 121.5348       6.713121      99.34678       12.62026      130.2903       7.927758  707.7239 46.17023 817.0590 24.98440 -109.3350      52.49677 
1 1 1 12  11 15 o 942.7947 17.78664 173.0627       6.512371      152.3143       9.199780      193.9025       9.220020  882.9604 26.82923 996.8824 23.81551 -113.9221      35.87459 
1 1 1 12  11 16 o 743.6559 21.18278 107.8294       6.117628      100.6757       8.155884      117.0320       9.250373  717.2181 29.28139 772.9617 30.81579 -55.74353      42.50898 
1 1 1 12  11 17 o 901.4962 20.09078 158.4690       7.033779      149.8209       9.097696      171.3200       11.09014  875.1359 26.76874 934.7776 30.54926 -59.64178      40.61801 
1 1 1 12  11 18 o 205.4395 53.84578 8.781955       4.348159      20.31906       6.457283      -0.7891694     5.881429  313.8059 54.99037 135.5261 59.16458 178.2798       80.77368 
1 1 1 12  11 19 o 119.4075 51.35192 -0.1011553     4.297112      1.078239       6.052216      -1.300094      6.102159  147.8686 62.15219 134.9952 59.55523 12.87335       86.07973 
1 1 1 12  11 20 o 267.3227 55.64345 15.00553       5.588791      22.42879       10.85763      12.32979       6.518682  316.8674 86.02302 240.1054 67.23688 76.76196       109.1822 
1 1 1 12  11 21 o 142.4957 60.18707 0.9441925      5.720475      -32.90236      11.24539      12.76038       6.644401  111.9423 56.37929 242.9624 67.82748 -131.0202      88.19973 
1 1 1 12  11 22 o 163.5594 60.14285 4.719060       5.019048      1.882251       7.390182      7.147748       6.837950  163.1157 68.62636 193.9933 70.37106 -30.87758      98.29376 
1 1 1 12  11 23 o 410.7715 31.13252 33.66215       4.929492      31.28450       6.629832      36.60172       7.371751  390.5364 44.50829 422.1742 45.69157 -31.63779      63.78642 
1 1 1 12  11 24 o 108.7933 49.14309 -1.834024      4.422226      0.1487671      5.731265      -4.751390      6.951963  135.8307 58.85772 126.5278 58.78139 9.302841       83.18344 
1 1 1 12  12 0  o 754.9446 20.44005 111.0594       5.992733      115.0966       7.353079      103.0730       10.34182  767.9312 24.65579 723.5147 36.92923 44.41650       44.40356 
1 1 1 12  12 1  o 162.8160 55.57441 4.892386       4.216896      10.03401       5.081828      -6.475522      7.556317  220.3852 58.42785 131.2177 61.06756 89.16750       84.51663 
1 1 1 12  12 2  o 746.7308 18.68435 108.5684       5.418388      107.6348       6.378071      110.9896       10.27116  743.1118 22.10076 752.4297 35.15004 -9.317932      41.52070 
1 1 1 12  12 3  o 651.0710 19.58204 82.54726       4.951245      76.94495       5.698866      99.79607       9.999654  628.2083 23.35914 712.4960 36.25862 -84.28772      43.13162 
1 1 1 12  12 4  o 853.9296 17.57577 141.9113       5.828603      140.0358       7.757173      144.3430       8.832997  847.5104 23.56842 859.9970 26.44741 -12.48663      35.42508 
1 1 1 12  12 5  o 426.1608 32.23293 35.72407       5.295147      35.72407       5.295147      0.000000       0.000000  426.1608 32.23293 ?        ?        0.000000       32.23293 
1 1 1 12  12 6  o 210.3480 47.48442 9.066285       3.787050      3.520752       4.705856      19.25843       6.379693  153.8310 57.91211 307.1563 55.52635 -153.3252      80.23084 
1 1 1 12  12 7  o 390.9770 27.63504 29.99129       4.169007      26.64473       5.104628      36.69497       7.224732  366.9631 36.29482 429.6132 43.92039 -62.65005      56.97644 
1 1 1 12  12 8  o 1167.160 17.33661 265.1091       7.858189      240.2960       16.21557      272.7249       8.983541  1106.614 37.73185 1183.449 19.54654 -76.83508      42.49423 
1 1 1 12  12 9  o 456.4177 26.09597 40.79252       4.606356      47.18313       10.97927      39.42732       5.074576  482.9876 59.81343 448.1928 29.31612 34.79483       66.61143 
1 1 1 12  12 10 o 720.2899 23.28833 101.1757       6.514387      83.75710       12.04833      108.3715       7.743945  649.1458 48.13507 744.9524 26.76737 -95.80658      55.07701 
1 1 1 12  12 11 o 1339.420 19.93985 349.4883       10.37210      304.3486       17.80075      372.6917       12.76247  1245.111 36.81309 1382.231 23.77531 -137.1199      43.82315 
1 1 1 12  12 12 o 462.2714 23.68804 41.79430       4.238312      34.11765       10.63318      43.24431       4.621287  405.9698 69.97002 469.9915 25.41335 -64.02167      74.44221 
1 1 1 12  12 13 o 512.5702 21.37491 51.20997       4.254863      43.72607       10.58091      52.65360       4.647156  464.1003 60.11886 519.5862 23.03041 -55.48593      64.37917 
1 1 1 12  12 14 o 251.3712 42.56714 12.78929       4.007135      11.59173       10.69177      12.98499       4.322174  248.8439 88.26518 252.6245 45.73933 -3.780624      99.41242 
1 1 1 12  12 15 o 627.2581 21.16258 76.71436       5.155168      70.52528       11.71899      78.19938       5.740418  593.4464 51.35499 633.0176 23.35069 -39.57129      56.41445 
1 1 1 12  12 16 o 586.0610 24.11105 67.08957       5.487656      62.42562       7.616002      72.12565       7.914010  562.4340 35.04216 605.0248 33.81717 -42.59076      48.69860 
1 1 1 12  12 17 o 744.5248 19.50621 108.1085       5.640011      113.1767       8.461842      104.0571       7.565564  759.8499 28.67537 729.0447 26.72140 30.80524       39.19579 
1 1 1 12  12 18 o 394.3385 30.20848 30.72594       4.591037      30.20028       6.688609      31.19422       6.313067  386.7920 45.39060 394.2725 41.87104 -7.480499      61.75347 
1 1 1 12  12 19 o 445.1985 27.87440 39.07167       4.795046      35.53032       6.710770      42.76575       6.853935  420.5487 41.63629 462.8051 38.48311 -42.25632      56.69683 
1 1 1 12  12 20 o 163.1773 59.27748 4.702264       4.854470      6.553375       7.611987      3.433285       6.302446  195.3048 73.62828 164.5570 65.58566 30.74786       98.60326 
1 1 1 12  12 21 o 461.7249 29.53162 42.23916       5.267661      39.59332       7.961209      44.29956       7.025434  440.1610 47.31652 469.5294 38.87831 -29.36838      61.24031 
1 1 1 12  12 22 o 224.3169 63.43847 10.94798       5.773270      -11.36147      12.17200      17.42370       6.557856  155.8592 74.05262 283.5991 61.32792 -127.7398      96.15043 
1 1 1 12  12 23 o 178.1927 66.43261 5.815289       6.163042      5.815289       6.163042      0.000000       0.000000  178.1927 66.43261 ?        ?        0.000000       66.43261 
1 1 1 12  12 24 o 115.0617 50.60836 -0.6150690     4.375195      -1.066308      5.730083      0.1581427E-01  6.775360  128.8954 57.24424 145.2720 63.45830 -16.37662      85.46262 
1 1 1 12  13 0  o 487.9456 25.01272 46.59193       4.723872      49.65822       5.675213      39.67557       8.523436  503.1021 29.17202 444.7464 50.22861 58.35562       58.08545 
1 1 1 12  13 1  o 268.1185 43.41739 14.51481       4.366261      13.49840       5.302887      16.65442       7.693872  255.8970 54.99772 281.9192 70.46687 -26.02223      89.38864 
1 1 1 12  13 2  o 1112.265 16.70657 240.7476       7.216454      238.6973       8.528097      245.9178       13.54262  1107.025 19.83657 1121.138 31.10397 -14.11267      36.89101 
1 1 1 12  13 3  o 721.4877 20.14244 101.3917       5.643766      104.6365       7.735885      97.69937       8.252081  732.0073 27.21239 706.8876 30.05974 25.11969       40.54752 
1 1 1 12  13 4  o 466.5810 25.96922 42.61698       4.686949      43.61249       6.291017      41.37509       7.026495  470.5469 34.67049 457.1713 39.97795 13.37561       52.91766 
1 1 1 12  13 5  o 331.8111 33.23986 21.76695       4.225690      27.57055       5.376039      12.38454       6.835506  372.9891 37.62827 244.6934 68.96786 128.2957       78.56496 
1 1 1 12  13 6  o 567.4942 21.48556 62.75657       4.735174      60.82611       5.991619      65.96815       7.728115  558.0510 27.64663 579.2179 34.51266 -21.16687      44.22058 
1 1 1 12  13 7  o 944.0744 16.71866 173.4469       6.129650      158.6334       7.925110      195.5029       9.670334  902.0361 22.62317 1000.969 24.87670 -98.93323      33.62526 
1 1 1 12  13 8  o 542.5908 24.60392 57.44661       5.184473      50.92487       11.88769      58.97840       5.761242  500.7706 62.48646 549.5040 26.99711 -48.73343      68.06909 
1 1 1 12  13 9  o 630.9289 20.87091 77.57517       5.113871      67.17494       11.94441      79.90944       5.658734  578.9866 53.73378 640.1331 22.76256 -61.14642      58.35625 
1 1 1 12  13 10 o 453.6439 32.33277 40.51064       5.658930      58.17643       11.37250      34.69706       6.523956  537.8889 55.22589 417.9085 40.71484 119.9804       68.61193 
1 1 1 12  13 11 o 388.5366 27.96810 29.65753       4.191873      40.45159       11.06819      27.84998       4.529274  443.9231 66.22701 375.8835 31.31239 68.03958       73.25628 
1 1 1 12  13 12 o 1486.706 19.96743 430.6546       11.52856      398.3789       20.15924      446.3398       14.05338  1424.268 36.44639 1512.416 23.92664 -88.14819      43.59843 
1 1 1 12  13 13 o 277.0649 38.28382 15.37235       4.009258      18.14464       10.27581      14.87455       4.354363  292.7548 85.22031 271.4697 42.71354 21.28510       95.32549 
1 1 1 12  13 14 o 162.2212 52.88153 5.084155       3.825537      19.66634       10.11709      2.651365       4.132348  303.4753 83.30904 139.8253 53.87391 163.6501       99.21085 
1 1 1 12  13 15 o 469.5108 23.28531 43.04176       4.245761      28.39183       11.21565      45.49235       4.587145  363.8896 81.40165 481.9231 24.59146 -118.0335      85.03510 
1 1 1 12  13 16 f 370.2968 25.74620 26.95460       3.679443      35.22337       6.876892      23.63804       4.355278  419.4767 42.81413 345.2627 32.87880 74.21396       53.98208 
1 1 1 12  13 17 o 641.6823 21.06507 80.41052       5.249415      69.09296       7.678568      90.34143       7.192807  591.3203 33.57561 678.8482 27.28335 -87.52789      43.26318 
1 1 1 12  13 18 o 268.9186 44.45095 14.78984       4.480073      12.22679       6.682528      16.88229       6.037953  239.5022 68.43276 283.8403 56.75896 -44.33806      88.90794 
1 1 1 12  13 19 o 291.0656 44.96500 17.34201       4.918888      12.67262       7.849619      20.36110       6.311862  243.0117 75.35310 312.7060 53.92240 -69.69421      92.65914 
1 1 1 12  13 20 o 284.1909 45.57688 16.63304       4.860166      20.41398       7.508661      13.90673       6.376021  307.7452 64.87109 253.4287 64.59317 54.31657       91.54527 
1 1 1 12  13 21 o 372.3064 32.28738 27.69030       4.622103      29.17933       6.395630      26.06231       6.687410  377.6959 44.45359 354.3488 49.98416 23.34708       66.89198 
1 1 1 12  13 22 o 531.8509 24.35061 55.69659       5.029534      57.12371       6.876223      54.05462       7.375684  534.4696 33.29362 518.1529 36.89457 16.31671       49.69582 
1 1 1 12  13 23 o 229.0226 62.56201 11.60730       5.721941      20.65084       12.58181      9.249162       6.424783  289.1426 95.98264 206.9046 68.58380 82.23796       117.9678 
1 1 1 12  14 0  o 543.6675 24.23835 57.68425       5.117578      63.57717       6.216197      45.28949       9.015265  570.2729 28.06816 475.5383 49.54375 94.73462       56.94212 
1 1 1 12  14 1  o 919.2743 17.99135 164.5393       6.422983      166.1940       7.725259      160.8342       11.55971  923.3411 21.54383 905.9971 32.85431 17.34406       39.28794 
1 1 1 12  14 2  o 807.3532 18.69265 126.9347       5.860874      127.1227       7.051033      126.5146       10.54187  807.4299 22.48640 803.3918 33.78797 4.038086       40.58651 
1 1 1 12  14 3  o 556.7286 24.30094 60.47688       5.254055      61.24745       7.206386      59.60247       7.676598  558.0955 33.40267 549.9335 36.14569 8.161987       49.21635 
1 1 1 12  14 4  f 182.1196 55.76696 6.635818       4.314703      8.616249       5.882732      4.330045       6.347570  207.6524 65.37183 174.3512 66.87257 33.30118       93.51693 
1 1 1 12  14 5  o 90.49165 42.73508 -4.423157      3.938215      -3.632228      5.040948      -5.662039      6.308971  110.8212 50.97338 119.1735 55.57498 -8.352318      75.41130 
1 1 1 12  14 6  o 111.8795 47.68691 0.3983771E-01  3.646621      -1.894987      4.509612      3.695169       6.198431  112.0809 50.20993 168.3770 65.67027 -56.29605      82.66573 
1 1 1 12  14 7  o 444.9041 24.41255 38.74713       4.201890      39.02443       5.240372      38.24783       7.031843  445.5054 30.47166 438.6334 41.78511 6.872070       51.71573 
1 1 1 12  14 8  o 142.3571 48.77853 3.699306       3.248754      1.858695       4.230925      6.343698       5.071274  134.1611 53.64855 182.3393 60.95111 -48.17818      81.19855 
1 1 1 12  14 9  o 141.8807 54.39898 2.787766       4.199489      3.494328       10.35681      2.648739       4.594106  200.7477 82.57335 144.8038 56.51974 55.94386       100.0642 
1 1 1 12  14 10 o 333.0410 34.08623 21.97765       4.346518      3.196887       10.61015      25.76500       4.764666  201.1623 83.24286 360.7950 34.42267 -159.6327      90.07938 
1 1 1 12  14 11 o 465.2715 25.74524 42.40933       4.633818      52.03038       11.45729      40.52781       5.066701  506.6545 59.35407 454.2785 28.86925 52.37604       66.00256 
1 1 1 12  14 12 o 343.4209 31.40145 23.29431       4.141628      33.40157       10.70084      21.51350       4.491693  400.2782 71.45958 329.0785 35.72011 71.19968       79.88991 
1 1 1 12  14 13 o 452.5778 24.88521 40.12786       4.357035      41.35143       11.00863      39.90060       4.744448  448.3597 65.12852 450.8990 27.22198 -2.539276      70.58868 
1 1 1 12  14 14 o 142.4997 51.73512 3.392239       3.696921      2.455761       10.26379      3.531847       3.962917  193.8795 81.18491 146.3431 53.49770 47.53645       97.22651 
1 1 1 12  14 15 o 802.6522 17.20711 125.5288       5.363686      119.0800       13.36432      126.7670       5.856015  772.9832 44.71029 806.3510 18.70037 -33.36786      48.46353 
1 1 1 12  14 16 o 1161.729 16.33854 262.9709       7.371336      265.4219       17.38038      262.4333       8.139665  1157.993 38.64785 1160.096 18.06694 -2.102783      42.66229 
1 1 1 12  14 17 o 313.0769 29.72790 19.44184       3.571102      7.368386       6.458391      24.75884       4.285899  196.3361 68.69130 353.1986 31.57914 -156.8625      75.60249 
1 1 1 12  14 18 o 670.3708 22.37350 87.96437       5.824747      92.67735       9.847304      85.42796       7.224043  682.3202 37.30349 659.0825 28.22361 23.23767       46.77737 
1 1 1 12  14 19 o 1076.077 19.12858 226.3233       7.993811      240.9860       13.52905      218.4586       9.908386  1104.203 31.54935 1055.157 24.18009 49.04626       39.74970 
1 1 1 12  14 20 o 339.9225 34.93660 23.21498       4.546362      19.10113       6.370415      27.48514       6.490317  299.8456 56.78596 365.6210 46.78231 -65.77533      73.57465 
1 1 1 12  14 21 o 266.8199 44.19700 14.77439       4.419418      17.40719       6.219897      12.09000       6.280547  284.1457 58.31993 234.1298 66.15049 50.01591       88.18787 
1 1 1 12  14 22 o 415.4897 28.75583 34.38506       4.611426      31.42774       6.212320      38.01440       6.882067  391.8604 41.45129 431.2451 41.60945 -39.38470      58.73292 
1 1 1 12  14 23 o 418.5475 28.41561 34.92093       4.591445      35.38148       6.323178      34.40726       6.677901  416.3440 39.58333 408.9376 42.67772 7.406403       58.20849 
1 1 1 12  15 0  o 334.6531 36.57038 22.27362       4.675468      25.03238       5.692738      16.55586       8.195518  353.6715 42.28545 279.7569 74.21367 73.91461       85.41503 
1 1 1 12  15 1  o 1216.987 18.86764 288.5432       8.917260      288.2099       11.14406      289.1364       14.86808  1215.144 23.61498 1214.639 31.51951 0.5045166      39.38460 
1 1 1 12  15 2  o 933.3779 21.06063 169.8591       7.634085      155.2890       9.787660      192.4911       12.19860  890.9892 28.28645 991.0619 31.69431 -100.0727      42.48120 
1 1 1 12  15 3  o 728.8195 20.72834 103.5499       5.866950      96.86967       8.212052      110.5144       8.384887  703.3934 30.06252 751.5695 28.72765 -48.17609      41.58164 
1 1 1 12  15 4  o 775.6085 19.48958 117.2184       5.870471      129.1936       8.497910      106.2867       8.119228  812.9824 26.91553 737.1261 28.36253 75.85632       39.10088 
1 1 1 12  15 5  o 193.0490 54.08949 7.645201       4.217405      9.168371       5.635605      5.706400       6.358179  211.8823 63.48769 184.5668 67.71883 27.31543       92.82524 
1 1 1 12  15 6  o 319.2026 35.31073 20.24768       4.303935      20.07773       5.465704      20.52505       6.982525  315.3905 45.97620 315.3586 59.18764 0.3189087E-01  74.94656 
1 1 1 12  15 7  o 385.6269 27.08164 29.21160       4.030025      30.60199       5.172444      27.06366       6.428931  393.4265 34.19360 367.0305 46.12187 26.39600       57.41454 
1 1 1 12  15 8  o 541.9541 20.42695 57.25254       4.299263      56.83795       5.519667      57.89204       6.855244  539.3002 26.35447 542.3915 32.69769 -3.091370      41.99640 
1 1 1 12  15 9  o 207.0130 54.63804 8.855243       4.456820      12.16244       10.50652      8.129560       4.921560  251.2611 87.62966 199.7242 59.21298 51.53687       105.7598 
1 1 1 12  15 10 o 359.5161 32.51219 25.54452       4.490223      25.95217       10.94508      25.46203       4.923636  348.3701 82.22301 358.2562 35.87065 -9.886139      89.70689 
1 1 1 12  15 11 o 337.6834 31.84665 22.54873       4.127071      26.27561       11.69252      22.01833       4.410980  349.0344 86.65976 333.1073 34.60246 15.92703       93.31261 
1 1 1 12  15 12 f 126.0331 48.81138 2.073508       3.405885      -8.913845      10.24732      3.438000       3.611182  150.7477 70.47575 142.2740 51.20767 8.473709       87.11520 
1 1 1 12  15 13 o 715.8555 21.13428 99.98720       5.875445      88.01501       12.81228      103.1753       6.611626  662.5454 50.16668 726.7790 23.42491 -64.23358      55.36625 
1 1 1 12  15 14 o 597.4464 20.58914 69.66129       4.777108      71.28842       12.41725      69.37862       5.175434  593.2366 54.50728 595.9633 22.36141 -2.726685      58.91584 
1 1 1 12  15 15 o 145.9704 51.92568 3.764253       3.702843      -16.77566      10.50541      6.678025       3.956777  132.3678 64.35871 180.3257 52.99360 -47.95789      83.36885 
1 1 1 12  15 16 o 468.6876 32.27594 43.50028       5.838952      0.000000       0.000000      43.50028       5.838952  ?        ?        468.6876 32.27594 0.000000       32.27594 
1 1 1 12  15 17 o 369.2227 29.69837 27.01385       4.222404      0.000000       0.000000      27.01385       4.222404  ?        ?        369.2227 29.69837 0.000000       29.69837 
1 1 1 12  15 18 o 620.6607 22.90148 75.50521       5.520085      82.11887       9.121095      71.68285       6.934140  641.6002 36.75929 602.8585 29.61756 38.74176       47.20641 
1 1 1 12  15 19 o 367.3538 32.53569 26.95843       4.593634      22.74239       6.713164      30.67070       6.299325  328.9385 54.45666 388.3783 42.45640 -59.43979      69.05124 
1 1 1 12  15 20 o 349.1758 34.02743 24.51089       4.555617      36.38672       6.527947      13.23634       6.360546  423.4553 40.17646 244.8985 65.57181 178.5567       76.90130 
1 1 1 12  15 21 o 197.4931 53.73274 8.404672       4.230821      1.750645       5.790253      16.02639       6.197004  146.0438 61.05066 270.4418 60.51558 -124.3980      85.96114 
1 1 1 12  15 22 o 197.8813 52.06861 8.460839       4.055523      12.59107       5.721346      4.289846       5.749511  238.1813 61.44664 162.7762 63.31369 75.40509       88.22875 
1 1 1 12  16 0  o 875.2317 19.21950 149.3283       6.532707      141.7090       7.748500      168.0558       12.14783  851.8043 23.42340 924.7162 33.82689 -72.91193      41.14504 
1 1 1 12  16 1  o 683.4873 21.27367 91.13687       5.646780      91.10939       6.853475      91.19498       9.964454  682.6238 25.85243 679.2447 37.92599 3.379089       45.89912 
1 1 1 12  16 2  o 1022.053 19.05194 203.5882       7.562072      207.3756       9.649407      197.5597       12.17408  1030.371 24.11455 1003.683 31.23285 26.68768       39.45887 
1 1 1 12  16 3  o 412.6376 31.53250 33.58282       5.014816      27.66632       7.119530      39.40876       7.064827  369.4579 50.97805 444.8598 41.36705 -75.40182      65.65055 
1 1 1 12  16 4  o 981.1284 18.11335 187.5309       6.901647      187.4999       9.848059      187.5608       9.675045  979.3773 25.89242 979.6517 25.43041 -0.2743530     36.29219 
1 1 1 12  16 5  o 461.8316 39.23360 42.33567       6.970097      0.000000       0.000000      42.33567       6.970097  ?        ?        461.8316 39.23360 0.000000       39.23360 
1 1 1 12  16 6  o 315.8567 54.67310 20.45977       6.463614      0.000000       0.000000      20.45977       6.463614  ?        ?        315.8567 54.67310 0.000000       54.67310 
1 1 1 12  16 7  o 453.7956 25.04363 40.35120       4.396440      43.54262       5.495903      34.67957       7.326565  470.5071 30.23786 415.9339 46.13458 54.57318       55.16092 
1 1 1 12  16 8  o 538.7891 21.43113 56.61993       4.484272      64.36366       5.550590      42.06750       7.609075  574.0071 24.89969 459.4001 43.15521 114.6070       49.82336 
1 1 1 12  16 9  o 489.0237 26.08525 46.87719       4.936069      18.26235       11.51478      53.31924       5.463517  293.4925 91.30773 521.4506 27.07247 -227.9581      95.23666 
1 1 1 12  16 10 o 356.1192 35.31154 25.17116       4.819220      26.11459       11.28895      24.96091       5.329226  347.9344 84.40862 353.6671 39.47431 -5.732727      93.18281 
1 1 1 12  16 11 o 580.0214 18.57945 65.56598       4.185091      60.51379       12.41739      66.21342       4.445168  545.1655 59.62275 582.7527 19.64156 -37.58716      62.77470 
1 1 1 12  16 12 o 662.7162 17.45071 85.57906       4.491266      72.15656       12.45110      87.58673       4.815457  597.3816 54.26140 670.3005 18.49865 -72.91895      57.32800 
1 1 1 12  16 13 o 430.5655 22.56800 36.32504       3.760504      38.35815       11.45197      36.07932       3.981272  426.1934 71.73843 428.8494 24.00136 -2.656006      75.64699 
1 1 1 12  16 14 o 459.9135 22.26830 41.35220       3.977327      42.18421       11.89788      41.24752       4.220107  446.5391 70.98489 458.5130 23.78141 -11.97391      74.86260 
1 1 1 12  16 15 o 450.6252 24.26158 39.89254       4.230188      0.000000       0.000000      39.89254       4.230188  ?        ?        450.6252 24.26158 0.000000       24.26158 
1 1 1 12  16 16 o 193.3760 50.53031 7.841148       3.836762      0.000000       0.000000      7.841148       3.836762  ?        ?        193.3760 50.53031 0.000000       50.53031 
1 1 1 12  16 17 o 280.5850 35.40754 15.86452       3.772328      16.23092       11.26434      15.81823       4.003503  270.4899 90.83767 279.4518 37.86483 -8.961914      98.41356 
1 1 1 12  16 18 o 208.7733 47.19560 9.168165       3.736640      22.77602       11.12816      7.438907       3.966964  312.9974 87.92031 187.6312 52.41918 125.3662       102.3609 
1 1 1 12  16 19 o 440.6989 27.28634 38.49250       4.647013      38.86932       6.514004      38.10199       6.631305  438.4619 38.65035 433.5549 39.83001 4.907013       55.50027 
1 1 1 12  16 20 o 263.2193 44.48531 14.45632       4.385338      10.34568       6.173486      18.64326       6.230515  216.7995 66.75964 294.1440 56.59722 -77.34448      87.52197 
1 1 1 12  16 21 o 99.47315 45.59755 -2.350916      3.986870      -6.157404      5.657918      1.403195       5.618856  105.9219 50.37328 141.6286 59.72618 -35.70677      78.13248 
1 1 1 12  17 0  o 194.2478 59.62534 7.676156       4.928986      3.569912       5.992974      16.26080       8.665253  164.5883 64.46719 275.6627 77.63618 -111.0744      100.9128 
1 1 1 12  17 1  o 999.2310 18.17969 194.6008       7.054728      192.7083       8.433310      199.0121       12.87549  993.5394 21.85672 1006.236 32.94852 -12.69659      39.53886 
1 1 1 12  17 2  o 839.9146 21.93525 137.7104       7.154934      147.5430       9.603290      125.4424       10.72690  867.8093 28.49494 798.5023 34.59157 69.30701       44.81672 
1 1 1 12  17 3  o 557.9352 25.27983 60.86338       5.477544      69.28378       8.102005      53.77447       7.433881  592.3227 35.38310 521.1570 36.96974 71.16565       51.17349 
1 1 1 12  17 4  o 517.4385 26.28077 52.50221       5.263766      64.26127       7.775371      42.55353       7.151836  570.4752 35.26889 462.5241 40.21606 107.9511       53.49043 
1 1 1 12  17 5  o 657.1893 22.86592 84.32285       5.835890      82.82212       7.756524      86.28068       8.859387  649.8926 30.73248 661.5911 34.60172 -11.69849      46.27920 
1 1 1 12  17 6  o 274.2845 43.81641 15.24603       4.510221      11.45498       5.819757      20.94685       7.136649  234.0695 62.74353 317.8428 60.01669 -83.77322      86.82600 
1 1 1 12  17 7  o 415.0301 28.02854 33.86994       4.491128      30.99310       5.885721      37.87965       6.948621  394.5976 38.91428 435.9093 41.54928 -41.31174      56.92683 
1 1 1 12  17 8  o 932.8966 21.65218 169.8295       7.844460      169.8295       7.844460      0.000000       0.000000  932.8966 21.65218 ?        ?        0.000000       21.65218 
1 1 1 12  17 9  o 308.6832 31.45265 18.88870       3.717818      27.10231       11.48844      17.92790       3.929255  353.5373 84.77191 300.0537 34.33792 53.48355       91.46239 
1 1 1 12  17 10 o 88.64533 40.39005 -1.878876      3.067175      10.70273       10.98513      -2.942659      3.194211  241.9177 88.97353 84.74468 39.52777 157.1730       97.35879 
1 1 1 12  17 11 o 333.2569 22.54883 21.79809       2.901134      23.18502       10.93694      21.69312       3.008923  325.2286 85.47273 332.3031 23.46657 -7.074463      88.63559 
1 1 1 12  17 12 o 706.7194 34.88912 98.56048       9.575579      104.6111       13.42643      92.29713       13.66043  721.4092 48.20121 675.2938 52.50141 46.11536       71.27240 
1 1 1 12  17 13 o 642.2150 54.86918 84.10067       13.55341      0.000000       0.000000      84.10067       13.55341  ?        ?        642.2150 54.86918 0.000000       54.86918 
1 1 1 12  17 14 o 746.3991 49.09452 112.7167       14.15148      0.000000       0.000000      112.7167       14.15148  ?        ?        746.3991 49.09452 0.000000       49.09452 
1 1 1 12  17 15 o 290.4928 91.11583 19.06688       11.44014      0.000000       0.000000      19.06688       11.44014  ?        ?        290.4928 91.11583 0.000000       91.11583 
1 1 1 12  17 16 o 151.8241 48.67102 4.610755       3.249404      -5.745872      10.58404      5.688502       3.414292  159.7525 73.62082 165.9247 49.34818 -6.172180      88.62994 
1 1 1 12  17 17 o 417.6466 22.83016 34.33594       3.688909      43.35754       12.47737      33.47186       3.861531  443.0861 75.20001 411.9841 24.24204 31.10196       79.01088 
1 1 1 12  17 18 o 690.9756 17.62528 93.37809       4.729627      99.49325       13.35987      92.50187       5.057132  694.5597 49.86137 687.3437 18.94534 7.216003       53.33931 
1 1 1 12  17 19 o 487.3208 21.41154 46.65714       4.052200      33.64417       11.57613      48.47433       4.325891  380.6183 80.81284 496.4363 22.43800 -115.8180      83.87001 
1 1 1 12  17 20 o 108.1198 47.74482 -0.7323157     3.931208      -4.133801      5.770006      2.214553       5.370594  114.9400 53.44916 144.5373 59.45819 -29.59727      79.95054 
1 1 1 12  18 0  o 551.3404 25.87014 59.50903       5.539194      61.35494       6.736423      55.65528       9.733424  557.9548 31.21386 525.9283 48.19118 32.02643       57.41685 
1 1 1 12  18 1  o 768.5435 20.94507 115.2923       6.251414      112.3746       7.549119      121.6592       11.15164  757.7713 25.65253 785.3071 36.56546 -27.53583      44.66637 
1 1 1 12  18 2  o 504.2300 30.90228 50.09912       6.022089      54.26945       8.019118      44.70555       9.119672  522.4223 39.82549 470.3458 50.72982 52.07648       64.49484 
1 1 1 12  18 3  o 439.4921 33.67172 38.20599       5.703330      33.22460       7.679912      44.33134       8.516214  405.1431 49.86370 469.6318 47.33969 -64.48868      68.75635 
1 1 1 12  18 4  o 312.1871 45.80735 19.75233       5.388463      29.52419       7.537128      9.536160       7.706571  380.8590 52.34179 220.6348 75.13012 160.2242       91.56526 
1 1 1 12  18 5  f 582.2792 24.77922 66.29238       5.603340      63.63011       7.564031      69.53010       8.341539  567.6400 34.47574 592.9034 36.40325 -25.26343      50.13754 
1 1 1 12  18 6  o 278.6323 57.84439 16.17624       6.054391      0.000000       0.000000      16.17624       6.054391  ?        ?        278.6323 57.84439 0.000000       57.84439 
1 1 1 12  18 7  o 203.5001 47.49092 8.569328       3.684729      12.52619       5.117529      4.309600       5.309773  245.1430 55.09568 164.6158 61.60508 80.52719       82.64817 
1 1 1 12  18 8  o 435.2947 22.02072 37.10072       3.710466      37.12704       5.052797      37.06991       5.466351  433.8807 30.17479 432.9551 32.75303 0.9255371      44.53402 
1 1 1 12  18 9  o 609.2667 18.00544 72.37685       4.260289      71.18057       12.52405      72.53339       4.530465  591.8671 55.12082 609.7637 19.13169 -17.89655      58.34660 
1 1 1 12  18 10 o 333.2548 23.96761 21.84218       3.081195      12.15330       11.47693      22.59475       3.198621  250.4742 91.12108 338.8877 24.46859 -88.41357      94.34915 
1 1 1 12  18 11 o 263.5695 76.71147 15.02863       8.326899      27.35725       11.31767      0.4788866      12.29497  351.5454 84.03887 197.4995 85.89330 154.0459       120.1673 
1 1 1 12  18 12 o 362.4353 88.12497 29.54916       12.28380      0.000000       0.000000      29.54916       12.28380  ?        ?        362.4353 88.12497 0.000000       88.12497 
1 1 1 12  18 13 o 340.6713 89.91352 26.48734       12.06952      0.000000       0.000000      26.48734       12.06952  ?        ?        340.6713 89.91352 0.000000       89.91352 
1 1 1 12  18 14 o 565.2056 41.61935 64.28705       9.071175      51.74667       13.07260      75.93291       12.59773  490.9261 70.59834 607.5153 53.95742 -116.5892      88.85679 
1 1 1 12  18 15 o 531.5746 43.52276 57.24460       8.906044      58.23167       12.97133      56.36430       12.24972  523.1555 65.26435 516.5526 62.32288 6.602905       90.24177 
1 1 1 12  18 16 o 470.0956 46.73203 45.30920       8.418489      34.97255       11.97423      55.41202       11.83802  392.1830 81.28947 511.4433 60.79171 -119.2603      101.5067 
1 1 1 12  18 17 o 206.8964 74.07325 8.751274       7.546716      13.50627       11.53168      5.189226       9.980848  248.1347 91.17516 196.6790 80.99911 51.45561       121.9580 
1 1 1 12  18 18 o 205.0579 37.05210 8.691773       2.842053      7.963312       10.48910      8.749491       2.952498  211.8878 84.55982 205.3224 38.44038 6.565414       92.88717 
1 1 1 12  18 19 o 187.8570 43.43639 7.482645       3.105629      -15.59978      9.955704      9.970916       3.268738  125.5893 61.40896 218.6885 39.96062 -93.09918      73.26604 
1 1 1 12  18 20 o 163.3846 46.85006 5.675115       3.126697      7.295619       10.61285      5.521090       3.271917  206.3340 84.07927 161.5059 48.37083 44.82809       97.00031 
1 1 1 12  19 0  o 142.0177 59.75080 0.9096669      5.602357      7.267954       7.748435      -6.055463      8.109770  202.8389 74.70618 137.3540 63.69907 65.48483       98.17630 
1 1 1 12  19 1  o 427.5019 36.43158 36.34491       5.990740      30.12915       8.218921      43.39056       8.750407  382.2578 57.11594 463.0669 49.42173 -80.80902      75.52972 
1 1 1 12  19 2  o 533.7874 28.73309 56.06638       5.934398      60.86212       8.059381      50.38676       8.770678  553.6356 37.70892 500.8971 45.58643 52.73843       59.16152 
1 1 1 12  19 3  o 343.8530 40.64076 23.74146       5.322092      19.55404       7.521874      27.93936       7.531282  303.9099 65.64996 369.0688 54.15616 -65.15900      85.10468 
1 1 1 12  19 4  o 150.7433 58.13968 3.203206       4.816485      -2.443510      7.384860      7.383341       6.353886  144.0289 64.40634 196.7556 68.17290 -52.72668      93.78551 
1 1 1 12  19 5  o 580.7707 23.66607 65.96513       5.337756      69.54305       7.680596      62.62281       7.423426  593.3002 33.47106 562.7193 34.13044 30.58087       47.80376 
1 1 1 12  19 6  o 246.7984 47.23982 12.54792       4.362786      24.30460       6.663376      3.726286       5.772001  344.5057 51.37551 163.3369 63.46369 181.1687       81.65221 
1 1 1 12  19 7  o 161.5737 51.32199 5.194358       3.619380      4.058959       5.352146      6.151136       4.913139  162.2668 61.60267 178.1168 59.99104 -15.84998      85.98729 
1 1 1 12  19 8  o 268.0745 32.69935 14.36664       3.333710      14.23511       4.540793      14.52044       4.909975  263.2827 46.08921 264.9604 49.53799 -1.677673      67.66260 
1 1 1 12  19 9  o 268.2975 23.84480 14.20530       2.458601      18.28314       3.923798      11.56941       3.154676  302.4297 33.99751 239.5348 34.94092 62.89485       48.75139 
1 1 1 12  19 10 o 311.6181 97.71288 22.16372       13.15781      0.000000       0.000000      22.16372       13.15781  ?        ?        311.6181 97.71288 0.000000       97.71288 
1 1 1 12  19 11 o 351.5625 89.81701 28.22843       12.30759      0.000000       0.000000      28.22843       12.30759  ?        ?        351.5625 89.81701 0.000000       89.81701 
1 1 1 12  19 12 o 471.4315 71.42261 47.86056       12.66666      0.000000       0.000000      47.86056       12.66666  ?        ?        471.4315 71.42261 0.000000       71.42261 
1 1 1 12  19 13 o 327.3433 69.49116 23.42708       8.560925      21.62359       11.64787      25.54586       12.62504  305.1269 91.23814 329.5229 94.02885 -24.39606      131.0184 
1 1 1 12  19 14 f 262.6440 75.48161 15.45414       8.107893      9.289493       11.42350      21.71203       11.50956  227.1927 89.00086 304.1092 90.64072 -76.91643      127.0311 
1 1 1 12  19 15 o 679.7186 35.93277 92.58660       9.451531      92.06802       13.56123      93.07644       13.17990  665.9922 52.86739 671.1769 50.94474 -5.184631      73.41885 
1 1 1 12  19 16 o 368.7456 57.99895 29.12838       8.031409      31.19727       11.84641      27.36860       10.92564  363.3058 85.40305 341.2124 83.20005 22.09338       119.2306 
1 1 1 12  19 17 o 87.97717 44.41175 -22.13675      7.205997      -24.05014      10.72151      -20.56028      9.731856  117.5358 58.58307 114.6318 56.91591 2.903984       81.67862 
1 1 1 12  19 18 o 443.3673 47.57263 41.06372       8.063211      45.67691       11.66768      36.84647       11.15574  451.7866 68.66171 400.4736 74.47027 51.31296       101.2929 
1 1 1 12  19 19 o 101.9267 50.10235 -12.56055      6.901357      -6.033840      10.23226      -18.00749      9.347605  150.9051 70.50770 115.0054 56.86687 35.89973       90.58243 
1 1 1 12  20 0  o 276.0301 56.48223 16.00530       5.850738      14.33045       7.958125      17.97544       8.631183  257.4355 75.01294 286.7389 76.20589 -29.30338      106.9312 
1 1 1 12  20 1  o 740.7869 20.95530 107.2532       6.028581      104.1706       7.382422      113.4235       10.44478  728.7667 26.08449 757.2135 35.51838 -28.44684      44.06763 
1 1 1 12  20 2  o 901.8531 19.86670 158.8510       6.958081      160.8589       10.01989      156.9809       9.669872  904.7634 28.51673 894.0354 27.85082 10.72797       39.86066 
1 1 1 12  20 3  o 115.1106 51.75976 -2.013304      4.840855      3.275006       7.240152      -6.288673      6.509926  172.0007 69.68394 118.0723 55.50838 53.92831       89.09003 
1 1 1 12  20 4  o 113.4155 50.85329 -1.804126      4.636927      -0.8835357     6.814366      -2.597953      6.327839  144.5885 63.38734 130.8903 58.98605 13.69818       86.58701 
1 1 1 12  20 5  o 302.6821 41.88191 18.58096       4.791214      33.13754       7.389739      8.023909       6.293186  403.4911 48.10775 200.7994 67.89438 202.6917       83.21059 
1 1 1 12  20 6  o 244.0330 47.32606 12.34027       4.323286      11.10586       6.779045      13.18650       5.612839  228.8135 69.87316 249.2144 58.92186 -20.40086      91.40047 
1 1 1 12  20 7  o 650.3395 19.50001 82.63496       4.924963      74.86852       7.197972      89.47121       6.753183  616.4126 30.06842 675.1583 25.75580 -58.74567      39.59130 
1 1 1 12  20 8  o 249.0857 36.68826 12.56577       3.442688      11.81988       5.248648      13.12899       4.560870  235.6890 57.78702 251.2311 48.50272 -15.54205      75.44437 
1 1 1 12  20 9  o 233.2459 28.40902 10.86633       2.520188      9.869228       3.756025      11.68281       3.398850  217.6254 45.88690 239.5782 37.78264 -21.95282      59.44018 
1 1 1 12  20 10 o 678.0540 54.83868 94.79182       14.31677      0.000000       0.000000      94.79182       14.31677  ?        ?        678.0540 54.83868 0.000000       54.83868 
1 1 1 12  20 11 o 252.6894 77.94466 14.14864       8.411312      13.07199       11.32951      15.47091       12.55552  249.2938 90.55803 265.8123 95.50327 -16.51852      131.6117 
1 1 1 12  20 12 o 236.6619 77.19408 12.23689       8.151324      13.03250       11.20993      11.34421       11.87416  247.5842 90.05716 239.7566 91.58047 7.827591       128.4417 
1 1 1 12  20 13 o 326.4098 68.38872 23.51691       8.391620      20.53623       11.55766      26.84017       12.20376  294.0941 91.47474 335.1516 91.28875 -41.05759      129.2334 
1 1 1 12  20 14 o 323.1123 66.22307 23.04812       8.030616      15.64434       11.42521      30.27769       11.29001  260.3657 91.34808 360.6262 82.41404 -100.2605      123.0307 
1 1 1 12  20 15 o 537.9612 41.70696 59.09309       8.645291      52.26017       12.28177      65.80392       12.17156  487.9712 66.54456 556.3199 57.14915 -68.34875      87.71661 
1 1 1 12  20 16 o 166.9801 70.26090 2.730414       7.747977      6.093824       11.16737      -0.3912984     10.75864  203.8788 84.96806 174.5201 77.91162 29.35869       115.2814 
1 1 1 12  20 17 o 167.9074 69.36720 3.531314       7.350282      6.164059       10.43007      0.9338114      10.36002  199.4991 82.54227 175.9778 77.61921 23.52136       113.3047 
1 1 1 12  21 0  o 547.7483 33.90216 59.68752       7.176231      59.68752       7.176231      0.000000       0.000000  547.7483 33.90216 ?        ?        0.000000       33.90216 
1 1 1 12  21 1  o 346.3049 39.14518 24.20356       5.172167      20.96134       6.321368      30.77011       8.996196  316.9203 53.24939 380.7347 63.04907 -63.81433      82.52686 
1 1 1 12  21 2  o 334.4765 41.60683 22.70228       5.287732      33.10066       7.800523      13.86199       7.192405  400.7914 51.29282 252.0591 70.64075 148.7323       87.29874 
1 1 1 12  21 3  o 368.4964 36.80554 27.25279       5.196675      31.74282       7.741356      23.56982       7.011191  391.9774 52.14845 335.4490 55.77788 56.52847       76.35858 
1 1 1 12  21 4  f 501.2636 27.49530 49.59946       5.332016      51.04399       8.002225      48.44602       7.150648  503.4713 41.29021 491.8674 37.72167 11.60391       55.92679 
1 1 1 12  21 5  o 397.5284 31.55313 31.43103       4.831182      29.82327       7.295981      32.68644       6.447133  380.1847 50.67731 401.8845 41.92554 -21.69983      65.77188 
1 1 1 12  21 6  o 374.1206 34.15826 27.98774       4.908162      27.71714       8.714946      28.11345       5.939725  359.5756 64.79215 372.3432 41.79860 -12.76761      77.10477 
1 1 1 12  21 7  o 260.5212 42.38935 13.94883       4.141261      11.15698       7.380103      15.23195       5.003204  228.0208 73.37648 270.0244 49.53637 -42.00362      88.53226 
1 1 1 12  21 8  f 491.9135 21.12194 47.40695       4.035065      46.39650       6.326093      48.10002       5.239222  482.1432 34.00353 493.2619 27.45907 -11.11871      43.70630 
1 1 1 12  21 9  o 839.3487 50.95276 144.6611       16.53020      0.000000       0.000000      144.6611       16.53020  ?        ?        839.3487 50.95276 0.000000       50.95276 
1 1 1 12  21 10 o 112.1412 55.05743 -15.04479      8.255965      -20.17571      11.02051      -8.482135      12.46361  127.8295 62.92764 165.2757 77.41258 -37.44621      99.76270 
1 1 1 12  21 11 o 258.8814 77.82759 15.24255       8.458612      6.441060       11.06242      27.63174       13.12482  209.2141 85.61406 336.3700 95.83356 -127.1559      128.5062 
1 1 1 12  21 12 o 508.9568 47.08885 53.42592       9.201885      44.33292       12.76313      63.26892       13.27906  442.5963 77.05363 541.0677 64.46478 -98.47141      100.4638 
1 1 1 12  21 13 o 175.7731 73.45126 3.367274       8.376993      5.928321       11.76794      0.7363591      11.92738  207.5659 86.92443 187.4878 82.95980 20.07806       120.1590 
1 1 1 12  21 14 o 327.7246 66.36453 24.06314       8.156786      23.10777       11.52551      25.02181       11.54539  304.6326 90.68227 317.7680 89.65652 -13.13544      127.5208 
1 1 1 12  21 15 o 199.1695 74.72502 8.036610       7.821878      -3.136213      11.02379      19.36491       11.10022  165.9264 75.97155 278.2852 90.03536 -112.3589      117.8051 
1 1 1 12  21 16 o 297.4966 72.44944 20.69963       8.292480      25.49438       11.64180      15.76135       11.81479  316.6474 90.27180 253.4416 92.41411 63.20578       129.1873 
1 1 1 12  22 0  o 134.0367 59.91064 -1.695609      6.382076      -1.695609      6.382076      0.000000       0.000000  134.0367 59.91064 ?        ?        0.000000       59.91064 
1 1 1 12  22 1  o 602.4669 27.80070 71.65973       6.504547      77.13313       8.768504      64.96247       9.699415  620.3603 36.55758 564.8442 44.57930 55.51611       57.65215 
1 1 1 12  22 2  o 718.6369 22.43517 101.3656       6.261333      97.55476       8.911994      105.0804       8.798815  700.7714 32.74693 728.0951 31.11774 -27.32373      45.17383 
1 1 1 12  22 3  o 187.1262 59.59904 7.305936       4.878438      0.6431327      7.272136      12.75790       6.578241  154.7581 66.67941 240.7570 67.58711 -85.99896      94.94293 
1 1 1 12  22 4  o 275.9819 50.26339 16.00399       5.188688      11.42160       8.392593      18.83921       6.601514  230.3668 78.40300 295.9850 59.49446 -65.61818      98.42063 
1 1 1 12  22 5  o 265.6096 75.79517 15.91788       8.203176      15.91788       8.203176      0.000000       0.000000  265.6096 75.79517 ?        ?        0.000000       75.79517 
1 1 1 12  22 6  o 163.4291 57.12864 5.148022       4.466669      15.60014       7.982334      0.3833850      5.389427  263.0613 74.66399 134.1850 57.60262 128.8764       94.30151 
1 1 1 12  22 7  o 124.7934 49.83587 1.849722       3.645568      3.941798       5.603943      0.3147756      4.800114  160.5096 62.48618 126.8778 54.41111 33.63172       82.85585 
1 1 1 12  22 8  o 401.5397 22.77386 31.79048       3.536728      32.41753       5.339403      31.30030       4.720889  401.5872 34.57315 395.8965 30.95160 5.690735       46.40371 
1 1 1 12  22 9  o 159.0009 50.65398 5.192897       3.523778      6.182471       3.651580      -8.206473      13.43689  171.3010 51.05401 171.3869 80.30791 -0.8589172E-01 95.16234 
1 1 1 12  22 10 o 234.2159 78.26483 12.33389       8.361526      13.46845       11.07605      10.83053       12.74978  245.1453 89.46469 234.8125 93.37900 10.33276       129.3196 
1 1 1 12  22 11 o 372.0630 64.32059 30.49688       8.957592      24.60375       11.82754      38.42374       13.71741  315.0620 91.34676 396.4951 91.01123 -81.43317      128.9468 
1 1 1 12  22 12 o 424.8102 55.10251 38.60072       8.876493      39.61575       12.16088      37.44324       12.98625  411.8073 78.91270 392.4044 87.45139 19.40286       117.7920 
1 1 1 12  22 13 o 527.4285 45.49071 57.81636       9.226673      39.43067       12.27319      81.71267       13.99210  407.7470 80.36399 614.0330 59.41944 -206.2860      99.94519 
1 1 1 12  22 14 o 161.6988 69.79234 1.652090       7.995297      3.984175       10.95324      -1.007703      11.69754  190.7897 82.01629 176.2728 79.74758 14.51692       114.3956 
1 1 1 12  22 15 f 140.4958 64.43323 -3.134460      7.974294      4.470320       11.31204      -10.64668      11.24299  193.9302 83.35705 145.4105 69.65835 48.51970       108.6310 
1 1 1 12  23 0  o 540.6706 39.29420 59.34591       8.194263      59.34591       8.194263      0.000000       0.000000  540.6706 39.29420 ?        ?        0.000000       39.29420 
1 1 1 12  23 1  o 325.5093 51.88741 22.43048       6.339014      14.84364       9.186780      29.32567       8.758019  253.1282 81.90977 365.9214 63.95815 -112.7932      103.9224 
1 1 1 12  23 2  o 442.8981 34.85686 39.49873       5.946974      50.27794       9.377011      32.24588       7.691751  491.3494 49.83054 391.4988 51.86720 99.85062       71.92559 
1 1 1 12  23 3  o 141.9032 58.79890 1.841927       5.303904      -5.248854      8.377929      6.584713       6.851828  139.0653 64.58036 187.1000 69.98877 -48.03476      95.23157 
1 1 1 12  23 4  o 375.2444 37.38349 28.57266       5.375293      23.43224       8.534225      31.95292       6.920541  322.7347 70.09768 392.7189 46.26400 -69.98419      83.98834 
1 1 1 12  23 5  o 296.2326 40.29437 18.03932       4.515304      18.95346       6.570424      17.22126       6.215552  294.9547 59.41430 281.1133 58.82284 13.84137       83.60733 
1 1 1 12  23 6  o 520.6662 32.43882 54.30442       6.526635      0.000000       0.000000      54.30442       6.526635  ?        ?        520.6662 32.43882 0.000000       32.43882 
1 1 1 12  23 7  o 598.0110 19.65127 70.17574       4.563811      63.22050       6.490494      76.97757       6.418515  563.0635 29.78791 623.6553 26.50098 -60.59180      39.87006 
1 1 1 12  23 8  o 179.0299 43.03743 6.793752       2.955315      5.554269       4.239948      7.964928       4.121462  164.9989 55.72898 191.7664 53.37914 -26.76755      77.16898 
1 1 1 12  23 9  o 216.8213 42.77364 9.909875       3.473752      10.43394       3.601762      2.927898       13.14655  222.4365 43.25222 200.0034 87.85316 22.43312       97.92309 
1 1 1 12  23 10 o 448.8703 52.94850 42.94063       9.052372      42.18567       11.92183      43.96856       13.91114  427.4183 74.53287 424.2328 87.34657 3.185486       114.8241 
1 1 1 12  23 11 o 283.9336 77.37534 19.36421       8.764784      13.80129       11.42401      27.32434       13.66555  241.3667 90.35565 318.7593 99.51978 -77.39259      134.4185 
1 1 1 12  23 12 o 151.7165 67.56404 -0.4740044     8.037072      -14.76242      10.71072      17.93905       12.15877  132.1533 64.41692 264.0296 94.07520 -131.8763      114.0162 
1 1 1 12  23 13 o 182.0873 74.09479 5.400836       8.227343      7.265431       11.04100      3.072812       12.33701  204.3099 84.76098 192.6011 84.83945 11.70885       119.9256 
1 1 1 12  24 0  o 543.6351 38.28338 60.30633       8.030887      60.30633       8.030887      0.000000       0.000000  543.6351 38.28338 ?        ?        0.000000       38.28338 
1 1 1 12  24 1  o 302.8933 70.14243 21.16334       8.088421      24.45112       9.357588      11.44895       16.08497  321.8730 76.06525 240.5487 101.2267 81.32426       126.6206 
1 1 1 12  24 2  o 603.8605 27.46836 72.45897       6.441655      70.87497       9.987248      73.58734       8.429359  585.3053 44.26472 602.5653 36.18928 -17.26001      57.17543 
1 1 1 12  24 3  o 127.5218 54.56517 0.6366137      4.807987      -5.142580      6.633361      7.033444       6.978827  120.3972 56.41858 188.6063 70.61826 -68.20912      90.38802 
1 1 1 12  24 4  f 520.4137 25.79303 53.67659       5.212896      66.27872       7.583819      42.38938       7.177267  572.9766 34.23849 453.8593 41.16816 119.1173       53.54522 
1 1 1 12  24 5  o 199.2685 54.33915 8.714032       4.321082      3.562443       6.225149      13.50416       6.002781  159.7061 64.64581 244.4392 62.87609 -84.73305      90.18027 
1 1 1 12  24 6  o 324.4781 32.33582 21.31643       4.020440      22.19468       5.706015      20.45055       5.665722  324.3401 46.64241 310.0752 48.65121 14.26489       67.39774 
1 1 1 12  24 7  o 237.0292 39.49861 11.72765       3.507943      12.03470       4.884669      11.40063       5.040985  233.5399 54.80050 226.1798 57.31787 7.360107       79.29964 
1 1 1 12  24 8  o 281.3790 26.90648 15.88397       2.904353      11.56199       3.943885      21.00509       4.293045  232.7348 45.26467 320.6104 35.05038 -87.87558      57.24875 
1 1 1 12  24 9  o 144.1828 49.48824 4.168603       3.344449      3.058174       3.467854      18.94311       12.64946  132.7859 49.76793 267.8689 95.90022 -135.0830      108.0449 
1 1 1 12  24 10 o 193.5021 76.30192 7.270003       8.446283      2.102354       11.29351      13.82934       12.72367  182.8604 80.82803 239.2507 93.87008 -56.39034      123.8740 
1 1 1 12  24 11 o 215.5063 79.37637 10.66475       8.747675      20.73602       11.89136      -1.213207      12.91398  278.2910 93.33224 180.0505 82.36087 98.24051       124.4758 
1 1 1 12  25 0  o 146.4974 58.69214 3.209648       5.074306      12.07056       6.107614      -16.53666      9.117489  227.0900 65.58464 114.0732 56.36004 113.0168       86.47427 
1 1 1 12  25 1  o 214.5296 69.62236 10.76998       6.633796      12.20046       7.371166      4.674098       15.21649  225.8732 73.39404 207.4035 92.61992 18.46973       118.1742 
1 1 1 12  25 2  o 274.7435 49.12452 16.33907       5.049087      19.54975       6.974259      12.80294       7.319198  291.9074 63.34112 231.1570 72.93549 60.75049       96.60063 
1 1 1 12  25 3  o 142.7653 56.84393 3.050459       4.730027      -3.853913      6.639727      10.16481       6.739937  123.8481 57.50647 209.5357 70.26582 -85.68760      90.79802 
1 1 1 12  25 4  o 193.5954 55.72946 8.377355       4.416445      0.1602764      6.282665      16.40434       6.209569  138.2484 60.72963 268.2699 60.98368 -130.0215      86.06449 
1 1 1 12  25 5  o 360.0919 33.27574 26.42755       4.600760      31.48907       6.537186      21.46009       6.476156  386.5860 44.34507 311.4913 55.57407 75.09470       71.09826 
1 1 1 12  25 6  o 187.3148 51.95766 7.767934       3.912063      6.457071       5.507956      9.102419       5.557361  175.4634 63.23265 199.7826 63.60913 -24.31915      89.69108 
1 1 1 12  25 7  o 377.0203 26.36848 28.47156       3.836495      23.71437       5.295771      33.72572       5.565523  336.4511 41.40394 405.5137 35.70463 -69.06262      54.67273 
1 1 1 12  25 8  o 125.6130 46.46331 2.816563       3.003078      0.9668334      4.155263      4.839146       4.345079  120.9691 51.20652 155.5903 56.14850 -34.62117      75.99185 
1 1 1 12  25 9  o 228.0284 37.29555 10.87824       3.188531      10.95641       3.292505      9.698972       12.78888  228.3514 38.49656 216.7652 90.68292 11.58624       98.51588 
1 1 1 12  26 0  o 156.0437 59.48112 4.722549       5.002573      8.063078       5.942537      -3.403334      9.268289  187.3149 65.87090 145.7236 67.75642 41.59128       94.49820 
1 1 1 12  26 1  o 380.7898 46.28450 31.20881       6.703872      35.76349       7.488456      12.82578       15.04428  406.0642 48.44267 227.1838 96.84687 178.8804       108.2867 
1 1 1 12  26 2  o 137.9375 56.61429 2.495843       4.855374      4.917665       6.829535      0.2081685E-01  6.904145  167.5356 67.74758 141.0239 62.72344 26.51164       92.32532 
1 1 1 12  26 3  o 298.5133 41.51666 18.88912       4.682679      7.410565       6.653080      30.15775       6.591959  184.3454 68.96468 374.6889 46.28579 -190.3435      83.05722 
1 1 1 12  26 4  o 229.3408 51.88508 11.77629       4.513149      8.668860       6.264473      15.12959       6.507581  193.7998 67.66071 251.4928 65.85237 -57.69304      94.41666 
1 1 1 12  26 5  o 236.2826 47.73328 12.24105       4.229303      -3.344800      5.862378      29.15708       6.107421  116.4011 54.04421 370.7723 43.22675 -254.3712      69.20498 
1 1 1 12  26 6  f 194.1689 51.53776 8.452932       3.950964      19.36671       5.771826      -1.170122      5.419787  295.8568 52.13976 121.4970 54.68660 174.3598       75.55910 
1 1 1 12  27 0  f 128.3355 54.40022 1.568946       4.700171      4.419796       5.592888      -5.285042      8.672026  154.9293 61.77246 133.3450 63.10794 21.58437       88.30883 
1 1 1 12  27 1  o 130.9023 55.62656 1.593190       4.934772      8.164038       6.817148      -5.640172      7.152570  187.1309 69.84854 119.6721 56.83214 67.45876       90.04838 
1 1 1 12  27 2  o 181.0137 65.50048 7.497603       5.918856      0.8471627      6.672221      32.05927       12.82254  141.5482 62.36932 328.5909 95.06599 -187.0426      113.6991 
1 1 1 13  0  0  o 162.4681 86.38382 7.710106       7.366538      7.710106       7.366538      7.710106       7.366538  162.4681 86.38382 162.4681 86.38382 0.000000       0.000000 
1 1 1 13  0  1  o 1280.105 31.12695 320.2945       15.45360      320.2945       15.45360      320.2945       15.45360  1280.105 31.12695 1280.105 31.12695 0.000000       0.000000 
1 1 1 13  0  2  o 139.2663 78.58795 5.218986       6.499807      5.218986       6.499807      5.218986       6.499807  139.2663 78.58795 139.2663 78.58795 0.000000       0.000000 
1 1 1 13  0  3  o 507.5608 40.54117 51.34832       7.873925      51.34832       7.873925      51.34832       7.873925  507.5608 40.54117 507.5608 40.54117 0.000000       0.000000 
1 1 1 13  0  4  o 1408.110 31.96319 387.3733       17.45859      387.3733       17.45859      387.3733       17.45859  1408.110 31.96319 1408.110 31.96319 0.000000       0.000000 
1 1 1 13  0  5  o 814.9974 32.10094 130.1458       10.12439      130.1458       10.12439      130.1458       10.12439  814.9974 32.10094 814.9974 32.10094 0.000000       0.000000 
1 1 1 13  0  6  o 403.1428 47.08854 33.09921       7.109428      33.09921       7.109428      33.09921       7.109428  403.1428 47.08854 403.1428 47.08854 0.000000       0.000000 
1 1 1 13  0  7  o 318.9477 67.43096 22.47955       7.348058      22.47955       7.348058      22.47955       7.348058  318.9477 67.43096 318.9477 67.43096 0.000000       0.000000 
1 1 1 13  0  8  o 126.6545 75.53574 3.476007       6.549498      3.476007       6.549498      3.476007       6.549498  126.6545 75.53574 126.6545 75.53574 0.000000       0.000000 
1 1 1 13  0  9  f 78.27507 53.26921 -2.754315      4.948549      -2.754315      4.948549      -2.754315      4.948549  78.27507 53.26921 78.27507 53.26921 0.000000       0.000000 
1 1 1 13  0  10 o 902.2503 36.93839 159.6723       12.89363      159.6723       12.89363      159.6723       12.89363  902.2503 36.93839 902.2503 36.93839 0.000000       0.000000 
1 1 1 13  0  11 o 232.3420 86.72092 14.36698       7.289235      14.36698       7.289235      14.36698       7.289235  232.3420 86.72092 232.3420 86.72092 0.000000       0.000000 
1 1 1 13  0  12 o 684.5212 31.65996 91.96046       8.375370      91.96046       8.375370      91.96046       8.375370  684.5212 31.65996 684.5212 31.65996 0.000000       0.000000 
1 1 1 13  0  13 o 105.6395 69.25999 -0.8465181     7.098557      -0.8465181     7.098557      -0.8465181     7.098557  105.6395 69.25999 105.6395 69.25999 0.000000       0.000000 
1 1 1 13  0  14 o 329.3500 60.52686 23.41254       6.970279      23.41254       6.970279      23.41254       6.970279  329.3500 60.52686 329.3500 60.52686 0.000000       0.000000 
1 1 1 13  0  15 o 1012.917 37.69843 201.6932       14.78284      201.6932       14.78284      201.6932       14.78284  1012.917 37.69843 1012.917 37.69843 0.000000       0.000000 
1 1 1 13  0  16 o 283.7581 74.69050 18.94455       7.111297      18.94455       7.111297      18.94455       7.111297  283.7581 74.69050 283.7581 74.69050 0.000000       0.000000 
1 1 1 13  0  17 o 1606.146 25.58326 503.5478       15.94852      503.5478       15.94852      503.5478       15.94852  1606.146 25.58326 1606.146 25.58326 0.000000       0.000000 
1 1 1 13  0  18 o 468.8705 42.08252 44.28405       7.520754      44.28405       7.520754      44.28405       7.520754  468.8705 42.08252 468.8705 42.08252 0.000000       0.000000 
1 1 1 13  0  19 f 484.6429 39.48988 47.16298       7.318985      47.16298       7.318985      47.16298       7.318985  484.6429 39.48988 484.6429 39.48988 0.000000       0.000000 
1 1 1 13  0  20 o 189.7496 84.22709 10.71296       6.557220      10.71296       6.557220      10.71296       6.557220  189.7496 84.22709 189.7496 84.22709 0.000000       0.000000 
1 1 1 13  0  21 o 108.0902 68.88371 1.219628       6.385537      1.219628       6.385537      1.219628       6.385537  108.0902 68.88371 108.0902 68.88371 0.000000       0.000000 
1 1 1 13  0  22 o 155.7577 81.26183 7.727617       6.426740      7.727617       6.426740      7.727617       6.426740  155.7577 81.26183 155.7577 81.26183 0.000000       0.000000 
1 1 1 13  0  23 o 129.4932 75.38149 4.911408       6.255413      4.911408       6.255413      4.911408       6.255413  129.4932 75.38149 129.4932 75.38149 0.000000       0.000000 
1 1 1 13  0  24 o 608.8462 32.00121 74.40151       7.518884      74.40151       7.518884      74.40151       7.518884  608.8462 32.00121 608.8462 32.00121 0.000000       0.000000 
1 1 1 13  0  25 o 896.7509 26.62742 159.8976       9.254681      159.8976       9.254681      159.8976       9.254681  896.7509 26.62742 896.7509 26.62742 0.000000       0.000000 
1 1 1 13  0  26 o 54.09120 39.79533 -15.46932      5.835732      -15.46932      5.835732      -15.46932      5.835732  54.09120 39.79533 54.09120 39.79533 0.000000       0.000000 
1 1 1 13  1  0  o 577.6740 22.25274 65.21501       4.992225      67.02859       8.562140      64.28092       6.144803  580.8801 38.16733 572.5307 27.63638 8.349426       47.12234 
1 1 1 13  1  1  o 727.1733 19.86362 103.1723       5.609503      125.1351       10.37618      94.10265       6.667891  797.3162 33.51033 693.5560 24.75591 103.7603       41.66290 
1 1 1 13  1  2  o 483.6529 29.39794 46.03217       5.495584      38.63575       7.365029      55.32343       8.254698  439.2740 43.75513 527.3702 40.61748 -88.09619      59.70169 
1 1 1 13  1  3  o 741.8829 19.25777 107.2918       5.548421      107.4252       6.902679      107.0482       9.326795  741.5500 23.96896 738.3768 32.52568 3.173218       40.40335 
1 1 1 13  1  4  o 1142.545 16.29253 254.1367       7.229190      253.3314       8.539822      256.1732       13.57988  1140.142 19.28688 1143.393 30.58245 -3.251221      36.15619 
1 1 1 13  1  5  o 711.0188 34.01901 99.18356       9.393571      0.000000       0.000000      99.18356       9.393571  ?        ?        711.0188 34.01901 0.000000       34.01901 
1 1 1 13  1  6  o 1413.281 19.12760 389.0105       10.49825      394.2467       13.45841      380.8726       16.77800  1421.428 24.38040 1395.028 30.96915 26.40002       39.41436 
1 1 1 13  1  7  o 1032.600 18.98042 207.6049       7.611425      196.2995       9.367169      229.5763       13.05848  1003.271 24.04152 1083.419 31.03618 -80.14795      39.25862 
1 1 1 13  1  8  o 319.7951 37.24997 20.31114       4.539531      23.41874       5.916946      15.86486       7.077559  341.9357 45.70152 276.2868 66.71642 65.64893       80.86847 
1 1 1 13  1  9  o 1156.799 36.02594 262.0349       16.18457      262.0349       16.18457      0.000000       0.000000  1156.799 36.02594 ?        ?        0.000000       36.02594 
1 1 1 13  1  10 o 800.4183 24.15911 124.8603       7.509756      119.0746       8.868000      139.5284       14.12002  780.9899 29.23831 841.6408 43.34690 -60.65094      52.28606 
1 1 1 13  1  11 o 270.8938 68.48216 15.22686       7.208385      15.22686       7.208385      0.000000       0.000000  270.8938 68.48216 ?        ?        0.000000       68.48216 
1 1 1 13  1  12 o 336.9899 44.54296 22.71205       5.686533      24.49246       7.214606      19.79164       9.240047  347.6274 55.29227 307.3825 77.44050 40.24487       95.15391 
1 1 1 13  1  13 o 239.5128 55.78892 11.82513       5.092709      10.97597       7.407104      12.58641       7.013370  233.7944 73.31413 246.9595 69.94807 -13.16519      101.3296 
1 1 1 13  1  14 o 657.6814 26.47413 84.42678       6.761847      90.56258       8.288134      72.21358       11.69327  680.4518 31.36400 602.1788 50.46684 78.27301       59.41887 
1 1 1 13  1  15 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 13  1  16 o 912.5765 19.12117 162.1707       6.776600      168.0393       9.782543      156.7564       9.396244  927.6024 27.15576 895.9482 27.00495 31.65424       38.29755 
1 1 1 13  1  17 o 1554.677 20.61477 470.9589       12.44649      447.8418       20.49054      484.4754       15.66825  1511.167 34.91508 1575.350 25.61036 -64.18298      43.30074 
1 1 1 13  1  18 o 533.1891 26.11681 55.53844       5.407910      50.45996       7.679807      60.53350       7.616465  504.7946 39.48954 554.1172 35.58163 -49.32263      53.15521 
1 1 1 13  1  19 o 1196.687 17.86916 278.9772       8.304483      283.5788       11.86723      274.5615       11.62514  1204.536 25.36889 1185.265 25.25544 19.27136       35.79690 
1 1 1 13  1  20 o 279.8146 46.19662 15.96284       4.844856      18.59945       6.833696      13.29832       6.869768  298.1099 61.08035 250.6607 68.58257 47.44919       91.83887 
1 1 1 13  1  21 o 355.3021 35.57653 25.16519       4.842992      20.19676       6.697871      30.60887       7.010898  311.2968 57.52200 388.5786 47.44395 -77.28180      74.56345 
1 1 1 13  1  22 o 123.4060 52.89763 0.7729489E-01  4.533016      2.308668       6.333123      -2.266789      6.491101  157.7718 64.69535 134.2213 60.17596 23.55046       88.35516 
1 1 1 13  1  23 o 206.5903 55.74065 9.041749       4.575394      10.09456       6.369506      7.919350       6.576631  218.2430 67.91192 199.9344 69.35282 18.30859       97.06618 
1 1 1 13  1  24 o 743.0904 20.34821 108.1370       5.872132      108.6670       8.184057      107.5745       8.430316  741.9362 28.40365 737.7556 29.42411 4.180542       40.89677 
1 1 1 13  1  25 o 245.2711 48.82908 12.70591       4.487569      9.850655       6.332579      15.58619       6.360273  213.2924 67.89986 266.6270 62.51073 -53.33463      92.29292 
1 1 1 13  1  26 o 184.2427 56.29528 7.231461       4.399563      2.067172       6.124566      12.73768       6.324072  151.1128 62.94634 238.9793 65.97451 -87.86647      91.18595 
1 1 1 13  2  0  o 232.1150 40.96589 10.98280       3.557782      16.39956       4.962943      5.256214       5.102902  283.2462 46.74880 170.9998 60.94333 112.2464       76.80846 
1 1 1 13  2  1  o 683.0569 17.10664 90.91467       4.537846      89.73255       6.282709      92.20394       6.561318  677.4785 23.87940 686.6002 24.60703 -9.121765      34.28894 
1 1 1 13  2  2  o 1067.461 15.23355 221.8358       6.315112      222.3547       8.888067      221.3067       8.974392  1067.350 21.44236 1064.764 21.70319 2.585205       30.50907 
1 1 1 13  2  3  o 807.0588 18.39580 126.9234       5.765698      122.7323       6.964588      136.0522       10.27871  792.9075 22.61752 832.6700 31.78613 -39.76251      39.01167 
1 1 1 13  2  4  o 619.3062 18.89052 74.73061       4.543361      74.01019       5.434029      76.40402       8.281955  615.8430 22.72082 622.8260 34.37342 -6.982971      41.20397 
1 1 1 13  2  5  o 1160.750 24.14463 262.9782       10.88397      262.9782       10.88397      0.000000       0.000000  1160.750 24.14463 ?        ?        0.000000       24.14463 
1 1 1 13  2  6  o 363.7139 30.74427 26.06515       4.301944      25.32602       6.289537      26.71492       5.897139  355.1143 46.74178 365.9401 42.27367 -10.82578      63.02267 
1 1 1 13  2  7  o 494.5965 23.43129 47.69504       4.500649      49.67780       6.589179      45.96101       6.162029  502.5301 33.96236 483.4558 33.01744 19.07428       47.36658 
1 1 1 13  2  8  o 623.7903 18.94395 75.74291       4.589203      61.77551       6.793447      87.46722       6.224091  561.3030 31.28928 669.8437 23.92624 -108.5406      39.38888 
1 1 1 13  2  9  o 394.4397 31.21643 30.58798       4.742739      42.99207       9.961794      26.95235       5.393183  462.5186 56.64393 368.9015 38.19843 93.61710       68.32024 
1 1 1 13  2  10 o 255.1798 47.17018 13.21412       4.502385      8.227417       6.927923      16.86026       5.923968  209.5451 71.23420 287.3476 55.09041 -77.80252      90.05145 
1 1 1 13  2  11 o 431.3028 37.51790 36.71241       6.221582      40.91953       7.478322      27.25388       11.21305  454.4586 42.87911 360.3255 81.97790 94.13306       92.51483 
1 1 1 13  2  12 o 570.4326 29.87790 63.73255       6.595827      65.75819       7.859233      58.90711       12.13020  578.5082 35.14836 541.6551 58.59978 36.85315       68.33259 
1 1 1 13  2  13 o 882.7560 27.79858 152.1465       9.529965      152.1465       9.529965      0.000000       0.000000  882.7560 27.79858 ?        ?        0.000000       27.79858 
1 1 1 13  2  14 o 984.4030 18.59616 188.6535       7.109259      214.9086       10.67640      167.7377       9.529147  1049.342 26.19871 927.0056 26.46937 122.3362       37.24245 
1 1 1 13  2  15 o 388.0725 34.18446 29.72814       5.099319      27.18417       7.283440      32.17406       7.141702  366.7820 52.64201 401.1285 46.72010 -34.34653      70.38429 
1 1 1 13  2  16 o 1109.046 18.06531 239.4455       7.780774      243.2386       11.15047      235.8457       10.86254  1116.334 25.72000 1099.299 25.44412 17.03516       36.17902 
1 1 1 13  2  17 o 683.4886 22.09535 91.07596       5.864894      90.20078       8.319461      91.94060       8.269193  678.7841 31.55990 685.3856 31.06706 -6.601501      44.28532 
1 1 1 13  2  18 o 498.8307 30.79190 48.91169       5.935933      51.26127       9.975392      47.62362       7.385913  505.3431 51.55137 490.3658 39.10958 14.97726       64.70783 
1 1 1 13  2  19 o 255.1485 51.57694 13.42349       4.934915      17.04866       6.924692      9.682276       7.034655  285.0847 64.10223 219.9746 71.70999 65.11002       96.18430 
1 1 1 13  2  20 o 559.4007 25.08152 61.21801       5.448850      67.81290       7.687283      54.55906       7.724526  586.0233 33.92278 524.2233 38.20562 61.79999       51.09231 
1 1 1 13  2  21 o 397.0432 32.70718 31.25695       4.998360      38.96833       6.997534      23.22348       7.142180  441.0793 41.33280 334.4345 57.03710 106.6448       70.43884 
1 1 1 13  2  22 o 556.8824 24.62599 60.78507       5.325804      61.04331       7.390515      60.50609       7.681561  554.5753 34.48596 551.5640 36.05975 3.011353       49.89576 
1 1 1 13  2  23 o 495.6457 26.84190 48.45435       5.147434      52.65776       7.223625      44.11815       7.336836  513.4666 36.46264 468.1225 40.76411 45.34402       54.69220 
1 1 1 13  2  24 o 128.0001 53.81364 0.8809859      4.538903      -3.920019      6.243721      6.261594       6.609874  122.7879 56.57086 185.5325 68.87173 -62.74456      89.12675 
1 1 1 13  2  25 o 169.9133 56.64405 5.858253       4.380242      10.04582       6.087535      1.362575       6.307517  214.7707 66.31954 149.0681 63.09441 65.70264       91.53789 
1 1 1 13  2  26 o 306.6031 44.49736 19.50996       5.143568      20.78631       6.413572      17.20934       8.610667  311.6979 54.99338 272.4781 77.62016 39.21976       95.12708 
1 1 1 13  3  0  o 687.3340 17.24508 92.07396       4.603214      87.60036       6.108878      97.95123       7.001988  669.3724 23.49988 707.3898 25.48793 -38.01746      34.66813 
1 1 1 13  3  1  o 377.9705 25.32096 28.07099       3.695285      28.29080       5.076396      27.82321       5.389489  377.4514 35.03045 373.6505 37.65428 3.800873       51.42934 
1 1 1 13  3  2  o 386.5063 24.72536 29.31860       3.691861      31.23964       5.062632      27.13671       5.395402  397.3958 33.10506 369.0177 38.20182 28.37802       50.55021 
1 1 1 13  3  3  o 370.2654 26.87661 26.95454       3.838362      23.44518       4.507475      36.21325       7.321405  343.7979 34.21447 425.2618 45.01563 -81.46387      56.54235 
1 1 1 13  3  4  o 1273.005 16.27990 315.4577       8.048407      309.8265       9.328880      331.8508       15.91707  1261.013 19.04944 1301.226 31.49794 -40.21375      36.81034 
1 1 1 13  3  5  o 218.1910 48.33385 9.788863       3.987716      8.158542       5.890715      11.16796       5.417875  203.2395 65.57169 231.9094 59.77798 -28.66985      88.73023 
1 1 1 13  3  6  o 546.7224 22.62017 58.27740       4.802758      46.66372       6.640104      71.01905       6.955089  486.5482 35.38387 602.6491 29.71736 -116.1010      46.20757 
1 1 1 13  3  7  o 1415.576 16.85107 389.9124       9.263790      374.0495       12.85809      407.0331       13.35817  1385.028 23.90508 1444.828 23.80689 -59.80054      33.73753 
1 1 1 13  3  8  o 1044.041 17.57483 212.1016       7.125848      208.3600       14.99717      213.1926       8.098412  1030.971 37.45718 1046.409 19.92830 -15.43835      42.42850 
1 1 1 13  3  9  o 782.7142 19.36585 119.2500       5.886644      111.8263       12.36618      121.4251       6.693701  753.3408 42.44133 789.5612 21.82994 -36.22046      47.72644 
1 1 1 13  3  10 o 952.6078 18.09640 176.5748       6.694750      184.7836       14.05827      174.1672       7.613474  971.2368 37.27168 945.7848 20.72824 25.45197       42.64783 
1 1 1 13  3  11 o 964.0063 22.56764 181.0436       8.448779      179.6806       10.17496      184.0701       15.16178  959.6420 27.30206 968.5609 40.30838 -8.918884      48.68437 
1 1 1 13  3  12 o 1045.336 18.72074 212.6906       7.599881      208.1258       10.74189      217.2654       10.75383  1032.767 26.78245 1055.303 26.23964 -22.53601      37.49424 
1 1 1 13  3  13 o 1218.886 20.97031 289.4046       9.926497      289.7254       12.08464      288.7390       17.40478  1218.628 25.53491 1213.442 36.93360 5.186401       44.90125 
1 1 1 13  3  14 o 579.9340 35.34634 66.16077       7.922696      66.16077       7.922696      0.000000       0.000000  579.9340 35.34634 ?        ?        0.000000       35.34634 
1 1 1 13  3  15 o 369.5250 51.37124 27.53976       7.172693      27.53976       7.172693      0.000000       0.000000  369.5250 51.37124 ?        ?        0.000000       51.37124 
1 1 1 13  3  16 o 766.3873 20.57288 114.4320       6.123100      113.9894       8.710683      114.8642       8.608956  763.5810 29.37441 766.5854 28.91758 -3.004456      41.21992 
1 1 1 13  3  17 o 464.2014 29.16876 42.30203       5.231651      52.90558       7.546469      32.49032       7.259233  517.5616 37.80672 402.6946 47.32022 114.8671       60.56857 
1 1 1 13  3  18 o 1146.530 17.97565 256.0121       8.003834      260.2276       11.41120      251.9299       11.22926  1154.209 25.45767 1135.658 25.46101 18.55151       36.00494 
1 1 1 13  3  19 o 407.4169 32.66886 32.79633       5.125459      26.00767       7.121142      40.09330       7.382932  357.2151 52.93453 448.1189 42.94975 -90.90384      68.16705 
1 1 1 13  3  20 o 125.3678 55.57833 -1.510572      5.378104      3.121582       8.684309      -4.392292      6.849670  184.0028 75.64063 129.9166 59.63140 54.08627       96.31931 
1 1 1 13  3  21 f 392.7755 33.63041 30.63820       5.080380      32.04407       7.009953      29.08281       7.373294  397.9408 46.22044 376.9587 51.73035 20.98212       69.37116 
1 1 1 13  3  22 o 803.5207 20.27679 126.1864       6.327384      132.7047       9.002796      119.8236       8.894727  821.5262 28.21811 780.2380 29.35469 41.28827       40.71806 
1 1 1 13  3  23 o 164.6840 58.73518 4.998464       4.740639      1.020052       6.428731      9.740431       7.018586  149.8739 63.58115 216.1772 71.68439 -66.30330      95.81865 
1 1 1 13  3  24 o 223.2273 54.78794 10.67080       4.714318      9.681012       6.451783      11.80466       6.905416  213.0047 68.61307 232.1418 70.43974 -19.13713      98.33366 
1 1 1 13  3  25 o 306.6931 47.08915 19.60131       5.429321      8.294443       6.468530      46.55770       9.987699  199.8033 68.81036 469.8587 55.82825 -270.0554      88.60959 
1 1 1 13  4  0  o 138.4203 49.91747 3.263420       3.433336      9.911216       4.637815      -4.797325      5.106957  217.8751 54.84956 106.0777 49.64308 111.7974       73.97911 
1 1 1 13  4  1  o 419.0481 23.70182 34.42240       3.841402      34.70406       5.251057      34.09813       5.634292  419.0347 32.52255 414.6866 35.32238 4.348022       48.01445 
1 1 1 13  4  2  o 224.7012 43.94168 10.33232       3.697124      10.80172       4.269551      8.925402       7.391749  228.7081 49.50563 214.9803 73.57772 13.72774       88.68195 
1 1 1 13  4  3  o 396.6323 26.28379 30.88796       4.025649      31.36769       4.616410      29.36518       8.224801  399.0526 30.00804 378.8118 57.73337 20.24072       65.06631 
1 1 1 13  4  4  o 818.8075 31.76374 131.3933       10.10047      0.000000       0.000000      131.3933       10.10047  ?        ?        818.8075 31.76374 0.000000       31.76374 
1 1 1 13  4  5  o 918.4296 16.62727 164.1747       5.930547      160.0800       6.876815      176.0580       11.71507  906.5012 19.53399 948.1424 31.81585 -41.64124      37.33397 
1 1 1 13  4  6  o 1133.183 16.82451 249.8934       7.404073      259.7234       11.05494      241.8970       9.970678  1153.798 24.67169 1113.832 23.05033 39.96606       33.76403 
1 1 1 13  4  7  o 123.9858 49.93478 1.416550       3.694107      1.824660       5.595726      1.101293       4.918133  149.6458 61.02402 136.8746 56.65994 12.77126       83.27232 
1 1 1 13  4  8  o 1094.230 17.32654 232.9655       7.362891      228.5669       15.57922      234.2305       8.354846  1079.942 37.14644 1096.886 19.61323 -16.94336      42.00639 
1 1 1 13  4  9  o 977.0146 28.41587 186.3233       10.78177      191.5663       15.08673      180.8504       15.41399  988.3178 39.30706 959.7695 41.35424 28.54834       57.05452 
1 1 1 13  4  10 o 668.5367 26.47779 87.17679       6.874402      81.35773       11.87367      90.11078       8.431178  640.8308 48.06052 678.9962 31.97370 -38.16541      57.72461 
1 1 1 13  4  11 o 625.8747 19.84453 76.26051       4.823433      77.42365       8.512459      75.71044       5.853889  627.9535 35.04575 623.2215 24.18656 4.731995       42.58162 
1 1 1 13  4  12 o 867.5237 19.35679 146.5211       6.521427      134.2922       9.238291      158.6677       9.207168  829.2341 28.68709 901.7696 26.29072 -72.53546      38.91209 
1 1 1 13  4  13 o 278.7826 47.41626 15.74745       4.949772      14.60141       7.276128      16.73468       6.753159  264.7253 69.78468 284.1702 62.85931 -19.44492      93.92121 
1 1 1 13  4  14 o 879.7347 19.33037 150.7118       6.604194      145.8464       9.417632      155.4194       9.263750  864.0482 28.06569 892.2029 26.73592 -28.15472      38.76200 
1 1 1 13  4  15 o 607.6824 28.51368 72.16207       6.729115      66.35593       8.042380      85.71481       12.28723  580.5867 35.84420 656.6745 48.52471 -76.08783      60.32788 
1 1 1 13  4  16 o 632.5635 33.38356 78.60513       8.171921      78.60513       8.171921      0.000000       0.000000  632.5635 33.38356 ?        ?        0.000000       33.38356 
1 1 1 13  4  17 o 595.6262 24.46137 69.24084       5.658256      75.51860       7.989670      62.92424       8.014353  619.8259 33.31402 564.8554 36.73418 54.97052       49.59057 
1 1 1 13  4  18 o 606.6063 23.90543 71.83968       5.631596      70.66817       8.025955      72.97585       7.904004  598.8947 34.65600 608.8965 33.55486 -10.00183      48.23865 
1 1 1 13  4  19 o 318.0210 59.57632 20.98818       7.087576      20.98818       7.087576      0.000000       0.000000  318.0210 59.57632 ?        ?        0.000000       59.57632 
1 1 1 13  4  20 o 213.8552 57.45095 9.564045       4.872987      13.07446       6.667994      5.540206       7.138978  248.2790 67.41755 187.2460 71.13197 61.03297       98.00450 
1 1 1 13  4  21 o 1084.448 21.06819 229.8029       8.872868      223.8655       14.30157      233.5184       11.31345  1064.686 34.58869 1091.103 26.69940 -26.41626      43.69480 
1 1 1 13  4  22 o 506.7289 27.49052 50.61552       5.389624      53.50176       7.566972      47.64365       7.678408  517.6019 37.90791 487.1502 40.96671 30.45163       55.81470 
1 1 1 13  4  23 o 565.1276 34.47896 63.61792       7.530887      63.61792       7.530887      0.000000       0.000000  565.1276 34.47896 ?        ?        0.000000       34.47896 
1 1 1 13  4  24 o 115.0966 52.94865 -3.397317      5.442259      -6.612682      6.399215      5.006779       10.34563  114.2987 54.12772 199.2812 82.30989 -84.98249      98.51258 
1 1 1 13  4  25 o 503.2573 27.02004 50.19231       5.261537      58.32367       7.346520      41.62909       7.539090  538.8568 35.30103 450.8542 43.60256 88.00253       56.10121 
1 1 1 13  5  0  o 212.8249 45.10521 9.325665       3.612210      11.96995       4.754646      5.716054       5.555127  240.1003 52.45821 178.4405 63.58737 61.65979       82.43311 
1 1 1 13  5  1  o 340.3763 28.23236 22.84365       3.698251      20.63926       4.945044      25.64140       5.570955  320.7439 40.60904 357.9679 40.80260 -37.22397      57.56689 
1 1 1 13  5  2  o 450.3428 30.76778 39.94067       5.348847      45.53532       6.704763      30.14706       8.870919  479.7371 36.25520 382.3389 61.85625 97.39816       71.69822 
1 1 1 13  5  3  o 150.4787 55.70908 3.607887       4.319011      3.607887       4.319011      0.000000       0.000000  150.4787 55.70908 ?        ?        0.000000       55.70908 
1 1 1 13  5  4  o 945.1901 19.36793 174.0516       7.109357      174.0516       7.109357      0.000000       0.000000  945.1901 19.36793 ?        ?        0.000000       19.36793 
1 1 1 13  5  5  o 737.5395 23.51475 106.1028       6.735250      106.1028       6.735250      0.000000       0.000000  737.5395 23.51475 ?        ?        0.000000       23.51475 
1 1 1 13  5  6  o 1345.988 20.10557 352.8625       10.50959      349.1234       12.64783      361.2030       18.88984  1337.888 24.34266 1357.309 35.83617 -19.42041      43.32201 
1 1 1 13  5  7  o 396.4303 41.99502 31.22717       6.366913      42.56055       10.95566      25.44739       7.823736  457.8026 63.31644 353.2655 59.11646 104.5371       86.62405 
1 1 1 13  5  8  o 981.2255 28.09052 187.9429       10.70426      211.0326       15.20777      165.2715       15.06940  1037.559 37.74198 917.0870 42.31139 120.4722       56.69842 
1 1 1 13  5  9  o 1087.834 21.55147 230.4827       9.104741      212.5144       15.05940      240.8345       11.43039  1041.451 37.23409 1111.138 26.48898 -69.68701      45.69512 
1 1 1 13  5  10 o 541.9641 30.02519 57.54445       6.294841      59.14507       11.11045      56.78774       7.639241  544.4164 53.23103 537.1746 36.84165 7.241821       64.73678 
1 1 1 13  5  11 o 550.3434 23.63145 59.03657       5.050707      59.77018       11.31909      58.85419       5.643704  546.8840 54.00042 549.2277 26.45964 -2.343628      60.13450 
1 1 1 13  5  12 o 254.6014 50.96250 13.25859       4.863115      18.78385       7.235772      8.706605       6.567638  301.2556 63.83152 211.4994 69.30544 89.75627       94.22158 
1 1 1 13  5  13 f 790.4250 20.56387 121.7055       6.312387      126.1106       9.331786      117.9895       8.570807  803.1704 29.91776 777.1385 28.39850 26.03192       41.24981 
1 1 1 13  5  14 o 855.3148 26.95808 142.8610       8.954533      0.000000       0.000000      142.8610       8.954533  ?        ?        855.3148 26.95808 0.000000       26.95808 
1 1 1 13  5  15 f 438.4109 30.57426 37.77710       5.172945      28.24823       7.497176      46.43589       7.146699  373.7742 53.14562 484.7527 38.27406 -110.9785      65.49321 
1 1 1 13  5  16 o 648.3187 23.21983 81.97744       5.846226      85.23686       8.225831      78.65062       8.310444  659.7569 32.10464 632.5580 33.95364 27.19891       46.72855 
1 1 1 13  5  17 o 135.7917 60.86954 -2.658489      6.638573      -2.658489      6.638573      0.000000       0.000000  135.7917 60.86954 ?        ?        0.000000       60.86954 
1 1 1 13  5  18 o 403.8673 40.54276 32.49343       6.273044      25.49441       7.216663      54.13033       12.68864  353.4897 54.30639 513.7667 65.05212 -160.2770      84.74055 
1 1 1 13  5  19 o 525.3322 26.62923 54.15506       5.415002      56.93983       7.674822      51.39462       7.641228  536.1156 37.09020 508.6801 38.97688 27.43555       53.80409 
1 1 1 13  5  20 o 408.1724 32.74323 33.00217       5.146618      41.65726       7.121111      23.53772       7.446630  456.6371 40.57868 336.2870 59.18036 120.3500       71.75614 
1 1 1 13  5  21 o 711.9946 21.70715 99.12055       6.002158      101.0764       8.299451      96.97589       8.690729  716.7922 29.81454 701.4431 31.90331 15.34912       43.66610 
1 1 1 13  5  22 o 500.1412 32.02515 49.60285       6.187634      50.24646       7.485612      48.21440       10.99468  500.9875 38.77645 480.7770 60.20600 20.21054       71.61268 
1 1 1 13  5  23 o 409.5360 44.03910 34.13735       6.894130      36.31499       8.892278      30.85615       10.91533  416.6801 56.40135 371.8486 78.07233 44.83148       96.31407 
1 1 1 13  5  24 o 413.0223 32.27699 34.09009       5.136050      32.41679       7.072584      35.95707       7.470701  396.6030 46.82215 417.9281 46.83443 -21.32513      66.22521 
1 1 1 13  5  25 o 151.6785 57.19006 3.884934       4.592944      1.839314       6.301860      6.202689       6.707951  151.4626 63.52930 183.8451 69.15594 -32.38257      93.90696 
1 1 1 13  6  0  o 809.3239 17.15008 127.5982       5.390343      124.9052       7.372222      130.6918       7.901459  799.5577 23.74218 817.6210 24.88440 -18.06323      34.39367 
1 1 1 13  6  1  o 842.9618 21.84998 138.6636       7.152980      137.9243       8.724252      140.1797       12.49402  839.6780 26.75392 843.3060 38.14951 -3.627930      46.59568 
1 1 1 13  6  2  o 529.2050 24.60787 54.70424       5.057385      54.70424       5.057385      0.000000       0.000000  529.2050 24.60787 ?        ?        0.000000       24.60787 
1 1 1 13  6  3  o 538.4516 24.86741 56.61614       5.200022      56.61614       5.200022      0.000000       0.000000  538.4516 24.86741 ?        ?        0.000000       24.86741 
1 1 1 13  6  4  o 1348.941 19.23479 354.4427       10.07647      354.4427       10.07647      0.000000       0.000000  1348.941 19.23479 ?        ?        0.000000       19.23479 
1 1 1 13  6  5  o 1118.695 18.97459 243.6992       8.243509      243.6992       8.243509      0.000000       0.000000  1118.695 18.97459 ?        ?        0.000000       18.97459 
1 1 1 13  6  6  o 242.9950 63.37908 12.23357       6.043318      12.23357       6.043318      0.000000       0.000000  242.9950 63.37908 ?        ?        0.000000       63.37908 
1 1 1 13  6  7  o 197.6880 67.17132 7.319002       6.160155      7.713593       10.27636      7.097681       7.696221  224.5060 85.32927 204.7995 74.60090 19.70648       113.3419 
1 1 1 13  6  8  o 291.4637 56.22874 17.38361       6.133979      23.13281       10.39655      14.31364       7.597178  331.5522 81.35384 262.7293 72.22055 68.82288       108.7854 
1 1 1 13  6  9  o 981.2280 22.06422 187.5594       8.407878      179.6976       14.34178      191.6764       10.37844  957.2772 38.57779 991.1517 26.96272 -33.87445      47.06627 
1 1 1 13  6  10 o 744.1582 24.33029 107.9609       7.031380      109.5134       12.64603      107.2662       8.459592  744.8961 43.90919 741.0803 29.39383 3.815796       52.83951 
1 1 1 13  6  11 o 452.3575 33.48812 40.26556       5.841223      33.42327       10.22368      43.58154       7.117264  403.4066 67.65369 469.5642 39.39327 -66.15759      78.28699 
1 1 1 13  6  12 o 120.5560 54.01669 -2.197829      5.221933      0.3496928      9.832592      -3.198637      6.162889  182.3370 78.02584 127.8571 57.86049 54.47990       97.13840 
1 1 1 13  6  13 o 1223.514 24.63084 292.0558       11.70351      0.000000       0.000000      292.0558       11.70351  ?        ?        1223.514 24.63084 0.000000       24.63084 
1 1 1 13  6  14 o 627.1315 22.90883 76.68835       5.579427      65.34576       8.038188      87.23402       7.750668  576.0233 36.11539 667.8868 29.88190 -91.86359      46.87483 
1 1 1 13  6  15 o 346.2896 37.62880 23.81903       4.978991      23.06368       7.326779      24.46716       6.786885  335.5899 58.33565 347.6545 51.85427 -12.06461      78.05071 
1 1 1 13  6  16 o 496.8176 27.05391 48.36588       5.200145      45.54837       7.558960      50.89739       7.165070  479.2430 41.00919 507.8327 36.57543 -28.58975      54.95012 
1 1 1 13  6  17 o 441.4060 30.26835 38.32705       5.157315      37.31915       7.351893      39.30358       7.236563  432.3362 44.41895 444.3034 42.45646 -11.96719      61.44586 
1 1 1 13  6  18 o 592.5165 28.83500 68.76231       6.635114      70.80828       7.956383      64.09029       12.02316  599.2484 34.33154 562.9814 55.72334 36.26703       65.45032 
1 1 1 13  6  19 o 616.4370 33.12786 74.96099       7.901590      74.96099       7.901590      0.000000       0.000000  616.4370 33.12786 ?        ?        0.000000       33.12786 
1 1 1 13  6  20 o 589.0181 24.53860 67.92000       5.613146      79.39559       7.896999      56.20184       7.980025  634.2092 32.16811 531.2007 38.95441 103.0085       50.51963 
1 1 1 13  6  21 o 112.4131 51.83725 -3.697060      5.259355      -9.804606      6.448292      8.439704       9.089977  105.9851 51.26807 216.2899 80.67117 -110.3048      95.58374 
1 1 1 13  6  22 o 416.8275 36.14907 34.75367       5.793751      36.68109       6.990279      30.52399       10.35521  425.8588 42.84873 373.8011 73.95187 52.05768       85.46866 
1 1 1 13  6  23 o 315.8400 41.12144 20.33416       4.924265      24.54300       6.733475      15.49532       7.219864  342.8847 52.21539 264.9280 69.35905 77.95670       86.81662 
1 1 1 13  6  24 o 238.3263 59.62132 12.37242       5.504465      10.59671       8.382944      13.71834       7.298262  223.1881 78.24987 247.4711 71.75719 -24.28304      106.1703 
1 1 1 13  6  25 o 287.6173 45.17253 17.23712       4.879368      16.99901       6.754821      17.49693       7.055962  276.9700 64.07265 280.1595 65.94695 -3.189575      91.94730 
1 1 1 13  7  0  o 698.6689 26.86479 95.50351       7.289249      0.000000       0.000000      95.50351       7.289249  ?        ?        698.6689 26.86479 0.000000       26.86479 
1 1 1 13  7  1  o 566.2010 31.40960 63.04518       6.879457      63.04518       6.879457      0.000000       0.000000  566.2010 31.40960 ?        ?        0.000000       31.40960 
1 1 1 13  7  2  o 1161.763 19.04655 262.9637       8.593340      262.9637       8.593340      0.000000       0.000000  1161.763 19.04655 ?        ?        0.000000       19.04655 
1 1 1 13  7  3  o 404.2776 30.46707 32.16997       4.748261      32.16997       4.748261      0.000000       0.000000  404.2776 30.46707 ?        ?        0.000000       30.46707 
1 1 1 13  7  4  o 690.1145 21.77602 92.83500       5.836166      92.83500       5.836166      0.000000       0.000000  690.1145 21.77602 ?        ?        0.000000       21.77602 
1 1 1 13  7  5  o 394.8239 31.39450 30.68410       4.774014      30.68410       4.774014      0.000000       0.000000  394.8239 31.39450 ?        ?        0.000000       31.39450 
1 1 1 13  7  6  o 768.3148 18.62943 114.9104       5.558617      110.8657       7.397731      120.1553       8.424024  753.8837 25.26773 784.4789 27.65097 -30.59515      37.45710 
1 1 1 13  7  7  o 1848.749 18.59562 665.2621       13.35108      620.2880       25.78852      681.7305       15.60520  1778.737 37.33247 1870.745 21.47962 -92.00818      43.07073 
1 1 1 13  7  8  o 685.4747 20.93736 91.51093       5.573671      75.55679       11.77783      96.11494       6.326983  616.7642 49.59124 702.2691 23.19878 -85.50494      54.74920 
1 1 1 13  7  9  o 1179.442 17.19923 270.6632       7.877958      257.2814       16.20122      274.8070       9.015581  1145.895 36.40616 1188.088 19.53967 -42.19226      41.31836 
1 1 1 13  7  10 o 376.1907 30.95072 27.85036       4.481638      33.07266       10.76995      26.75669       4.928627  399.9026 71.99527 368.0056 34.90353 31.89691       80.00985 
1 1 1 13  7  11 o 832.7957 18.50926 135.0163       5.986258      122.3148       12.73039      138.6222       6.782973  787.4825 41.77622 843.5723 20.70474 -56.08978      46.62551 
1 1 1 13  7  12 o 639.0507 25.66356 79.70623       6.369130      80.60206       11.62938      79.32240       7.612289  637.0733 47.34278 636.7973 30.78124 0.2760010      56.46967 
1 1 1 13  7  13 o 332.8326 44.41584 22.21661       5.597791      24.50517       10.45419      21.29668       6.628046  340.1489 80.40855 323.1573 54.76938 16.99158       97.28936 
1 1 1 13  7  14 o 215.1911 61.15173 9.510455       5.351200      3.344003       9.951246      12.01896       6.346980  197.3913 81.03707 240.6644 65.95197 -43.27316      104.4829 
1 1 1 13  7  15 o 1061.621 25.11587 219.9944       10.35489      0.000000       0.000000      219.9944       10.35489  ?        ?        1061.621 25.11587 0.000000       25.11587 
1 1 1 13  7  16 o 642.7076 22.85183 80.57903       5.703776      81.03106       8.360178      80.18539       7.801488  641.9360 33.65199 639.8343 31.39655 2.101685       46.02391 
1 1 1 13  7  17 o 463.9910 28.89156 42.30222       5.180224      36.26566       7.332148      48.31839       7.319754  425.7510 45.02862 493.8605 38.46837 -68.10950      59.22324 
1 1 1 13  7  18 o 361.2066 35.16886 25.91386       4.870779      28.24554       6.960017      23.67584       6.818797  373.4709 49.18356 340.1517 53.37558 33.31918       72.58082 
1 1 1 13  7  19 o 742.6216 21.12520 107.6890       6.092511      123.9400       8.779932      92.59666       8.461132  794.8809 28.44206 686.2064 31.75015 108.6746       42.62655 
1 1 1 13  7  20 o 398.0197 45.79829 32.05962       6.950104      32.05962       6.950104      0.000000       0.000000  398.0197 45.79829 ?        ?        0.000000       45.79829 
1 1 1 13  7  21 f 554.9882 34.54359 61.18645       7.408330      61.18645       7.408330      0.000000       0.000000  554.9882 34.54359 ?        ?        0.000000       34.54359 
1 1 1 13  7  22 o 531.9979 25.69170 55.63029       5.307998      67.11780       7.530608      44.28786       7.482906  580.9819 33.51873 468.4550 41.56314 112.5269       53.39476 
1 1 1 13  7  23 o 664.6498 22.73268 86.73096       5.867749      90.11466       8.169096      83.12447       8.433732  674.2316 31.19873 645.6177 33.75418 28.61383       45.96418 
1 1 1 13  7  24 f 314.9314 41.06339 20.33572       4.902756      20.76888       6.536711      19.77868       7.412702  311.6179 56.07634 299.1805 65.60596 12.43747       86.30584 
1 1 1 13  7  25 o 655.4896 25.48162 84.85001       6.486656      82.85857       10.19061      86.20651       8.410577  637.9449 41.35570 656.1840 33.11128 -18.23901      52.97783 
1 1 1 13  8  0  o 553.7709 26.61396 59.96268       5.723578      59.96268       5.723578      0.000000       0.000000  553.7709 26.61396 ?        ?        0.000000       26.61396 
1 1 1 13  8  1  o 806.0382 21.05744 126.6803       6.591573      126.6803       6.591573      0.000000       0.000000  806.0382 21.05744 ?        ?        0.000000       21.05744 
1 1 1 13  8  2  o 731.1552 21.41934 104.2250       6.081961      104.2250       6.081961      0.000000       0.000000  731.1552 21.41934 ?        ?        0.000000       21.41934 
1 1 1 13  8  3  o 463.7594 27.52660 42.16993       4.935418      42.16993       4.935418      0.000000       0.000000  463.7594 27.52660 ?        ?        0.000000       27.52660 
1 1 1 13  8  4  o 203.0573 50.42262 8.481821       3.958045      9.185086       4.432970      5.717169       8.789327  211.1161 53.88647 202.3044 78.39497 8.811707       95.12899 
1 1 1 13  8  5  o 289.0591 34.97092 16.60390       3.845896      17.07525       4.352687      14.92600       8.212415  292.3288 39.33925 267.7678 75.63924 24.56100       85.25768 
1 1 1 13  8  6  o 516.6230 23.52411 52.03126       4.719705      51.67109       6.176113      52.53684       7.317432  513.1471 31.13897 516.3989 36.72706 -3.251770      48.15093 
1 1 1 13  8  7  o 264.3313 48.73302 14.21004       4.818332      19.08127       10.93857      13.03732       5.367076  301.7945 87.94682 251.5556 56.33873 50.23889       104.4447 
1 1 1 13  8  8  o 774.4153 20.05052 116.7796       6.030141      116.1998       13.22532      116.9318       6.775415  767.0097 44.59188 774.6351 22.52220 -7.625366      49.95684 
1 1 1 13  8  9  o 1002.606 17.45082 195.6183       6.794765      192.7307       15.08974      196.3528       7.609923  990.8016 39.21634 1004.212 19.51313 -13.41034      43.80278 
1 1 1 13  8  10 o 546.3121 23.92518 58.20351       5.076028      54.76361       11.70489      59.00030       5.633315  521.2600 58.85131 549.7837 26.38422 -28.52368      64.49499 
1 1 1 13  8  11 f 480.5625 25.25666 45.19038       4.697078      47.25707       10.77931      44.70599       5.218582  483.6199 58.58846 477.5094 28.26705 6.110474       65.05101 
1 1 1 13  8  12 o 247.4607 45.60298 12.45593       4.221082      21.95548       10.47795      10.61556       4.611872  321.4138 83.27020 226.8144 53.26578 94.59943       98.84923 
1 1 1 13  8  13 o 415.4156 29.01042 33.90230       4.650821      44.01011       10.90720      31.65614       5.141670  465.1036 61.92479 400.5873 33.35372 64.51636       70.33598 
1 1 1 13  8  14 o 737.2366 23.70580 106.0330       6.787182      93.15665       12.23472      111.7572       8.157487  685.0815 46.25676 756.2180 27.77675 -71.13647      53.95586 
1 1 1 13  8  15 o 728.3835 24.45023 103.5528       6.916255      98.99650       12.76350      105.4469       8.229156  705.8829 46.82540 734.2713 28.85830 -28.38837      55.00381 
1 1 1 13  8  16 o 347.0355 42.22726 24.10449       5.573775      10.35415       10.48039      29.52753       6.581760  239.5710 87.08733 383.8835 45.00223 -144.3124      98.02757 
1 1 1 13  8  17 o 790.3119 20.12196 121.7948       6.175851      112.7709       8.695628      130.9795       8.772829  758.6331 29.51489 818.0490 27.61419 -59.41583      40.41871 
1 1 1 13  8  18 o 421.7657 33.45620 35.21008       5.434960      36.11105       7.189002      34.00817       8.303231  424.1944 44.29232 408.4600 53.64139 15.73434       69.56441 
1 1 1 13  8  19 o 180.5847 61.55191 6.264305       5.172734      2.763137       6.677330      11.51857       8.179988  164.4714 66.81908 236.1711 77.34409 -71.69969      102.2101 
1 1 1 13  8  20 o 470.0905 31.05376 43.71854       5.637285      44.77058       7.122259      41.95404       9.223821  473.2133 39.10585 452.3641 53.54314 20.84918       66.30336 
1 1 1 13  8  21 o 263.3840 56.26355 14.67789       5.580203      17.85705       6.484849      5.607960       10.95332  289.9304 59.58602 209.1057 85.33667 80.82468       104.0809 
1 1 1 13  8  22 o 171.9153 66.63281 4.586269       6.350761      4.586269       6.350761      0.000000       0.000000  171.9153 66.63281 ?        ?        0.000000       66.63281 
1 1 1 13  8  23 o 156.0908 58.00967 4.228025       4.692019      8.253665       6.334773      -0.6645010     6.983612  199.6663 68.11537 145.0693 63.86969 54.59705       93.37581 
1 1 1 13  8  24 o 296.3768 49.36894 18.49160       5.482429      15.87911       8.062659      20.73838       7.477066  263.2459 75.15099 306.3935 64.85938 -43.14758      99.26939 
1 1 1 13  9  0  o 232.9927 57.88089 11.28595       5.213876      11.28595       5.213876      0.000000       0.000000  232.9927 57.88089 ?        ?        0.000000       57.88089 
1 1 1 13  9  1  o 355.0013 37.31353 25.03519       5.067292      25.03519       5.067292      0.000000       0.000000  355.0013 37.31353 ?        ?        0.000000       37.31353 
1 1 1 13  9  2  o 1145.523 19.29185 255.6021       8.582336      255.6021       8.582336      0.000000       0.000000  1145.523 19.29185 ?        ?        0.000000       19.29185 
1 1 1 13  9  3  f 573.6301 20.98443 64.11980       4.674736      66.88016       5.356016      55.29268       9.577879  585.5800 23.55199 526.9109 47.31044 58.66907       52.84860 
1 1 1 13  9  4  o 509.1387 23.11763 50.54203       4.570961      48.05820       5.088507      60.92294       10.40271  495.4503 26.54261 553.0157 48.94287 -57.56546      55.67688 
1 1 1 13  9  5  o 885.7073 16.93023 152.6519       5.823461      154.9416       6.711798      145.6785       11.71290  892.0322 19.37449 862.2521 34.97859 29.78003       39.98591 
1 1 1 13  9  6  o 354.1588 32.42844 24.74217       4.410660      29.08370       5.575208      17.47934       7.210958  383.1912 37.96385 290.0664 65.55538 93.12482       75.75462 
1 1 1 13  9  7  o 908.7158 18.88324 160.7590       6.663963      159.8317       14.37522      161.0128       7.520905  901.7717 41.04780 909.1135 21.30218 -7.341736      46.24613 
1 1 1 13  9  8  o 811.9763 19.79363 128.3928       6.241614      134.8478       14.02329      126.7981       6.970084  826.3732 43.85337 806.6111 22.25081 19.76215       49.17537 
1 1 1 13  9  9  o 1260.547 17.25063 309.2499       8.444855      281.1685       17.27283      318.0708       9.680753  1196.987 37.15746 1277.992 19.50532 -81.00464      41.96587 
1 1 1 13  9  10 o 546.6298 23.53691 58.27771       4.996556      58.47599       11.52920      58.23186       5.544275  539.4258 55.84381 546.1339 26.14072 -6.708069      61.65930 
1 1 1 13  9  11 o 639.6499 20.95993 79.73491       5.206672      85.62386       12.19093      78.42104       5.758274  656.1497 48.17849 634.0789 23.38412 22.07086       53.55356 
1 1 1 13  9  12 o 1019.982 21.18286 202.7745       8.390836      166.4845       14.37939      221.5119       10.33240  919.7253 40.25819 1065.289 24.97502 -145.5633      47.37588 
1 1 1 13  9  13 o 983.0120 17.47535 188.1194       6.671335      191.6916       15.23461      187.2719       7.420671  987.0210 39.74449 980.4880 19.48825 6.532959       44.26530 
1 1 1 13  9  14 o 748.0905 19.46333 109.0251       5.654565      105.9658       12.43836      109.8220       6.348506  731.3746 43.99677 750.5104 21.78145 -19.13586      49.09325 
1 1 1 13  9  15 o 433.5459 29.99882 36.96899       5.019833      36.57034       7.676056      37.26686       6.635346  427.2585 47.04082 433.1991 39.88912 -5.940613      61.67642 
1 1 1 13  9  16 o 797.4071 23.09032 124.1277       7.150528      121.6495       13.55423      125.0834       8.417097  782.4915 44.78934 799.6697 27.10340 -17.17828      52.35149 
1 1 1 13  9  17 o 267.3409 61.45424 15.00538       6.246796      26.35643       10.78547      9.275458       7.662943  349.4021 81.05449 218.4386 74.91338 130.9635       110.3714 
1 1 1 13  9  18 o 306.4102 55.59225 19.46667       6.371614      25.35249       10.79870      16.32320       7.891743  340.6127 82.50813 275.7745 72.66708 64.83817       109.9459 
1 1 1 13  9  19 o 700.9896 21.15166 96.03083       5.758164      92.10109       8.121202      100.0036       8.165526  684.1171 30.56763 713.1933 29.48146 -29.07617      42.46807 
1 1 1 13  9  20 o 168.4019 58.29134 5.384623       4.644859      7.132467       6.730120      3.794843       6.418593  194.9746 69.93551 168.1420 66.44754 26.83260       96.46891 
1 1 1 13  9  21 o 947.4168 18.71453 175.4176       6.885700      179.9477       9.816240      171.0293       9.661308  956.5304 26.42521 932.4108 26.68091 24.11957       37.55213 
1 1 1 13  9  22 o 235.0341 58.68052 11.92578       5.339707      10.36537       6.241059      16.18807       10.31478  218.9802 67.07308 266.7803 86.82714 -47.80011      109.7167 
1 1 1 13  9  23 o 361.1239 61.17262 28.13823       8.272814      28.13823       8.272814      0.000000       0.000000  361.1239 61.17262 ?        ?        0.000000       61.17262 
1 1 1 13  9  24 o 438.5527 33.93386 38.67799       5.734422      43.56501       8.695907      34.91756       7.628016  456.8918 49.81607 409.0521 48.99295 47.83963       69.87096 
1 1 1 13  10 0  o 667.5504 24.67424 87.00139       6.396698      87.00139       6.396698      0.000000       0.000000  667.5504 24.67424 ?        ?        0.000000       24.67424 
1 1 1 13  10 1  o 508.3014 28.55329 50.67689       5.613619      50.67689       5.613619      0.000000       0.000000  508.3014 28.55329 ?        ?        0.000000       28.55329 
1 1 1 13  10 2  o 850.4797 18.14514 140.8333       5.993112      142.0622       6.954997      137.2894       11.81094  853.7929 20.97570 836.2960 36.36609 17.49695       41.98181 
1 1 1 13  10 3  o 719.5562 19.16690 100.8315       5.356049      95.99311       6.111852      116.8456       11.11914  701.7021 22.42808 771.5038 37.11121 -69.80176      43.36197 
1 1 1 13  10 4  o 297.0341 36.15404 17.55254       4.084505      17.50557       4.637870      17.71488       8.622530  295.5116 41.56112 290.3444 75.69364 5.167175       86.35308 
1 1 1 13  10 5  o 647.3696 21.63658 81.66686       5.439624      88.59318       7.084887      71.72096       8.489925  673.5864 27.08393 603.6534 36.38502 69.93292       45.35867 
1 1 1 13  10 6  o 311.1782 35.95370 19.23152       4.264921      21.53251       5.255259      14.79228       7.299461  328.2073 42.20858 266.2879 69.75253 61.91940       81.52901 
1 1 1 13  10 7  o 267.5196 40.15475 14.36905       4.042972      24.41651       5.277788      0.9969357E-01  6.289642  350.3675 39.47615 146.2958 62.49866 204.0717       73.92191 
1 1 1 13  10 8  o 754.6259 25.17921 111.1346       7.379072      97.87878       12.43495      118.3398       9.167717  702.7072 45.81673 777.8193 30.34971 -75.11212      54.95705 
1 1 1 13  10 9  o 983.2261 18.03862 188.2195       6.887867      195.7569       15.56536      186.3842       7.680818  997.4635 40.18223 978.0859 20.22099 19.37756       44.98333 
1 1 1 13  10 10 o 1157.944 17.30242 261.0161       7.780768      261.4386       17.32289      260.9093       8.708671  1153.095 38.68361 1157.338 19.37599 -4.242065      43.26489 
1 1 1 13  10 11 o 292.9404 39.11560 17.16758       4.338808      24.80988       10.35303      15.53938       4.778704  341.9755 79.46838 276.8854 46.05887 65.09015       91.85120 
1 1 1 13  10 12 o 445.1611 27.43779 38.87363       4.720335      37.92035       11.20242      39.07942       5.204970  428.1896 69.76981 445.8592 30.23904 -17.66962      76.04095 
1 1 1 13  10 13 o 738.9731 19.51754 106.3899       5.601209      89.26601       12.60839      110.6003       6.252008  669.4032 48.83722 753.2045 21.37365 -83.80133      53.30954 
1 1 1 13  10 14 o 614.9590 21.44679 73.74094       5.121963      68.78085       11.79123      74.89455       5.686481  585.7149 52.39082 619.4728 23.63705 -33.75793      57.47616 
1 1 1 13  10 15 o 200.7290 50.13280 8.324441       3.896435      6.107479       7.223409      9.234239       4.627384  193.1438 71.93776 211.0919 55.65416 -17.94804      90.95288 
1 1 1 13  10 16 o 1577.650 20.35835 485.4957       12.47329      480.0727       15.78975      494.4970       20.34274  1566.604 25.95304 1586.376 33.01987 -19.77258      41.99847 
1 1 1 13  10 17 o 296.5334 46.77602 17.92308       5.208162      8.546811       7.106574      28.80194       7.654855  209.8544 72.13265 374.9993 54.13003 -165.1449      90.18414 
1 1 1 13  10 18 o 762.0434 23.81555 113.6457       7.048039      112.8450       13.38030      113.9532       8.291599  750.0555 46.15918 761.9339 28.02161 -11.87836      53.99889 
1 1 1 13  10 19 o 393.0748 38.86124 30.97944       5.854561      16.59863       11.06675      36.56823       6.899019  275.6214 89.94773 426.1997 42.23796 -150.5783      99.37122 
1 1 1 13  10 20 o 437.5133 29.77658 37.90963       5.029244      33.11375       7.094136      42.75529       7.130858  403.2157 46.13408 461.1769 40.21745 -57.96118      61.20291 
1 1 1 13  10 21 o 152.4075 57.72726 3.733684       4.693141      1.488037       6.432769      6.289188       6.862236  152.1838 64.02697 187.5856 70.06715 -35.40178      94.91501 
1 1 1 13  10 22 o 329.6612 41.85192 22.24345       5.237381      17.11384       7.784071      26.48649       7.079509  276.0414 71.89723 355.0805 52.95867 -79.03912      89.29632 
1 1 1 13  10 23 o 112.1794 50.48740 -1.697628      4.617991      4.184128       6.154780      -9.274179      6.985457  165.6022 65.18703 112.1281 54.02121 53.47407       84.66192 
1 1 1 13  10 24 o 392.4731 38.52589 31.36986       5.796367      35.08414       6.831627      21.82427       10.95187  412.8328 43.25330 299.2850 88.22544 113.5478       98.25771 
1 1 1 13  11 0  o 926.2722 21.30384 167.2724       7.663453      167.2724       7.663453      0.000000       0.000000  926.2722 21.30384 ?        ?        0.000000       21.30384 
1 1 1 13  11 1  f 372.7169 33.28193 27.44127       4.766755      35.70942       5.577515      5.040560       9.180523  425.4014 34.04617 200.5654 79.40231 224.8360       86.39368 
1 1 1 13  11 2  o 381.7116 30.79103 28.69662       4.525606      29.03960       5.129903      27.49267       9.611098  383.2513 34.84730 363.2000 70.68300 20.05133       78.80622 
1 1 1 13  11 3  o 511.5348 24.15020 51.05148       4.797598      49.72764       5.466846      55.48714       10.00690  503.6754 28.05991 527.1530 49.45866 -23.47757      56.86403 
1 1 1 13  11 4  o 677.5829 19.67278 89.42770       5.176739      92.53394       5.938748      79.59988       10.56347  688.9587 22.19595 634.1294 43.15105 54.82928       48.52497 
1 1 1 13  11 5  o 256.4709 45.78201 13.35951       4.392674      10.90438       5.407240      18.12414       7.532747  229.4874 59.99699 294.6532 67.30391 -65.16577      90.16349 
1 1 1 13  11 6  o 207.9337 52.27724 8.911912       4.216989      7.319942       5.095689      12.37150       7.511867  192.2875 60.87654 245.1163 73.26479 -52.82875      95.25588 
1 1 1 13  11 7  o 796.3668 18.93853 123.5165       5.857163      129.4600       7.624422      114.9586       9.149001  814.5472 24.10253 766.4123 30.73854 48.13489       39.06136 
1 1 1 13  11 8  o 1037.519 18.49274 209.6335       7.451190      173.3870       14.58147      222.4433       8.668425  938.5404 40.00555 1068.318 20.89353 -129.7771      45.13295 
1 1 1 13  11 9  o 504.3746 31.67751 50.02061       6.173352      50.39939       11.39977      49.86343       7.343287  498.4233 60.10674 502.2309 37.92922 -3.807617      71.07352 
1 1 1 13  11 10 o 344.5566 45.06647 23.84105       5.885826      17.06446       10.66284      26.81071       7.058631  285.3280 87.71690 364.0411 51.35428 -78.71313      101.6441 
1 1 1 13  11 11 o 599.1282 22.31883 70.00872       5.193011      79.70557       12.16615      67.84843       5.742406  631.8799 49.98625 589.4709 25.08439 42.40900       55.92720 
1 1 1 13  11 12 o 623.0270 21.29789 75.67810       5.153135      84.58521       12.56094      73.87562       5.650536  650.9538 50.07122 615.2734 23.64795 35.68042       55.37466 
1 1 1 13  11 13 o 771.4623 18.66286 115.9371       5.591403      115.6457       13.17799      116.0011       6.174782  763.5020 44.63815 771.4034 20.61162 -7.901489      49.16709 
1 1 1 13  11 14 o 959.0090 18.92688 179.2102       7.049034      188.0984       15.32307      176.8243       7.938954  976.4551 40.40784 952.1270 21.47041 24.32806       45.75775 
1 1 1 13  11 15 o 676.3124 48.88351 91.53526       12.75272      91.53526       12.75272      0.000000       0.000000  676.3124 48.88351 ?        ?        0.000000       48.88351 
1 1 1 13  11 16 o 513.5746 26.73253 51.79316       5.313350      36.86914       7.873923      64.27074       7.199684  427.2954 48.29770 570.7736 32.61575 -143.4782      58.27911 
1 1 1 13  11 17 o 476.0338 27.91124 44.61124       5.137385      42.72171       7.593533      46.20610       6.976361  461.5500 42.85304 481.8719 37.57645 -20.32190      56.99450 
1 1 1 13  11 18 o 109.8185 49.88477 -2.463334      4.633528      -5.566829      7.114004      -0.1767196     6.106397  127.7076 59.37371 140.6452 60.84871 -12.93763      85.01649 
1 1 1 13  11 19 o 334.8611 45.03251 22.87200       5.707781      14.18318       11.16855      25.94359       6.640459  258.7069 90.34145 355.3173 49.46480 -96.61038      102.9968 
1 1 1 13  11 20 o 358.3842 51.36728 26.62921       6.944850      0.000000       0.000000      26.62921       6.944850  ?        ?        358.3842 51.36728 0.000000       51.36728 
1 1 1 13  11 21 o 271.7543 50.73178 15.54740       5.157160      16.51821       7.868966      14.81646       6.827966  271.4852 73.03678 259.0746 67.26867 12.41068       99.29474 
1 1 1 13  11 22 o 266.3620 48.20789 14.92860       4.803174      5.225251       6.426464      27.20911       7.229689  175.2833 67.27341 358.9391 53.49898 -183.6558      85.95262 
1 1 1 13  11 23 o 624.0536 23.14424 76.69901       5.609095      75.40250       7.560332      78.28638       8.365562  614.1808 31.80590 624.1921 34.64645 -10.01135      47.03181 
1 1 1 13  12 0  o 177.6787 63.64610 5.520050       5.572278      5.520050       5.572278      0.000000       0.000000  177.6787 63.64610 ?        ?        0.000000       63.64610 
1 1 1 13  12 1  o 124.3669 53.20040 -0.1970387E-01 4.568192      2.228532       5.306472      -6.455280      8.977981  148.9769 59.90157 146.4272 67.59404 2.549652       90.31695 
1 1 1 13  12 2  o 909.6316 18.13354 161.1304       6.405839      164.3208       7.521611      152.7057       12.22260  918.1275 21.09502 881.9035 35.68736 36.22400       41.45584 
1 1 1 13  12 3  o 830.2955 18.74533 134.2714       6.044408      139.3687       7.133626      121.2973       11.38103  845.4682 21.72626 785.6411 37.30176 59.82709       43.16772 
1 1 1 13  12 4  o 300.9771 36.83665 18.05297       4.215808      19.72548       4.767511      12.05523       9.028203  314.1253 39.98715 245.9538 81.28957 68.17151       90.59231 
1 1 1 13  12 5  o 470.3563 26.41116 43.35563       4.804869      47.72641       6.042525      35.83946       7.923870  492.5974 31.75545 422.4794 49.21767 70.11801       58.57292 
1 1 1 13  12 6  f 1071.234 17.20791 223.4135       7.158801      214.7317       9.348974      235.7197       11.13065  1049.142 22.94573 1098.468 26.09188 -49.32642      34.74611 
1 1 1 13  12 7  o 224.9894 49.94907 10.42856       4.250540      7.953781       5.194548      15.44323       7.394368  198.7263 61.24551 271.0724 69.81571 -72.34610      92.87220 
1 1 1 13  12 8  o 759.8348 21.39356 112.5760       6.312920      128.6661       13.73358      108.2653       7.108427  805.7750 44.05449 744.6501 24.58064 61.12488       50.44805 
1 1 1 13  12 9  o 736.3286 21.74790 105.7362       6.218949      97.63524       13.53490      107.9041       7.001818  699.3853 50.16550 743.4476 24.25116 -44.06232      55.71980 
1 1 1 13  12 10 o 270.2419 46.35868 14.84335       4.690157      12.34259       10.54488      15.46009       5.236656  252.6057 87.80692 274.8067 50.94396 -22.20103      101.5152 
1 1 1 13  12 11 o 799.1346 19.14742 124.4238       5.942348      115.9706       13.50186      126.4545       6.617740  764.2011 45.70399 805.3295 21.15963 -41.12842      50.36452 
1 1 1 13  12 12 o 588.9760 23.81630 67.72014       5.447534      56.38211       12.21433      70.53539       6.086390  526.5880 60.84741 600.7735 26.08681 -74.18549      66.20369 
1 1 1 13  12 13 o 449.9714 28.04909 39.77296       4.877137      58.24939       11.43281      35.66261       5.392411  536.9036 55.63897 425.0383 32.92523 111.8654       64.65111 
1 1 1 13  12 14 o 207.3098 53.02980 8.920170       4.286605      0.3270723      10.04096      10.83534       4.740283  182.1176 78.40997 228.2234 54.27556 -46.10583      95.36225 
1 1 1 13  12 15 o 446.4109 26.08932 39.14185       4.503304      43.85463       11.70344      38.32281       4.878953  458.6904 67.73827 441.1869 28.63053 17.50345       73.54034 
1 1 1 13  12 16 o 475.2307 24.98668 44.33797       4.595296      42.76517       11.41117      44.64240       5.020364  451.9478 67.04808 476.3749 27.24991 -24.42709      72.37405 
1 1 1 13  12 17 o 205.6916 55.97940 8.883151       4.591240      18.38685       7.240545      2.492127       5.937589  293.4537 65.22487 155.4174 63.05621 138.0363       90.72138 
1 1 1 13  12 18 o 377.9239 33.76436 28.46568       4.903360      19.34813       7.253044      36.14020       6.654369  300.6933 64.07131 423.7916 40.94202 -123.0983      76.03540 
1 1 1 13  12 19 o 153.3374 60.19905 3.237338       5.235866      8.856444       8.959893      0.3234501      6.452168  216.3776 80.21248 146.1309 62.88550 70.24669       101.9246 
1 1 1 13  12 20 o 276.7172 51.15229 16.09653       5.294562      7.384062       8.803631      21.03333       6.626958  204.6751 78.69498 315.0377 56.22828 -110.3626      96.71877 
1 1 1 13  12 21 o 538.7807 31.72438 57.88874       6.608644      63.42328       13.61411      56.18254       7.558976  541.5428 66.10557 528.2301 37.08282 13.31268       75.79632 
1 1 1 13  12 22 o 388.5536 41.88754 30.95672       6.220747      42.84476       12.78526      27.26947       7.120417  431.8231 79.15577 359.0523 52.62667 72.77078       95.05368 
1 1 1 13  12 23 o 104.0248 47.82027 -2.698384      4.428061      5.678242       6.028432      -12.51336      6.525511  175.1152 65.62071 98.21902 48.36489 76.89613       81.51834 
1 1 1 13  13 0  o 266.4270 57.23404 14.73610       5.745304      14.73610       5.745304      0.000000       0.000000  266.4270 57.23404 ?        ?        0.000000       57.23404 
1 1 1 13  13 1  o 130.8357 57.17760 -0.9044707     5.506012      -12.58622      7.022788      17.73149       8.870158  106.3738 51.91904 288.7977 77.48077 -182.4239      93.26766 
1 1 1 13  13 2  o 1256.901 17.25896 307.6385       8.424494      309.1466       9.968418      303.8696       15.75911  1259.269 20.38355 1244.627 32.60352 14.64209       38.45099 
1 1 1 13  13 3  o 332.3437 37.09159 21.98703       4.705642      20.93039       5.433552      25.15722       9.411575  322.3953 44.59155 345.5909 72.44112 -23.19559      85.06540 
1 1 1 13  13 4  o 158.2731 57.77000 4.162954       4.618598      2.187717       5.896706      7.298044       7.428908  154.5710 62.79387 203.2717 73.40827 -48.70065      96.60147 
1 1 1 13  13 5  o 1015.005 17.63331 200.6429       6.950723      196.2607       9.132845      206.6753       10.71532  1002.717 23.45306 1028.146 26.83628 -25.42902      35.64032 
1 1 1 13  13 6  o 188.3214 55.60517 7.215285       4.347291      9.623248       5.378800      2.679257       7.382412  215.8228 61.30157 171.7703 70.07461 44.05254       93.10388 
1 1 1 13  13 7  o 696.6304 19.85507 94.59008       5.371577      87.51466       6.697808      107.3442       8.992540  669.2053 25.77184 740.0419 31.28946 -70.83655      40.53662 
1 1 1 13  13 8  o 379.1480 27.70942 28.26595       4.051779      21.01375       5.349654      38.02335       6.205231  323.2433 43.73886 438.1869 36.80545 -114.9436      57.16405 
1 1 1 13  13 9  f 303.9232 45.08916 18.65516       5.160489      5.773431       11.07920      22.22419       5.831721  216.7214 86.76108 331.8774 46.52566 -115.1560      98.44858 
1 1 1 13  13 10 o 473.0448 30.00677 43.99742       5.483973      35.21104       11.60298      46.52470       6.222889  409.1405 75.81655 485.8375 33.18010 -76.69696      82.75910 
1 1 1 13  13 11 o 597.7665 24.42777 69.79015       5.670789      59.90031       12.58769      72.30841       6.351868  542.6703 60.77180 608.0801 26.89755 -65.40973      66.45818 
1 1 1 13  13 12 o 268.2346 47.95354 14.70096       4.811974      12.98183       11.28289      15.08317       5.320066  258.1649 90.76605 270.6183 52.51537 -12.45334      104.8634 
1 1 1 13  13 13 o 130.6612 52.32000 1.776584       4.029965      11.81389       10.24927      -0.5899617E-01 4.382994  246.4122 86.51570 121.2528 51.99591 125.1594       100.9383 
1 1 1 13  13 14 o 188.8381 52.74707 7.369815       4.017117      2.354114       10.55800      8.218824       4.343821  194.5360 81.94556 198.9464 54.57776 -4.410385      98.45713 
1 1 1 13  13 15 o 518.2096 23.43164 52.52938       4.715591      32.99463       12.03040      56.07561       5.125772  388.9123 82.22381 535.2048 24.66103 -146.2925      85.84242 
1 1 1 13  13 16 o 393.3189 28.89380 30.56818       4.382550      27.69861       11.61432      31.04461       4.732393  352.6712 85.65247 395.8673 31.03096 -43.19604      91.10031 
1 1 1 13  13 17 o 294.1639 35.44861 17.37788       3.968073      15.77710       7.417995      18.01954       4.696503  269.4440 70.18982 297.7752 41.76072 -28.33118      81.67355 
1 1 1 13  13 18 o 414.6554 33.42395 34.26907       5.336654      31.01779       9.634974      35.70795       6.409670  379.7280 67.82428 421.1595 39.65566 -41.43155      78.56656 
1 1 1 13  13 19 o 223.2691 58.35287 10.72132       5.116001      17.36389       9.054243      7.605893       6.200730  277.0230 79.80912 194.6614 67.35199 82.36163       104.4308 
1 1 1 13  13 20 o 405.7864 32.33891 32.93406       5.053940      23.02251       7.184074      42.64550       7.111184  327.7552 58.59130 458.5592 40.34235 -130.8040      71.13681 
1 1 1 13  13 21 o 744.6685 29.18428 110.0261       8.439952      0.000000       0.000000      110.0261       8.439952  ?        ?        744.6685 29.18428 0.000000       29.18428 
1 1 1 13  13 22 o 210.5741 63.10570 9.786003       5.567668      10.94518       12.47867      9.497888       6.221235  232.9471 92.46170 208.1081 67.41164 24.83899       114.4268 
1 1 1 13  14 0  o 881.4244 19.85999 151.5091       6.798172      155.6441       7.921010      139.9464       13.24562  892.7512 22.84663 841.4178 40.53522 51.33344       46.53034 
1 1 1 13  14 1  o 797.8937 20.48384 124.1755       6.347233      121.7040       7.406850      131.0073       12.31481  789.2220 24.16609 814.8050 38.91759 -25.58295      45.81025 
1 1 1 13  14 2  o 359.3683 36.03725 25.66391       4.961678      25.81704       5.991434      25.32968       8.851635  358.4820 43.95740 347.4950 68.02638 10.98706       80.99285 
1 1 1 13  14 3  o 810.5003 19.41517 128.0584       6.111142      127.3495       7.195742      129.8925       11.57510  807.6277 22.94227 812.2040 36.69710 -4.576294      43.27846 
1 1 1 13  14 4  o 552.3469 25.02684 59.62434       5.368413      65.67715       7.275324      52.38927       7.954178  577.5320 32.57048 513.6621 40.19452 63.86993       51.73428 
1 1 1 13  14 5  o 301.8470 41.37163 18.31797       4.722118      20.30995       5.975064      15.00395       7.706879  315.7018 50.43193 266.3602 72.54287 49.34158       88.35070 
1 1 1 13  14 6  o 551.4814 23.76453 59.39523       5.089653      56.74154       6.412264      63.91405       8.367550  537.1055 30.87124 568.3012 38.13435 -31.19574      49.06385 
1 1 1 13  14 7  o 660.1861 20.62073 84.99418       5.286867      76.15987       6.539273      101.6659       8.983256  623.9865 26.98524 719.8452 32.13414 -95.85864      41.96196 
1 1 1 13  14 8  o 498.2565 30.75905 48.84221       5.922770      48.84221       5.922770      0.000000       0.000000  498.2565 30.75905 ?        ?        0.000000       30.75905 
1 1 1 13  14 9  o 149.4517 60.33598 2.190528       5.407390      4.305375       11.59640      1.602920       6.112621  212.4946 87.38671 152.7747 63.19830 59.71982       107.8446 
1 1 1 13  14 10 o 251.8747 53.74274 13.13594       5.096732      20.68755       11.69733      11.36630       5.662510  309.5330 91.15942 233.2451 61.59875 76.28787       110.0202 
1 1 1 13  14 11 o 230.4376 54.93333 11.05158       4.846611      8.478958       11.27847      11.63424       5.367464  231.2761 89.03298 235.9467 58.79099 -4.670624      106.6923 
1 1 1 13  14 12 f 233.2266 48.99897 11.23484       4.296968      19.93311       10.92309      9.642330       4.673796  302.9821 87.76743 215.0733 55.56268 87.90880       103.8765 
1 1 1 13  14 13 o 304.1140 35.48885 18.47562       4.112543      23.21766       10.88229      17.68554       4.441950  325.3824 85.13661 296.4469 39.57120 28.93549       93.88356 
1 1 1 13  14 14 o 977.0775 16.95242 186.1087       6.432630      173.6817       15.14426      188.8443       7.105464  934.6476 41.72268 983.8391 18.59690 -49.19147      45.67961 
1 1 1 13  14 15 f 181.6168 53.40509 6.814295       4.017395      8.923042       10.92265      6.484396       4.320228  228.1514 87.67120 178.6820 55.98415 49.46941       104.0215 
1 1 1 13  14 16 o 246.0265 46.98830 12.54615       4.325790      0.000000       0.000000      12.54615       4.325790  ?        ?        246.0265 46.98830 0.000000       46.98830 
1 1 1 13  14 17 o 521.6114 24.78532 53.42125       5.020761      0.000000       0.000000      53.42125       5.020761  ?        ?        521.6114 24.78532 0.000000       24.78532 
1 1 1 13  14 18 o 103.7130 45.81052 -0.8535839     3.621390      -2.006355      6.852213      -0.4068137     4.265810  138.1034 61.87806 115.8873 50.49474 22.21616       79.86623 
1 1 1 13  14 19 o 164.8212 57.68422 5.249135       4.554618      10.24705       6.757691      1.088953       6.165385  217.6985 70.23090 146.3831 62.19032 71.31538       93.80840 
1 1 1 13  14 20 o 515.6533 25.67620 52.49239       5.141816      48.39243       7.579672      55.98755       6.998323  487.7989 40.37414 528.1469 34.30607 -40.34805      52.98092 
1 1 1 13  14 21 o 333.9728 36.96916 22.71208       4.714466      19.14678       6.813778      25.98640       6.529809  294.7185 61.51971 351.6147 49.16419 -56.89618      78.75146 
1 1 1 13  15 0  o 504.0317 29.14097 49.99133       5.679799      52.20301       6.755850      44.65937       10.48968  513.8755 34.04562 466.6708 59.21164 47.20465       68.30170 
1 1 1 13  15 1  o 570.3137 25.46848 63.63472       5.640852      69.28941       6.833224      51.53772       9.994483  594.3318 29.60525 505.0029 51.68950 89.32886       59.56739 
1 1 1 13  15 2  o 380.4531 34.59278 28.71377       5.055255      28.62048       5.969548      28.95031       9.505093  378.1408 41.32256 371.2964 68.44017 6.844452       79.94755 
1 1 1 13  15 3  f 462.7647 28.58811 42.11890       5.112597      41.54014       6.094598      43.49351       9.392520  458.2365 34.50053 463.2667 53.16949 -5.030121      63.38203 
1 1 1 13  15 4  o 368.6771 37.67995 27.06989       5.319095      30.52269       7.065731      22.55387       8.080694  388.9265 47.78538 327.9096 65.74384 61.01688       81.27542 
1 1 1 13  15 5  f 129.5685 54.51773 0.6116043      4.664648      3.873341       5.999973      -4.372119      7.416548  167.1545 64.77233 136.7961 62.51413 30.35844       90.01929 
1 1 1 13  15 6  o 194.6450 56.67502 7.772949       4.544271      8.602019       5.411692      5.790479       8.368364  205.2159 62.37726 198.2032 76.58154 7.012741       98.77072 
1 1 1 13  15 7  o 336.6948 36.10746 22.56052       4.647614      25.26243       5.487886      15.70772       8.739826  355.4483 40.47774 272.0078 78.42476 83.44055       88.25469 
1 1 1 13  15 8  o 715.1146 20.90300 99.76292       5.805135      103.8152       7.099969      91.59061       10.08280  728.7492 25.08710 680.4570 38.31096 48.29224       45.79402 
1 1 1 13  15 9  o 755.5033 22.84709 111.4647       6.703401      102.7559       14.14384      113.9876       7.612704  715.6010 51.23320 763.4371 25.67661 -47.83612      57.30732 
1 1 1 13  15 10 o 520.4723 24.98494 52.97418       5.050146      58.62762       12.60476      51.89314       5.511878  534.9063 61.81627 513.9907 27.71562 20.91553       67.74516 
1 1 1 13  15 11 o 315.4130 38.24821 19.93043       4.589281      17.48610       11.72610      20.37256       4.987092  285.9519 92.54122 318.1416 41.34145 -32.18976      101.3558 
1 1 1 13  15 12 o 372.8687 30.73840 27.50933       4.411408      13.25861       11.69644      29.87264       4.763174  258.2026 92.24053 388.3974 31.85908 -130.1948      97.58748 
1 1 1 13  15 13 o 307.9791 35.76146 18.99078       4.197628      30.88811       11.34851      17.10507       4.518057  376.0901 80.15069 290.6373 41.18092 85.45276       90.11105 
1 1 1 13  15 14 o 393.9758 27.77394 30.64543       4.222264      30.52205       12.00633      30.66284       4.510368  369.9327 85.31391 393.6197 29.72499 -23.68692      90.34400 
1 1 1 13  15 15 o 423.5529 27.38716 35.41706       4.480756      0.000000       0.000000      35.41706       4.480756  ?        ?        423.5529 27.38716 0.000000       27.38716 
1 1 1 13  15 16 o 338.1675 33.98815 22.89091       4.403187      0.000000       0.000000      22.89091       4.403187  ?        ?        338.1675 33.98815 0.000000       33.98815 
1 1 1 13  15 17 o 175.7501 53.09792 6.435009       3.930049      25.10258       11.46831      3.951088       4.183353  328.3568 88.10313 150.2228 54.95795 178.1340       103.8390 
1 1 1 13  15 18 o 292.7509 37.90239 17.43779       4.207996      1.518440       11.37959      19.95942       4.529025  189.6091 82.54817 313.4640 37.97911 -123.8549      90.86591 
1 1 1 13  15 19 o 501.6857 21.39962 49.43814       4.169325      45.31198       7.221301      51.50138       5.106423  472.2558 39.74353 510.0844 25.86244 -37.82861      47.41745 
1 1 1 13  15 20 o 440.7739 28.39775 38.71259       4.835155      37.31171       7.245160      39.83752       6.492475  424.9240 44.56804 442.7098 38.13482 -17.78589      58.65641 
1 1 1 13  15 21 o 819.2827 28.01503 133.3212       8.913593      133.3212       8.913593      0.000000       0.000000  819.2827 28.01503 ?        ?        0.000000       28.01503 
1 1 1 13  16 0  o 1034.354 21.23577 208.9428       8.530317      224.6283       10.96924      184.9430       13.56846  1070.816 26.37750 967.9232 36.09622 102.8923       44.70694 
1 1 1 13  16 1  o 511.7900 28.63224 51.53221       5.668001      59.57068       6.870181      34.39937       10.02989  549.4182 32.34125 405.7589 65.91224 143.6594       73.41920 
1 1 1 13  16 2  o 538.0762 27.67652 56.88366       5.763814      53.90426       7.026764      63.01102       10.07691  521.9581 34.86563 560.5411 46.71594 -38.58295      58.29229 
1 1 1 13  16 3  o 163.8391 63.30833 3.794254       5.719228      1.622821       7.700879      6.465034       8.540557  167.6390 70.26669 202.9631 77.63464 -35.32414      104.7117 
1 1 1 13  16 4  o 471.4792 32.86018 43.90546       5.979111      38.89206       7.720376      51.41887       9.451277  440.0279 45.85182 505.5620 48.74187 -65.53418      66.91904 
1 1 1 13  16 5  o 318.4511 43.96891 20.47719       5.292672      24.55906       6.612535      13.20034       8.828970  347.3260 50.50281 251.9421 80.17087 95.38393       94.75179 
1 1 1 13  16 6  o 597.9682 24.36255 69.90051       5.657556      76.00032       7.072381      59.06013       9.428226  622.5908 29.25061 543.5129 45.07431 79.07788       53.73353 
1 1 1 13  16 7  o 123.1666 51.73465 0.5897562      4.188813      0.1612938      5.136185      1.440748       7.238474  132.2659 56.49072 162.4350 68.10692 -30.16913      88.48589 
1 1 1 13  16 8  o 354.3633 31.08083 24.84256       4.234088      27.10042       5.346661      21.04514       6.933916  368.6443 37.88524 318.4850 58.20601 50.15939       69.44949 
1 1 1 13  16 9  o 584.9711 22.98294 66.87666       5.221172      83.22720       13.00045      63.73222       5.701160  641.9390 52.61006 570.5880 25.72839 71.35101       58.56422 
1 1 1 13  16 10 o 590.7867 22.35094 68.21641       5.128076      46.41043       12.68355      72.47749       5.606769  468.9752 71.93679 608.7097 23.71780 -139.7344      75.74586 
1 1 1 13  16 11 o 448.5638 27.20141 39.61504       4.716140      30.55167       12.46563      41.12903       5.094839  370.6134 87.93374 456.6921 28.87491 -86.07867      92.55324 
1 1 1 13  16 12 o 858.2535 20.87942 143.9701       6.959241      134.1383       14.58165      146.8701       7.919369  816.9643 46.14834 866.0872 23.54512 -49.12286      51.80774 
1 1 1 13  16 13 o 277.8714 40.58950 15.68865       4.250916      0.000000       0.000000      15.68865       4.250916  ?        ?        277.8714 40.58950 0.000000       40.58950 
1 1 1 13  16 14 o 290.7736 37.40366 17.07395       4.125808      0.000000       0.000000      17.07395       4.125808  ?        ?        290.7736 37.40366 0.000000       37.40366 
1 1 1 13  16 15 o 518.5124 22.17806 52.69490       4.465918      56.16453       13.93250      52.29758       4.714688  509.3993 72.47096 516.2561 23.51580 -6.856842      76.19077 
1 1 1 13  16 16 o 443.4449 24.82030 38.79049       4.257233      32.94546       11.92816      39.64373       4.557381  379.8730 83.16131 447.8769 26.31729 -68.00391      87.22616 
1 1 1 13  16 17 o 354.4037 29.80708 25.05292       4.064377      25.99351       11.96625      24.93025       4.321274  329.5826 90.65564 352.8641 31.87802 -23.28146      96.09711 
1 1 1 13  16 18 o 563.8511 20.51808 62.39924       4.492925      54.51328       12.72639      63.52207       4.802144  498.7220 67.43762 568.5271 21.74984 -69.80511      70.85823 
1 1 1 13  16 19 o 359.2005 29.05405 25.79782       4.018246      32.11917       12.15453      25.02216       4.257645  364.3147 87.08987 352.8773 31.39629 11.43738       92.57630 
1 1 1 13  16 20 o 111.0789 48.98354 -0.6481303     4.123776      -0.7215089     6.273267      -0.5922943     5.472253  135.7511 60.11117 127.8871 56.40962 7.863976       82.43420 
1 1 1 13  17 0  o 274.8007 74.37236 16.29092       8.130567      16.29092       8.130567      0.000000       0.000000  274.8007 74.37236 ?        ?        0.000000       74.37236 
1 1 1 13  17 1  o 703.1828 26.78390 96.91455       7.314254      100.4201       9.737255      92.37542       11.08022  713.3984 35.14604 680.6654 42.12366 32.73303       54.86025 
1 1 1 13  17 2  o 490.8850 51.41396 48.83841       9.655992      0.000000       0.000000      48.83841       9.655992  ?        ?        490.8850 51.41396 0.000000       51.41396 
1 1 1 13  17 3  o 711.3750 24.91059 99.03164       6.881936      95.25388       9.058381      104.1888       10.58373  695.4883 33.53766 725.1152 37.71423 -29.62695      50.46918 
1 1 1 13  17 4  o 340.2222 44.14394 23.37601       5.695123      21.51401       7.726843      25.59068       8.426850  319.6102 64.47620 349.2928 64.49834 -29.68262      91.19877 
1 1 1 13  17 5  o 232.6483 73.05704 11.23745       7.352362      0.000000       0.000000      11.23745       7.352362  ?        ?        232.6483 73.05704 0.000000       73.05704 
1 1 1 13  17 6  o 463.5274 27.32012 42.25591       4.896227      44.59303       6.502951      39.19683       7.439857  474.1725 35.57320 441.9149 43.93325 32.25754       56.52948 
1 1 1 13  17 7  o 497.4735 24.10490 48.41793       4.656969      48.28698       6.095520      48.60155       7.217670  494.4212 31.91619 494.3346 37.88487 0.8660889E-01  49.53692 
1 1 1 13  17 8  o 142.5240 52.22469 3.378496       3.779750      -0.9048162     4.719040      11.04415       6.313037  119.9497 52.66344 228.8815 66.84533 -108.9319      85.09839 
1 1 1 13  17 9  o 406.2747 31.57908 32.69502       4.943349      11.74290       12.02524      36.95566       5.422724  249.2502 92.82145 431.8173 32.57607 -182.5672      98.37186 
1 1 1 13  17 10 o 357.8522 32.72296 25.46985       4.497283      28.09540       12.06418      25.04611       4.846630  353.6706 88.14932 354.0341 35.73984 -0.3634338     95.11908 
1 1 1 13  17 11 o 670.0945 19.82683 87.74464       5.159616      0.000000       0.000000      87.74464       5.159616  ?        ?        670.0945 19.82683 0.000000       19.82683 
1 1 1 13  17 12 o 179.3338 49.41818 6.715664       3.552048      0.000000       0.000000      6.715664       3.552048  ?        ?        179.3338 49.41818 0.000000       49.41818 
1 1 1 13  17 13 o 574.3332 20.82659 64.56519       4.645261      0.000000       0.000000      64.56519       4.645261  ?        ?        574.3332 20.82659 0.000000       20.82659 
1 1 1 13  17 14 o 98.36049 43.56107 -0.8917105     3.295648      -18.83236      11.66212      0.6653690      3.435688  136.3057 66.60978 112.2897 46.99121 24.01603       81.51709 
1 1 1 13  17 15 o 269.9507 33.53841 14.69990       3.440278      6.570418       11.44428      15.50752       3.607119  212.8928 87.09465 277.1595 34.24019 -64.26671      93.58348 
1 1 1 13  17 16 o 362.2242 26.56131 26.03682       3.710361      25.92606       11.42431      26.04988       3.923027  330.2137 87.63234 361.8427 28.13860 -31.62906      92.03916 
1 1 1 13  17 17 o 288.2489 34.01648 16.82934       3.734530      15.75811       11.61703      16.95281       3.943872  259.3165 92.00245 288.6300 35.96488 -29.31351      98.78220 
1 1 1 13  17 18 o 325.5946 30.13472 21.28177       3.767204      31.22175       11.87923      20.17035       3.972236  359.0847 86.26363 315.9357 32.85548 43.14893       92.30870 
1 1 1 13  17 19 o 380.7648 25.60816 28.82977       3.764705      53.24223       12.13716      26.23098       3.960021  490.3882 65.35802 362.1407 28.38464 128.2474       71.25559 
1 1 1 13  18 0  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 13  18 1  o 344.4615 47.39692 24.17926       6.172484      24.63908       8.116436      23.54858       9.505674  341.8167 63.47956 329.0846 75.92406 12.73212       98.96524 
1 1 1 13  18 2  o 625.5165 24.92406 76.64369       6.054600      82.47971       7.582087      66.37295       10.05845  647.5892 30.14819 574.6795 45.43957 72.90967       54.53135 
1 1 1 13  18 3  o 602.8869 25.90282 71.24312       6.064723      74.49183       8.760081      68.25273       8.404586  612.4620 37.00370 586.1226 37.11485 26.33936       52.40979 
1 1 1 13  18 4  o 365.1455 38.20594 26.69153       5.337603      40.13031       7.983115      15.82691       7.177941  445.5362 46.83960 271.6305 68.15623 173.9057       82.69958 
1 1 1 13  18 5  o 630.7198 23.76246 77.87022       5.820441      73.72488       8.253555      81.97124       8.209317  609.9002 34.99250 643.9370 32.93756 -34.03680      48.05579 
1 1 1 13  18 6  o 378.6719 32.87698 28.48934       4.786866      33.22857       6.538836      23.01642       7.026771  406.4105 42.03688 332.5892 56.41891 73.82123       70.35761 
1 1 1 13  18 7  o 544.9837 23.43619 58.15592       4.960193      60.04320       6.801264      56.01154       7.249740  550.9202 31.92558 530.9233 35.36343 19.99689       47.64257 
1 1 1 13  18 8  f 464.4282 23.45525 42.35511       4.216761      39.37614       5.503922      46.58856       6.561247  445.5925 32.01929 483.8752 35.15622 -38.28268      47.55202 
1 1 1 13  18 9  o 518.8735 19.71305 52.61810       3.972313      69.96240       6.248408      40.85365       5.146084  596.6334 26.96707 454.5284 29.30954 142.1051       39.82803 
1 1 1 13  18 10 o 786.8939 18.62106 120.9703       5.690475      0.000000       0.000000      120.9703       5.690475  ?        ?        786.8939 18.62106 0.000000       18.62106 
1 1 1 13  18 11 o 219.5898 40.78767 9.935786       3.350269      0.000000       0.000000      9.935786       3.350269  ?        ?        219.5898 40.78767 0.000000       40.78767 
1 1 1 13  18 12 o 211.3911 35.62285 9.119840       2.820471      -6.703812      11.29052      10.17303       2.912821  162.1495 75.18462 223.8062 34.63144 -61.65678      82.77719 
1 1 1 13  18 13 o 190.0277 75.41461 5.483900       8.300319      5.518918       11.29270      5.442750       12.24147  207.5010 85.87327 212.2253 88.74689 -4.724319      123.4918 
1 1 1 13  18 14 o 563.4362 42.76604 64.54855       9.287943      52.86116       12.97402      76.83508       13.30241  491.6824 69.91501 604.5429 57.34598 -112.8605      90.42494 
1 1 1 13  18 15 o 272.3521 75.80508 17.03576       8.312300      -0.1420828     11.40945      36.46714       12.13479  181.9984 80.80459 397.0081 81.43735 -215.0097      114.7232 
1 1 1 13  18 16 o 160.2142 50.19191 5.346637       3.472629      -1.198222      11.29110      6.030390       3.649520  176.0090 79.10501 168.9185 51.19777 7.090408       94.22746 
1 1 1 13  18 17 o 283.5914 31.16567 16.23660       3.375784      29.51462       11.39090      14.95813       3.534567  349.0191 84.86095 270.9612 34.36147 78.05783       91.55376 
1 1 1 13  18 18 o 200.1086 42.44439 8.480228       3.196251      7.121089       11.65882      8.590679       3.323586  209.0120 86.93800 200.9751 43.81861 8.036926       97.35648 
1 1 1 13  19 0  o 532.5116 35.16123 56.43782       7.230525      56.43782       7.230525      0.000000       0.000000  532.5116 35.16123 ?        ?        0.000000       35.16123 
1 1 1 13  19 1  o 262.2537 55.13538 14.49324       5.437187      8.651309       6.705542      25.70692       9.290296  207.0303 70.08305 344.1396 71.83391 -137.1092      100.3581 
1 1 1 13  19 2  o 278.2272 51.15616 16.11049       5.323774      17.76840       6.596130      13.01222       9.017126  289.1181 60.68103 246.9806 81.22097 42.13756       101.3856 
1 1 1 13  19 3  o 319.1009 46.31575 20.84822       5.571964      28.44576       8.294252      14.59940       7.522107  367.9737 60.11698 258.9649 72.12373 109.0089       93.89294 
1 1 1 13  19 4  f 177.3322 61.08601 6.071427       5.097932      8.271519       7.549067      4.226946       6.912098  207.2919 74.09858 174.7449 68.98714 32.54700       101.2414 
1 1 1 13  19 5  o 516.2219 27.39608 52.54803       5.472620      51.68338       7.910860      53.34161       7.578729  507.4007 40.48321 516.4962 38.05138 -9.095551      55.55896 
1 1 1 13  19 6  o 284.8294 43.98132 16.62270       4.708292      15.38335       6.624919      17.88751       6.692659  266.9583 64.59963 289.3521 61.45615 -22.39374      89.16261 
1 1 1 13  19 7  o 338.0023 35.36465 22.91183       4.573396      23.43030       6.603093      22.43378       6.340418  335.7968 52.34026 328.8416 51.32456 6.955109       73.30562 
1 1 1 13  19 8  o 462.8824 24.92744 42.20509       4.464499      38.28212       6.331865      46.08349       6.295798  436.7592 37.69977 480.8961 33.92864 -44.13687      50.71908 
1 1 1 13  19 9  f 151.6085 45.99823 4.697061       2.944786      5.730948       4.340467      3.815301       4.008435  169.4846 56.38081 147.7074 53.83327 21.77716       77.95394 
1 1 1 13  19 10 o 208.0081 41.97104 8.987892       3.273535      -0.2036452     13.14530      9.595588       3.380018  196.1632 86.93089 215.0876 41.97139 -18.92439      96.53278 
1 1 1 13  19 11 f 577.5896 42.86806 67.66602       9.547112      55.60197       12.81486      82.71400       14.31220  508.3890 66.50076 627.0209 59.48760 -118.6319      89.22514 
1 1 1 13  19 12 o 529.9280 46.18905 57.55836       9.410654      35.00468       12.27761      89.68099       14.65247  389.2269 83.70979 652.5355 58.43903 -263.3085      102.0904 
1 1 1 13  19 13 o 692.8833 36.76188 96.56241       9.856648      89.62048       13.42692      104.6755       14.51544  655.2009 53.22856 708.4267 53.14765 -53.22577      75.21936 
1 1 1 13  19 14 o 335.4603 67.69208 25.12786       8.514666      33.16667       12.32581      17.79010       11.77610  372.0117 86.88802 271.4002 92.86967 100.6115       127.1782 
1 1 1 13  19 15 o 429.9462 53.01672 39.21627       8.664760      50.11983       12.23060      28.22951       12.27717  474.3109 68.37339 336.2156 91.55637 138.0953       114.2694 
1 1 1 13  19 16 o 172.1178 72.49127 3.179446       8.260313      -23.36413      11.50974      31.37225       11.86191  124.1473 61.68412 357.5392 86.39223 -233.3919      106.1534 
1 1 1 13  19 17 o 246.6121 74.60019 14.34769       7.753963      8.062082       11.29207      19.95584       10.66620  211.1350 86.46040 281.7567 87.91536 -70.62167      123.3066 
1 1 1 13  20 0  o 790.1099 26.70865 122.9681       8.195349      122.9681       8.195349      0.000000       0.000000  790.1099 26.70865 ?        ?        0.000000       26.70865 
1 1 1 13  20 1  o 520.8897 28.47874 53.68683       5.739132      50.99345       7.108387      58.72980       9.726698  504.5905 36.52163 536.4178 47.17063 -31.82727      59.65649 
1 1 1 13  20 2  o 235.7222 56.45592 11.88684       5.100003      9.197152       6.383453      16.63353       8.480087  209.2928 68.31431 272.5780 76.81441 -63.28526      102.7974 
1 1 1 13  20 3  o 281.9849 51.20631 16.66515       5.401065      20.85692       8.037073      13.21315       7.293473  308.4749 68.83563 245.1819 71.91826 63.29297       99.55190 
1 1 1 13  20 4  o 603.0386 25.50797 71.52721       5.973775      73.43640       9.139553      70.10323       7.893209  604.6890 39.12901 592.9797 34.42379 11.70929       52.11599 
1 1 1 13  20 5  o 336.2005 42.71856 23.07391       5.451623      27.42704       9.258112      20.76331       6.745025  354.0820 69.80849 312.6038 57.68504 41.47827       90.55821 
1 1 1 13  20 6  o 438.7594 32.93437 38.41696       5.570876      36.35772       8.828348      39.77945       7.181135  416.4613 56.00514 442.7312 42.28019 -26.26990      70.17257 
1 1 1 13  20 7  o 589.3423 23.36896 68.22287       5.348537      56.57658       7.848685      78.32028       7.308157  530.3196 38.36841 629.1588 29.91022 -98.83911      48.64932 
1 1 1 13  20 8  o 789.7982 17.03727 121.8921       5.225697      121.8828       7.396277      121.9015       7.384241  787.2512 24.19201 787.3286 24.15026 -0.7739258E-01 34.18316 
1 1 1 13  20 9  o 168.9565 44.11483 5.997341       2.925849      6.064219       3.728461      5.890145       4.720381  170.4357 51.76885 171.9595 58.79810 -1.523849      78.34048 
1 1 1 13  20 10 o 648.8946 20.77660 82.60042       5.235723      61.55518       13.60522      86.25894       5.672588  532.2474 67.32662 662.6869 22.04169 -130.4395      70.84286 
1 1 1 13  20 11 o 234.4861 79.34308 12.26456       8.594570      17.50191       11.42105      5.426312       13.05037  271.3192 91.46564 212.7762 90.44064 58.54301       128.6292 
1 1 1 13  20 12 o 300.7637 74.62908 20.85810       8.675399      16.41295       11.31679      27.19349       13.51034  262.6885 90.98366 326.9340 98.37624 -64.24551      133.9997 
1 1 1 13  20 13 o 200.7834 76.89928 7.814009       8.386207      -2.779669      11.14642      21.63293       12.73061  168.8450 76.95706 291.6016 96.53654 -122.7566      123.4572 
1 1 1 13  20 14 f 274.3698 75.11099 17.74939       8.237230      12.71637       11.54927      22.96045       11.75177  237.1918 90.38596 300.4661 92.03989 -63.27428      128.9999 
1 1 1 13  20 15 o 345.6514 63.93149 26.78198       8.265760      26.54949       11.19212      27.06096       12.25980  325.9174 86.85399 323.7910 92.74821 2.126434       127.0663 
1 1 1 13  20 16 o 201.0366 75.61143 8.455561       8.018150      13.66621       10.74848      1.917651       12.03983  239.1131 87.99973 187.8518 83.22406 51.26131       121.1206 
1 1 1 13  21 0  o 585.4150 32.70507 68.46091       7.405715      68.46091       7.405715      0.000000       0.000000  585.4150 32.70507 ?        ?        0.000000       32.70507 
1 1 1 13  21 1  o 245.4062 56.19809 13.00482       5.240635      13.02476       6.465117      12.96659       8.949207  242.2709 66.63350 241.0125 80.96637 1.258392       104.8598 
1 1 1 13  21 2  o 395.3002 43.08230 31.98699       6.506749      36.07354       10.11874      29.10586       8.496305  406.7974 66.33665 367.3122 61.75279 39.48517       90.63089 
1 1 1 13  21 3  o 455.1666 34.61927 41.57835       6.073631      43.34515       9.858054      40.49736       7.710968  452.5427 57.38144 444.1111 45.34446 8.431610       73.13515 
1 1 1 13  21 4  o 142.4818 59.55185 1.547466       5.508160      -3.460767      9.279783      4.271807       6.844257  154.2950 70.28385 171.7449 68.37935 -17.44998      98.05894 
1 1 1 13  21 5  o 400.8562 36.09827 32.40071       5.559289      31.72411       9.119334      32.80086       7.013133  382.5421 63.61842 398.7985 46.13424 -16.25638      78.58543 
1 1 1 13  21 6  o 250.3599 49.00423 13.25475       4.594030      5.104508       6.620114      20.82542       6.380394  175.6804 68.04821 312.7965 54.50512 -137.1161      87.18582 
1 1 1 13  21 7  o 608.4456 20.41732 72.62932       4.824458      73.12347       6.842741      72.14088       6.803060  607.3513 29.01096 603.2449 29.03907 4.106445       41.04757 
1 1 1 13  21 8  o 175.1320 48.47825 6.515609       3.409353      11.76376       4.692970      0.6501034      4.961321  233.7705 52.92436 130.3776 55.59835 103.3929       76.76043 
1 1 1 13  21 9  o 544.3546 17.79379 58.02580       3.761649      57.14148       5.088740      59.09117       5.585434  538.2254 24.34547 546.6149 26.31161 -8.389526      35.84694 
1 1 1 13  21 10 o 227.5246 79.74429 11.56489       8.705860      23.41967       12.05866      -1.340950      12.58189  305.6281 93.16058 183.4049 82.86491 122.2232       124.6815 
1 1 1 13  21 11 o 171.2614 73.12069 2.464389       8.600005      7.412601       11.39190      -4.092429      13.11349  210.2925 86.56233 177.2982 81.79113 32.99425       119.0917 
1 1 1 13  21 12 o 381.7086 64.00052 32.44543       9.151484      10.86370       11.98584      62.61463       14.17123  227.6600 90.53711 525.0044 71.35368 -297.3444      115.2749 
1 1 1 13  21 13 o 227.7057 81.10403 12.03088       9.036232      2.942252       12.04391      23.73577       13.66792  191.9819 84.21470 296.3854 100.0583 -104.4035      130.7814 
1 1 1 13  21 14 o 278.4806 75.87752 18.67261       8.429505      3.346102       11.34838      37.53743       12.59037  189.0713 82.37164 389.0653 85.64734 -199.9940      118.8299 
1 1 1 13  22 0  o 418.1695 48.65564 36.63660       7.753850      36.63660       7.753850      0.000000       0.000000  418.1695 48.65564 ?        ?        0.000000       48.65564 
1 1 1 13  22 1  f 214.2561 63.96105 10.19493       5.727809      10.14651       7.169010      10.28039       9.524543  214.5246 72.46532 220.5233 82.51255 -5.998627      109.8159 
1 1 1 13  22 2  o 178.1962 65.34354 6.140985       5.918744      6.141544       9.239003      6.140595       7.708171  195.2094 78.84664 187.3078 73.18281 7.901611       107.5756 
1 1 1 13  22 3  o 338.5883 45.16984 23.85547       5.791348      18.55712       9.071378      27.50069       7.524278  280.1860 79.61885 357.9371 55.96146 -77.75110      97.31828 
1 1 1 13  22 4  o 166.4554 59.58042 5.385172       4.882226      0.7500390      6.840798      10.19710       6.970038  149.2912 64.49677 214.8833 71.44469 -65.59213      96.25060 
1 1 1 13  22 5  o 257.0867 49.64362 14.09917       4.776984      8.921096       6.779004      19.20658       6.732585  203.8887 70.42952 295.3495 60.72562 -91.46086      92.99418 
1 1 1 13  22 6  o 214.9128 49.92887 9.947950       4.087627      15.38335       5.554426      3.526488       6.037266  265.8781 55.58246 158.9950 63.90614 106.8830       84.69595 
1 1 1 13  22 7  o 138.6529 52.18682 3.252385       3.820992      4.970854       5.175074      1.192720       5.665576  163.9238 60.92226 140.2907 59.60944 23.63309       85.23384 
1 1 1 13  22 8  o 299.5319 30.33261 18.07511       3.479775      11.64649       4.800721      25.19181       5.051110  230.5942 54.47479 350.9523 37.64851 -120.3581      66.21867 
1 1 1 13  22 9  o 218.4210 32.96775 9.772576       2.709434      9.756053       4.005403      9.786516       3.678830  212.2339 49.50430 213.9868 45.65983 -1.752960      67.34608 
1 1 1 13  22 10 o 487.1771 49.94049 50.26708       9.315071      28.56004       12.07314      82.19671       14.64255  333.9004 90.73683 610.1949 62.68100 -276.2945      110.2818 
1 1 1 13  22 11 o 553.5787 46.44960 64.26705       9.893636      57.13847       13.24767      73.25705       14.87707  499.2510 70.27177 567.4122 68.92904 -68.16122      98.43442 
1 1 1 13  22 12 o 260.5260 79.97343 16.76220       8.867100      30.65460       12.06886      0.4670622      13.07094  344.9931 89.36346 186.8325 84.43254 158.1606       122.9418 
1 1 1 13  22 13 o 653.8117 41.48468 88.48988       10.47884      77.98744       14.07448      101.5525       15.69648  591.5303 62.19876 678.1156 60.23030 -86.58527      86.58161 
1 1 1 13  23 0  o 220.1712 72.43493 11.23483       7.171517      11.23483       7.171517      0.000000       0.000000  220.1712 72.43493 ?        ?        0.000000       72.43493 
1 1 1 13  23 1  o 217.5629 68.11642 10.85384       6.396894      10.85384       6.396894      0.000000       0.000000  217.5629 68.11642 ?        ?        0.000000       68.11642 
1 1 1 13  23 2  o 304.6780 47.99400 19.75815       5.490892      19.97689       7.579613      19.51658       7.965326  294.4534 67.69838 288.4377 71.47314 6.015778       98.44532 
1 1 1 13  23 3  o 410.3297 34.26293 34.17290       5.409961      41.95016       7.502279      25.74760       7.808591  449.1679 43.55612 340.0011 61.39707 109.1668       75.27773 
1 1 1 13  23 4  o 215.9789 56.44791 10.37348       4.787402      2.043808       6.589207      19.68685       6.967433  152.5146 64.51691 295.5099 62.65572 -142.9954      89.93426 
1 1 1 13  23 5  o 320.0978 38.22773 21.12131       4.658130      17.46113       6.086400      26.29651       7.237246  280.5915 57.77897 347.4184 55.50903 -66.82690      80.12279 
1 1 1 13  23 6  o 184.0256 53.19702 7.421811       4.016615      9.020737       5.380839      5.409697       6.036181  200.5353 62.42205 170.7006 65.27341 29.83476       90.31683 
1 1 1 13  23 7  f 173.0824 48.26081 6.494672       3.365954      6.170931       4.279649      7.019722       5.450169  169.9793 55.95762 181.3670 63.12199 -11.38770      84.35426 
1 1 1 13  23 8  f 195.2788 41.94958 8.134060       3.086474      5.417983       4.347634      10.89380       4.382442  162.1130 56.37951 222.4900 51.70406 -60.37703      76.49809 
1 1 1 13  23 9  o 497.2741 17.68989 48.57315       3.416244      39.59029       4.756573      58.14354       4.909661  444.4800 27.69347 541.7691 23.33508 -97.28909      36.21400 
1 1 1 13  23 10 o 182.0675 75.10003 5.347177       8.596775      6.397984       11.31649      3.913246       13.21948  199.1474 84.41361 197.2836 87.31387 1.863770       121.4470 
1 1 1 13  23 11 o 121.7366 59.02227 -11.03971      8.669747      -5.390729      11.48093      -18.53527      13.22496  158.4113 74.22952 141.8832 69.66451 16.52814       101.7996 
1 1 1 13  24 0  o 140.1496 58.04772 2.321959       5.166107      4.773024       6.188257      -3.314470      9.384109  164.4368 65.16154 148.7678 68.82577 15.66905       94.77876 
1 1 1 13  24 1  o 151.8418 63.01587 2.933273       6.105685      2.933273       6.105685      0.000000       0.000000  151.8418 63.01587 ?        ?        0.000000       63.01587 
1 1 1 13  24 2  o 495.1097 29.43635 49.41092       5.634465      52.84914       7.792471      45.64381       8.156672  504.3550 40.11575 463.9214 45.87422 40.43369       60.94028 
1 1 1 13  24 3  o 300.1519 46.06083 19.29346       5.197614      16.04655       6.894614      23.56800       7.910790  259.8435 67.65843 317.7518 66.25289 -57.90833      94.69482 
1 1 1 13  24 4  o 125.7373 53.47372 1.022583       4.566735      -0.4014474     6.138937      2.787030       6.833415  133.4179 59.25210 156.4132 65.90824 -22.99527      88.62679 
1 1 1 13  24 5  o 197.1754 53.71273 8.715883       4.224597      5.991033       5.520265      12.56751       6.563124  170.9047 63.03908 229.5377 68.45339 -58.63301      93.05801 
1 1 1 13  24 6  o 105.6305 46.59470 -0.4552914     3.734080      0.5991384      4.916878      -1.892136      5.739652  126.5846 54.68360 122.0152 55.46192 4.569473       77.88659 
1 1 1 13  24 7  o 119.5499 46.39714 2.208387       3.082283      2.401515       3.963864      1.913010       4.902122  130.0305 51.95224 135.0429 56.28902 -5.012329      76.59953 
1 1 1 13  24 8  o 253.0060 32.33244 13.14478       3.104202      12.53880       4.226946      13.85419       4.573518  240.1556 47.00447 251.9197 48.50776 -11.76402      67.54571 
1 1 1 13  24 9  o 371.4997 20.31741 27.33402       2.920155      19.99397       4.189281      34.27102       4.072635  311.2827 35.27712 413.8674 25.46235 -102.5848      43.50640 
1 1 1 13  25 0  f 163.5626 61.06125 5.602680       5.210190      3.469016       6.060121      11.64932       10.20176  152.2474 62.94885 213.9343 84.01671 -61.68694      104.9827 
1 1 1 13  25 1  o 184.7357 64.66706 7.872993       5.724197      7.872993       5.724197      0.000000       0.000000  184.7357 64.66706 ?        ?        0.000000       64.66706 
1 1 1 13  25 2  o 234.8193 58.12960 12.83576       5.272711      8.122734       7.188727      18.32358       7.757151  189.3297 71.50951 270.0009 72.46487 -80.67117      101.8075 
1 1 1 13  25 3  o 270.4596 49.78128 16.18863       5.036067      12.34040       6.808927      20.83629       7.482825  223.3425 70.33301 293.9516 67.03455 -70.60902      97.16153 
1 1 1 13  25 4  o 304.8337 62.71201 21.79332       7.176349      0.000000       0.000000      21.79332       7.176349  ?        ?        304.8337 62.71201 0.000000       62.71201 
1 1 1 13  25 5  f 265.4122 42.94270 15.11403       4.275091      15.69887       5.827815      14.43266       6.290439  260.2853 59.01406 245.1620 65.00982 15.12332       87.80054 
1 1 1 13  25 6  o 210.7638 46.43662 9.771385       3.698316      5.267723       4.959718      15.41167       5.550404  160.7277 59.65963 259.5864 56.64878 -98.85870      82.27002 
1 1 1 13  26 0  o 154.8168 58.87460 4.948043       4.893841      3.988727       5.688117      7.681574       9.601734  151.4251 61.61220 187.6239 78.54052 -36.19888      99.82323 
1 1 1 13  26 1  o 330.8494 46.56596 24.06155       5.817546      24.06155       5.817546      0.000000       0.000000  330.8494 46.56596 ?        ?        0.000000       46.56596 
1 1 1 13  26 2  f 188.3092 66.76263 8.488106       6.116310      16.09898       6.872692      -20.49179      13.41090  253.0821 68.32887 134.6641 66.85386 118.4180       95.59431 
1 1 1 14  0  0  o 350.0077 43.47345 25.03939       5.663667      25.03939       5.663667      25.03939       5.663667  350.0077 43.47345 350.0077 43.47345 0.000000       0.000000 
1 1 1 14  0  1  o 488.9348 31.63751 47.18689       5.949637      47.18689       5.949637      47.18689       5.949637  488.9348 31.63751 488.9348 31.63751 0.000000       0.000000 
1 1 1 14  0  2  o 614.9122 27.58653 74.08583       6.557582      74.08583       6.557582      74.08583       6.557582  614.9122 27.58653 614.9122 27.58653 0.000000       0.000000 
1 1 1 14  0  3  o 154.6824 72.74510 6.923269       4.915206      6.923269       4.915206      6.923269       4.915206  154.6824 72.74510 154.6824 72.74510 0.000000       0.000000 
1 1 1 14  0  4  o 929.0279 26.18419 168.4291       9.430071      168.4291       9.430071      168.4291       9.430071  929.0279 26.18419 929.0279 26.18419 0.000000       0.000000 
1 1 1 14  0  5  o 960.2045 25.75007 179.8592       9.586576      179.8592       9.586576      179.8592       9.586576  960.2045 25.75007 960.2045 25.75007 0.000000       0.000000 
1 1 1 14  0  6  o 1476.505 24.37376 424.6022       13.96749      424.6022       13.96749      424.6022       13.96749  1476.505 24.37376 1476.505 24.37376 0.000000       0.000000 
1 1 1 14  0  7  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 14  0  8  o 475.0298 37.31503 44.85398       6.786164      44.85398       6.786164      44.85398       6.786164  475.0298 37.31503 475.0298 37.31503 0.000000       0.000000 
1 1 1 14  0  9  o 1361.192 24.80724 361.0558       13.10389      361.0558       13.10389      361.0558       13.10389  1361.192 24.80724 1361.192 24.80724 0.000000       0.000000 
1 1 1 14  0  10 o 230.1339 92.32166 14.63101       8.019178      14.63101       8.019178      14.63101       8.019178  230.1339 92.32166 230.1339 92.32166 0.000000       0.000000 
1 1 1 14  0  11 o 287.9166 82.17041 19.97171       7.962640      19.97171       7.962640      19.97171       7.962640  287.9166 82.17041 287.9166 82.17041 0.000000       0.000000 
1 1 1 14  0  12 o 123.6791 78.38000 1.427021       8.133174      1.427021       8.133174      1.427021       8.133174  123.6791 78.38000 123.6791 78.38000 0.000000       0.000000 
1 1 1 14  0  13 o 69.81001 50.57172 -14.44866      7.355954      -14.44866      7.355954      -14.44866      7.355954  69.81001 50.57172 69.81001 50.57172 0.000000       0.000000 
1 1 1 14  0  14 o 573.7178 58.12687 67.13695       12.64623      67.13695       12.64623      67.13695       12.64623  573.7178 58.12687 573.7178 58.12687 0.000000       0.000000 
1 1 1 14  0  15 o 586.0676 36.93640 68.08791       8.330245      68.08791       8.330245      68.08791       8.330245  586.0676 36.93640 586.0676 36.93640 0.000000       0.000000 
1 1 1 14  0  16 o 1464.363 25.90974 418.8860       14.72425      418.8860       14.72425      418.8860       14.72425  1464.363 25.90974 1464.363 25.90974 0.000000       0.000000 
1 1 1 14  0  17 o 117.0861 73.41811 1.899635       6.927255      1.899635       6.927255      1.899635       6.927255  117.0861 73.41811 117.0861 73.41811 0.000000       0.000000 
1 1 1 14  0  18 o 699.5991 32.08718 96.66909       8.676073      96.66909       8.676073      96.66909       8.676073  699.5991 32.08718 699.5991 32.08718 0.000000       0.000000 
1 1 1 14  0  19 o 350.8497 57.10860 26.56372       7.162519      26.56372       7.162519      26.56372       7.162519  350.8497 57.10860 350.8497 57.10860 0.000000       0.000000 
1 1 1 14  0  20 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 14  0  21 o 269.9059 75.13370 18.14248       6.813016      18.14248       6.813016      18.14248       6.813016  269.9059 75.13370 269.9059 75.13370 0.000000       0.000000 
1 1 1 14  0  22 o 148.2805 81.14753 7.209359       6.681912      7.209359       6.681912      7.209359       6.681912  148.2805 81.14753 148.2805 81.14753 0.000000       0.000000 
1 1 1 14  0  23 o 301.7476 63.39354 21.32611       6.541465      21.32611       6.541465      21.32611       6.541465  301.7476 63.39354 301.7476 63.39354 0.000000       0.000000 
1 1 1 14  0  24 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 14  1  0  o 835.6920 16.98765 136.0420       5.513249      142.4857       7.861007      129.8043       7.734358  853.9705 23.70322 814.9243 24.43876 39.04620       34.04549 
1 1 1 14  1  1  o 828.9006 16.87655 133.8098       5.432679      127.2713       7.531001      140.9041       7.844523  807.1719 24.02474 849.3539 23.78208 -42.18195      33.80497 
1 1 1 14  1  2  o 1129.692 15.89376 248.4196       6.972920      243.6336       9.728788      253.4753       9.999165  1117.400 22.41930 1139.703 22.59145 -22.30261      31.82764 
1 1 1 14  1  3  o 1192.199 16.13268 276.6458       7.469362      276.2046       10.54950      277.0895       10.57710  1189.839 22.83052 1191.737 22.85378 -1.898682      32.30368 
1 1 1 14  1  4  o 1003.576 19.82563 196.2212       7.726896      206.7608       10.22104      182.1640       11.80408  1029.039 25.57615 964.5129 31.51347 64.52606       40.58619 
1 1 1 14  1  5  o 300.8680 40.33222 18.10929       4.593929      17.18686       6.458015      19.05423       6.536284  288.4584 59.61922 304.6379 57.35276 -16.17950      82.72720 
1 1 1 14  1  6  o 701.7807 28.60890 96.22604       7.797055      96.22604       7.797055      0.000000       0.000000  701.7807 28.60890 ?        ?        0.000000       28.60890 
1 1 1 14  1  7  o 1142.598 17.35456 254.0639       7.700788      253.3956       10.82912      254.7476       10.95306  1139.855 24.46332 1142.848 24.67851 -2.992554      34.74885 
1 1 1 14  1  8  o 765.8090 19.34798 114.1866       5.754189      114.5915       8.098699      113.7738       8.177174  766.1519 27.21901 763.3583 27.58334 2.793518       38.75197 
1 1 1 14  1  9  o 801.7365 19.19004 125.1513       5.974967      126.7240       8.505579      123.6191       8.395261  805.6642 27.18453 795.7356 27.16673 9.928650       38.43215 
1 1 1 14  1  10 o 1110.555 39.07899 242.2931       16.85433      242.2931       16.85433      0.000000       0.000000  1110.555 39.07899 ?        ?        0.000000       39.07899 
1 1 1 14  1  11 o 390.4427 38.26305 30.22474       5.727268      31.04320       8.062104      29.39088       8.137585  391.7342 54.46815 380.3119 56.84082 11.42233       78.72521 
1 1 1 14  1  12 o 117.6201 55.42921 -6.954939      6.561886      -8.885571      8.022491      -3.052495      11.40585  128.4600 60.76637 181.5345 80.68602 -53.07443      101.0088 
1 1 1 14  1  13 o 176.2992 62.75803 5.461027       5.409804      7.020114       7.643311      3.895963       7.657946  203.0876 74.28814 182.1082 72.38519 20.97940       103.7224 
1 1 1 14  1  14 o 384.8225 38.52492 29.39793       5.680110      26.57428       8.029449      32.22643       8.036330  360.2240 59.47204 399.3648 53.13426 -39.14084      79.75069 
1 1 1 14  1  15 o 745.6135 25.81990 108.5837       7.476464      114.4170       13.48650      105.9957       8.983191  759.2864 45.95322 735.6389 31.44401 23.64752       55.68145 
1 1 1 14  1  16 o 1139.896 18.69888 253.1338       8.277681      258.2727       11.88901      248.2989       11.53197  1149.478 26.63283 1127.144 26.34487 22.33337       37.46144 
1 1 1 14  1  17 o 665.2902 23.45696 86.43961       6.060535      74.15768       8.445839      99.47686       8.701667  612.9326 35.63531 712.0729 31.46661 -99.14032      47.53970 
1 1 1 14  1  18 o 483.5399 40.44768 46.58562       7.525697      46.58562       7.525697      0.000000       0.000000  483.5399 40.44768 ?        ?        0.000000       40.44768 
1 1 1 14  1  19 o 499.7829 28.08697 49.16587       5.429379      49.96830       7.743268      48.38982       7.614941  500.3721 40.18671 492.3618 40.17506 8.010376       56.82435 
1 1 1 14  1  20 o 275.3587 48.11463 15.63417       4.957933      15.53452       7.011680      15.73381       7.011472  268.7428 67.32400 270.5254 67.07087 -1.782562      95.03168 
1 1 1 14  1  21 o 348.5431 36.81407 24.38518       4.907681      20.83278       6.851454      28.12847       7.033130  314.2634 58.28461 369.7348 50.28584 -55.47134      76.97897 
1 1 1 14  1  22 o 378.9026 33.33773 28.68990       4.855653      20.87560       6.723114      37.21053       7.020389  313.8806 57.26416 428.2266 42.78705 -114.3461      71.48367 
1 1 1 14  1  23 o 365.4369 34.23050 26.82919       4.801352      33.28066       6.851905      20.60522       6.730010  402.9639 44.52816 310.1526 58.00680 92.81128       73.12691 
1 1 1 14  1  24 o 131.5769 53.86041 1.717207       4.379951      -2.884875      6.161561      6.418068       6.227337  125.3738 57.17204 183.0030 67.03758 -57.62926      88.10607 
1 1 1 14  2  0  o 282.2192 37.21459 15.95756       3.979276      14.03932       5.510698      18.04758       5.752157  259.7541 56.25634 296.5905 51.82616 -36.83636      76.49004 
1 1 1 14  2  1  o 467.0649 27.31368 42.82691       4.932758      38.67509       8.007833      45.36559       6.261810  438.7681 47.76677 479.3840 33.85238 -40.61588      58.54612 
1 1 1 14  2  2  o 729.9702 20.72348 103.8980       5.874836      110.7855       10.18602      100.4649       7.191470  750.9258 34.92847 716.9894 25.82718 33.93640       43.44009 
1 1 1 14  2  3  o 953.5907 32.35167 178.2421       11.98082      0.000000       0.000000      178.2421       11.98082  ?        ?        953.5907 32.35167 0.000000       32.35167 
1 1 1 14  2  4  o 890.6647 32.15607 155.3784       11.12257      0.000000       0.000000      155.3784       11.12257  ?        ?        890.6647 32.15607 0.000000       32.15607 
1 1 1 14  2  5  o 1072.968 19.44600 224.2197       8.102989      227.6364       10.46750      219.1107       12.79988  1080.067 24.95539 1058.197 31.14663 21.87000       39.91095 
1 1 1 14  2  6  o 553.8198 26.19234 59.86732       5.633403      61.33229       7.259519      57.64981       8.931558  558.6359 33.61850 539.4691 42.98854 19.16687       54.57305 
1 1 1 14  2  7  o 563.3922 25.34864 61.92516       5.546174      61.75557       7.116221      62.18755       8.851739  560.7933 32.81829 561.0380 40.90830 -0.2447510     52.44549 
1 1 1 14  2  8  o 821.3328 21.15913 131.4170       6.749087      124.8060       8.546778      142.3683       11.00026  799.5076 27.52655 852.8417 33.21288 -53.33411      43.13707 
1 1 1 14  2  9  o 835.9453 22.93225 136.2216       7.444793      131.3831       13.38544      138.3887       8.958211  816.0862 42.38050 841.8688 27.39989 -25.78265      50.46644 
1 1 1 14  2  10 o 499.1541 29.12543 48.86126       5.621407      68.27959       12.01764      43.42247       6.360108  584.2310 53.56354 469.3640 35.14724 114.8670       64.06544 
1 1 1 14  2  11 o 885.0728 29.70547 153.1965       10.21042      153.1965       10.21042      0.000000       0.000000  885.0728 29.70547 ?        ?        0.000000       29.70547 
1 1 1 14  2  12 o 651.7809 25.40255 82.93463       6.429939      91.63872       9.231357      74.73241       8.961271  682.6350 34.93870 615.6272 37.66323 67.00781       51.37345 
1 1 1 14  2  13 o 217.6349 61.07531 9.761545       5.372672      9.497609       7.663694      10.01663       7.534173  221.8418 74.92384 225.4691 74.24699 -3.627243      105.4808 
1 1 1 14  2  14 o 119.6727 53.76191 -2.294561      5.208909      -6.296044      7.473391      1.485924       7.264086  130.7795 60.81957 164.0759 68.46671 -33.29642      91.57899 
1 1 1 14  2  15 o 716.8713 22.86086 100.2511       6.364462      97.16674       9.145844      103.1471       8.862270  703.9055 33.45657 725.6597 31.44735 -21.75421      45.91599 
1 1 1 14  2  16 f 609.8698 25.34310 72.66220       6.002398      69.58259       8.637933      75.53779       8.346891  593.4927 37.67237 619.2068 34.85225 -25.71411      51.32140 
1 1 1 14  2  17 o 583.8365 29.57307 66.96950       6.683383      66.23294       11.80591      67.31686       8.107625  573.0518 53.67435 583.7410 35.93862 -10.68927      64.59505 
1 1 1 14  2  18 o 482.6061 29.37255 45.85857       5.478873      44.80252       7.655666      46.96732       7.844373  473.5802 42.06356 484.9667 42.06704 -11.38651      59.48932 
1 1 1 14  2  19 o 622.7461 24.03935 75.89671       5.813821      71.59015       8.059755      80.56834       8.394423  601.3463 34.65874 638.2822 33.98736 -36.93585      48.54245 
1 1 1 14  2  20 o 480.7563 28.45952 45.59010       5.289840      39.84672       7.289760      51.97821       7.688048  444.9409 42.71230 510.0364 39.11182 -65.09552      57.91438 
1 1 1 14  2  21 o 267.6750 48.84544 14.88545       4.890516      14.06730       6.712951      15.81078       7.139180  254.7605 66.96810 269.6663 68.14212 -14.90579      95.54096 
1 1 1 14  2  22 o 290.0367 44.56807 17.32107       4.859384      17.95621       6.816342      16.66468       6.929469  288.2547 62.67668 276.3882 65.55080 11.86652       90.69329 
1 1 1 14  2  23 o 762.9881 20.89615 114.1655       6.191730      114.9626       8.670240      113.3358       8.845239  762.0294 29.29756 756.2061 30.11906 5.823364       42.01791 
1 1 1 14  2  24 o 99.07451 46.36251 -3.883578      4.452994      -4.010913      6.347456      -3.760174      6.248676  122.6940 56.70739 122.5799 56.51751 0.1141510      80.06221 
1 1 1 14  3  0  o 1211.797 18.97498 286.2383       8.929746      296.8513       15.73521      281.1965       10.84533  1229.309 32.95972 1199.917 23.27359 29.39197       40.34852 
1 1 1 14  3  1  o 467.8483 27.27879 42.96358       4.934808      50.71927       8.370539      38.83200       6.109434  504.6208 43.12724 442.9402 35.82300 61.68051       56.06466 
1 1 1 14  3  2  o 351.5233 34.38826 24.48675       4.634406      24.00077       8.075796      24.72538       5.658955  340.1938 63.46107 351.4678 42.30929 -11.27399      76.27177 
1 1 1 14  3  3  o 523.0468 28.00567 53.64291       5.668076      54.44227       7.285790      52.41743       9.021148  525.3086 35.92932 512.8813 45.77253 12.42725       58.18969 
1 1 1 14  3  4  o 170.5357 58.90874 5.318171       4.742598      8.545466       6.027426      0.7239695E-01  7.684530  207.4815 66.26422 160.6552 68.86914 46.82632       95.57146 
1 1 1 14  3  5  o 462.6944 30.12847 42.04216       5.384240      39.30402       7.035719      45.91215       8.364426  445.1113 41.16793 480.3326 45.37762 -35.22125      61.26930 
1 1 1 14  3  6  o 984.8916 31.94376 189.8116       12.21807      0.000000       0.000000      189.8116       12.21807  ?        ?        984.8916 31.94376 0.000000       31.94376 
1 1 1 14  3  7  o 954.8887 20.27948 177.5918       7.520341      172.0185       9.430441      187.3268       12.46369  938.8943 25.86350 978.3158 32.80496 -39.42151      41.77423 
1 1 1 14  3  8  o 774.3389 21.51723 116.8263       6.470615      115.4528       8.238115      119.0384       10.45457  768.9314 27.58750 779.5479 34.53307 -10.61652      44.19958 
1 1 1 14  3  9  o 426.8733 52.34364 36.61911       8.495605      45.10293       11.27212      25.46275       12.92622  471.0754 63.20966 344.8641 93.95940 126.2113       113.2423 
1 1 1 14  3  10 o 1145.396 37.63000 257.6000       16.73856      257.6000       16.73856      0.000000       0.000000  1145.396 37.63000 ?        ?        0.000000       37.63000 
1 1 1 14  3  11 o 237.7157 60.45905 11.72767       5.594383      15.96071       10.38033      9.994840       6.641448  277.7437 86.74006 222.5679 69.36105 55.17574       111.0621 
1 1 1 14  3  12 o 751.3558 26.90591 110.2906       7.850935      111.3677       9.495705      107.9635       13.95688  753.9788 32.42949 736.6672 49.06599 17.31165       58.81448 
1 1 1 14  3  13 o 814.6387 24.69837 129.5363       7.813783      139.5950       10.01538      113.8905       12.49092  844.5168 30.53734 758.8492 42.55659 85.66760       52.37931 
1 1 1 14  3  14 o 845.5118 21.07212 139.3487       6.919199      143.3701       10.01534      135.6768       9.570272  855.9158 30.13054 832.7496 29.59252 23.16620       42.23229 
1 1 1 14  3  15 o 924.1427 20.20820 166.4444       7.252616      156.4471       10.25771      176.4379       10.25579  894.1000 29.54174 949.9308 27.80028 -55.83081      40.56563 
1 1 1 14  3  16 o 354.0350 40.04583 25.01529       5.409130      33.95461       7.875026      17.03074       7.442607  410.2828 50.48973 284.3999 68.25459 125.8829       84.89936 
1 1 1 14  3  17 o 786.3720 21.54656 120.6816       6.580122      129.4874       9.524821      112.6419       9.101034  812.5953 30.18245 757.7119 30.92849 54.88348       43.21518 
1 1 1 14  3  18 o 289.6000 56.10962 17.43159       6.082592      24.39072       10.47426      13.89059       7.471510  334.8717 81.34656 255.5246 72.13463 79.34711       108.7229 
1 1 1 14  3  19 o 520.8568 27.90736 53.39678       5.624487      50.39354       7.849662      56.56554       8.063085  502.1810 40.59692 532.6956 39.25225 -30.51462      56.46989 
1 1 1 14  3  20 o 242.1628 53.97650 12.33319       4.946577      12.01959       6.884012      12.66797       7.112620  237.0454 69.96687 242.8505 70.96017 -5.805115      99.65295 
1 1 1 14  3  21 o 355.4177 37.78754 25.40876       5.135738      29.31434       7.077241      21.06434       7.464265  377.6706 49.43995 313.6138 63.46500 64.05685       80.44946 
1 1 1 14  3  22 o 156.0910 58.63247 4.054008       4.818448      3.635207       6.636722      4.520842       7.006970  167.2686 67.08409 175.8952 69.45335 -8.626694      96.56109 
1 1 1 14  3  23 o 437.2971 31.43059 38.16431       5.302132      41.92261       7.306379      33.98334       7.706288  453.7894 41.93332 404.1736 50.17575 49.61584       65.39120 
1 1 1 14  3  24 o 182.4000 62.36748 6.825310       5.310885      5.974811       6.577285      8.418698       9.002654  181.1843 68.40852 208.9669 79.76042 -27.78267      105.0783 
1 1 1 14  4  0  o 279.3245 44.37541 15.81759       4.652718      15.79739       7.546008      15.82998       5.909772  273.1363 70.61872 276.1713 56.99189 -3.034973      90.74734 
1 1 1 14  4  1  o 465.9740 28.02609 42.63831       5.048095      36.74627       8.298872      46.09890       6.360068  426.7608 51.08891 483.3181 34.10330 -56.55731      61.42566 
1 1 1 14  4  2  o 568.0641 29.51416 63.33374       6.488690      0.000000       0.000000      63.33374       6.488690  ?        ?        568.0641 29.51416 0.000000       29.51416 
1 1 1 14  4  3  o 464.9111 25.31777 42.32741       4.553902      40.14921       5.197715      49.52239       9.446652  452.0133 29.77641 497.4119 49.56279 -45.39862      57.81958 
1 1 1 14  4  4  o 393.4649 28.32987 30.41380       4.299941      27.92783       5.007808      37.39010       8.389031  375.8315 34.70235 431.3901 51.06515 -55.55853      61.74060 
1 1 1 14  4  5  f 1014.988 16.84735 200.4888       6.640803      199.5594       7.780180      202.9834       12.74615  1012.204 19.79218 1018.266 32.23220 -6.062012      37.82388 
1 1 1 14  4  6  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 14  4  7  o 374.8569 32.97215 27.71410       4.751167      21.55656       6.705419      33.92240       6.732995  325.3390 55.03421 413.0761 42.58157 -87.73712      69.58415 
1 1 1 14  4  8  o 472.2250 33.12719 43.86709       6.036757      42.74538       6.910401      47.48103       12.40374  465.0368 38.61303 481.8931 68.18186 -16.85626      78.35645 
1 1 1 14  4  9  o 372.0254 46.23901 27.71878       6.536403      33.49147       11.18662      24.72621       8.054380  401.0065 74.57713 346.8734 62.06950 54.13312       97.02768 
1 1 1 14  4  10 o 762.5948 20.89137 113.3234       6.187122      93.93941       12.52492      119.5803       7.115965  687.8365 47.17306 783.0129 23.40113 -95.17645      52.65843 
1 1 1 14  4  11 o 692.8580 25.59034 93.72672       6.885704      71.78281       12.02484      104.4324       8.399057  599.0913 52.20605 730.6851 29.59867 -131.5938      60.01294 
1 1 1 14  4  12 o 712.4713 21.97533 98.97546       6.080380      92.45037       9.023780      104.4017       8.228986  686.6465 33.83976 730.6245 29.00175 -43.97791      44.56715 
1 1 1 14  4  13 o 393.2238 45.52983 30.94647       6.824244      32.33528       8.075835      27.47831       12.76194  399.9314 53.32518 356.8272 91.62113 43.10416       106.0095 
1 1 1 14  4  14 o 652.4783 35.42784 83.81513       8.943503      83.81513       8.943503      0.000000       0.000000  652.4783 35.42784 ?        ?        0.000000       35.42784 
1 1 1 14  4  15 o 448.3718 32.29118 39.60872       5.585124      50.70347       8.115041      29.62366       7.698524  505.3318 41.72417 382.2466 53.31153 123.0852       67.69804 
1 1 1 14  4  16 o 322.4247 45.21325 20.97119       5.505723      25.58386       7.996858      16.81432       7.591484  352.1108 60.67076 282.1531 69.69135 69.95764       92.40034 
1 1 1 14  4  17 o 186.0045 61.72728 6.737931       5.203837      5.128893       7.358829      8.347414       7.359846  186.5349 71.88652 210.0065 73.33686 -23.47162      102.6936 
1 1 1 14  4  18 o 678.3032 23.38968 89.96134       6.161352      96.14435       8.788785      83.98584       8.640053  699.0178 32.37521 651.9617 34.24441 47.05603       47.12572 
1 1 1 14  4  19 o 805.3439 21.28048 126.7561       6.655655      125.1977       9.269032      128.4149       9.562881  797.8723 29.91389 807.8634 30.48055 -9.991089      42.70720 
1 1 1 14  4  20 o 568.0273 29.47434 63.69173       6.479570      64.66282       10.71579      63.13203       8.135336  564.1834 49.40543 562.7206 37.44041 1.462769       61.98936 
1 1 1 14  4  21 o 119.4705 52.91406 -1.176203      4.863678      2.758992       6.868596      -5.133669      6.888005  164.3542 67.38243 126.0101 58.53075 38.34410       89.25380 
1 1 1 14  4  22 o 274.0854 55.80974 16.00613       5.738641      16.29788       6.874347      15.33543       10.42314  272.7492 65.68336 261.2230 87.38178 11.52621       109.3155 
1 1 1 14  4  23 o 152.5746 61.27131 2.970664       5.544349      7.043684       6.726809      -5.658039      9.790921  190.8555 69.71052 151.1763 70.06736 39.67921       98.83820 
1 1 1 14  4  24 o 100.9662 47.37276 -4.238610      4.701961      -8.724866      6.634991      0.2873115      6.664258  109.6250 52.77315 145.7661 63.31537 -36.14111      82.42477 
1 1 1 14  5  0  o 231.8502 53.31669 11.14699       4.700432      11.79559       7.457734      10.71953       6.054364  238.9542 73.34151 227.1683 65.20860 11.78590       98.13837 
1 1 1 14  5  1  o 604.2887 24.07318 71.30106       5.649447      73.99876       9.531087      69.83988       7.014508  611.2882 40.37582 596.3336 30.38943 14.95465       50.53439 
1 1 1 14  5  2  o 501.2151 24.73447 49.05060       4.814540      50.22199       5.512354      45.28267       9.886374  505.9850 28.16408 473.6389 54.75739 32.34613       61.57587 
1 1 1 14  5  3  o 1000.617 17.17983 194.9097       6.675971      190.7108       7.656954      208.2196       13.63240  989.3472 19.92872 1030.402 34.06730 -41.05481      39.46815 
1 1 1 14  5  4  o 648.5804 20.34394 81.95893       5.124209      83.43321       5.900457      77.43549       10.33545  654.0521 23.22979 625.4178 42.81060 28.63422       48.70699 
1 1 1 14  5  5  o 1244.029 18.36046 301.3081       8.870379      300.1121       10.85633      303.7103       15.38557  1240.727 22.53092 1245.682 31.80375 -4.955933      38.97590 
1 1 1 14  5  6  o 333.3883 55.72621 22.64784       6.960356      22.64784       6.960356      0.000000       0.000000  333.3883 55.72621 ?        ?        0.000000       55.72621 
1 1 1 14  5  7  o 408.7698 30.56654 32.85525       4.817242      43.95237       7.178187      23.76228       6.497740  471.3539 39.58030 343.1219 50.25187 128.2321       63.96757 
1 1 1 14  5  8  o 851.3835 20.12341 141.1921       6.653571      145.9668       14.34987      139.8845       7.509596  860.8882 42.92133 847.0515 22.82858 13.83673       48.61465 
1 1 1 14  5  9  o 194.0083 58.30180 7.596770       4.747432      1.900387       10.96054      8.912259       5.267156  198.2878 83.50778 208.9748 61.06512 -10.68697      103.4529 
1 1 1 14  5  10 o 589.5519 23.73027 67.80797       5.433163      72.20960       11.94465      66.65970       6.100824  601.0793 51.67212 584.1501 26.89280 16.92920       58.25144 
1 1 1 14  5  11 o 260.5346 49.69281 13.88238       4.844418      20.59658       10.68673      12.14583       5.434908  310.8892 85.73698 241.8909 58.49664 68.99828       103.7916 
1 1 1 14  5  12 o 676.2894 27.14577 89.38129       7.129561      68.34157       11.69769      101.8161       8.992910  584.2266 52.10423 720.8799 32.12250 -136.6534      61.21034 
1 1 1 14  5  13 o 294.5081 49.00986 17.62559       5.408429      18.90132       7.968125      16.53573       7.364799  300.0208 69.71568 280.7722 68.21574 19.24863       97.53800 
1 1 1 14  5  14 o 515.5461 35.20657 52.41758       7.006724      50.21967       8.409642      57.40673       12.67025  502.5181 43.52184 531.1972 62.62234 -28.67911      76.26080 
1 1 1 14  5  15 o 171.0131 65.99094 4.094386       6.207626      1.472901       7.306185      10.89890       11.77106  164.0528 68.57859 248.4399 91.97031 -84.38710      114.7239 
1 1 1 14  5  16 o 527.8227 40.51025 55.32285       8.240529      55.32285       8.240529      0.000000       0.000000  527.8227 40.51025 ?        ?        0.000000       40.51025 
1 1 1 14  5  17 o 300.1876 46.49179 18.32623       5.244738      31.34001       7.536415      6.104651       7.303430  392.9820 50.55373 192.7192 72.22549 200.2628       88.16009 
1 1 1 14  5  18 o 165.6571 60.97267 4.624466       5.160262      8.723384       7.378254      0.6997654      7.219751  211.9397 73.46138 157.5494 67.12458 54.39032       99.51022 
1 1 1 14  5  19 o 273.4177 50.81506 15.50193       5.197077      9.982228       7.196606      21.51790       7.513165  220.5060 72.56231 318.8733 62.90491 -98.36726      96.03289 
1 1 1 14  5  20 o 155.9555 59.40215 3.765900       4.986914      1.732409       6.947994      5.926585       7.161997  159.4797 66.78961 188.1906 71.30495 -28.71089      97.69978 
1 1 1 14  5  21 o 413.4210 45.68825 34.86100       7.212831      36.65601       9.916582      32.84463       10.51025  415.2796 63.50658 387.8057 72.45062 27.47391       96.34406 
1 1 1 14  5  22 o 116.3411 53.35804 -3.203456      5.469424      -8.517982      6.599655      8.451384       9.773321  110.5632 53.07170 215.0472 82.85303 -104.4840      98.39324 
1 1 1 14  5  23 o 718.6942 21.99204 101.4816       6.138152      104.6978       8.617271      98.16907       8.745462  726.0575 30.56123 702.2651 32.06665 23.79236       44.29739 
1 1 1 14  5  24 o 239.2329 53.62689 12.36255       4.859122      2.224446       6.746896      23.28800       7.003985  157.1139 65.80849 328.9220 56.88955 -171.8081      86.98952 
1 1 1 14  6  0  o 473.0042 24.54101 43.81593       4.492527      39.89947       5.993259      48.83901       6.787371  449.3795 34.60801 497.2602 35.37791 -47.88074      49.49051 
1 1 1 14  6  1  o 398.0998 25.97905 31.09735       3.994439      29.30693       5.133016      33.84622       6.360223  384.8195 34.72086 412.5240 40.21169 -27.70453      53.12738 
1 1 1 14  6  2  o 367.3085 32.39850 26.64121       4.574161      26.85598       5.132226      25.81164       10.08663  368.0048 36.38745 349.4774 76.44594 18.52737       84.66421 
1 1 1 14  6  3  o 797.2443 18.81732 123.7908       5.826090      118.3112       6.582009      143.6209       12.52118  779.0052 21.75655 854.8608 37.71568 -75.85553      43.54102 
1 1 1 14  6  4  o 738.8208 22.04794 106.4143       6.326086      106.4143       6.326086      0.000000       0.000000  738.8208 22.04794 ?        ?        0.000000       22.04794 
1 1 1 14  6  5  o 314.5255 41.01078 19.78008       4.890162      19.78008       4.890162      0.000000       0.000000  314.5255 41.01078 ?        ?        0.000000       41.01078 
1 1 1 14  6  6  o 435.3152 23.84798 37.06973       4.016316      34.13273       4.964699      42.63198       6.832290  416.5853 30.90783 464.3944 38.22302 -47.80905      49.15580 
1 1 1 14  6  7  o 931.7123 26.77575 169.5150       9.688386      0.000000       0.000000      169.5150       9.688386  ?        ?        931.7123 26.77575 0.000000       26.77575 
1 1 1 14  6  8  o 668.5867 22.65705 87.16036       5.882868      92.87356       12.78795      85.62672       6.625580  683.4752 48.49295 662.2765 25.76064 21.19873       54.91062 
1 1 1 14  6  9  o 425.9990 32.11483 35.73908       5.273957      53.92311       12.28161      31.62781       5.839802  515.1512 62.68120 399.4113 38.11112 115.7400       73.35796 
1 1 1 14  6  10 o 317.2986 40.61976 20.13569       4.890436      15.14001       11.03374      21.35701       5.455578  273.0419 89.84792 326.0843 44.22150 -53.04236      100.1409 
1 1 1 14  6  11 o 488.0128 27.87369 46.70944       5.260758      52.36234       11.73576      45.28788       5.885178  507.8690 60.70504 479.7875 31.76484 28.08148       68.51356 
1 1 1 14  6  12 o 1180.390 18.11599 271.3396       8.304544      248.1215       16.65169      279.0262       9.581105  1123.158 38.17590 1196.479 20.61970 -73.32092      43.38861 
1 1 1 14  6  13 o 552.1415 25.02455 59.52835       5.365925      61.42387       11.74113      59.02792       6.032812  552.3381 55.48682 548.6564 28.41072 3.681702       62.33744 
1 1 1 14  6  14 o 1552.452 18.39795 469.4516       11.09214      448.0777       15.23922      493.5339       16.17597  1514.378 25.91198 1589.224 26.20942 -74.84631      36.85599 
1 1 1 14  6  15 o 484.7353 29.94379 46.19842       5.609284      46.34021       8.179455      46.07253       7.707057  482.0053 44.18819 481.3103 41.64236 0.6950378      60.71806 
1 1 1 14  6  16 o 685.4457 27.67900 91.99580       7.368032      88.34228       8.717819      101.1308       13.78494  670.4072 33.48429 710.2830 50.29946 -39.87573      60.42544 
1 1 1 14  6  17 o 491.8521 43.43356 48.40962       8.211130      48.40962       8.211130      0.000000       0.000000  491.8521 43.43356 ?        ?        0.000000       43.43356 
1 1 1 14  6  18 o 498.4901 34.67239 49.27599       6.670477      56.06679       7.937103      32.94517       12.30851  530.5353 38.79192 387.2180 84.24623 143.3172       92.74826 
1 1 1 14  6  19 o 200.6224 61.03770 8.368759       5.180000      8.138779       7.182348      8.618052       7.477837  205.3239 72.39516 210.2675 73.89455 -4.943527      103.4479 
1 1 1 14  6  20 o 763.7822 24.37118 114.4450       7.228931      124.4566       9.110283      97.42530       11.87833  794.5945 29.52285 695.3544 44.21639 99.24005       53.16661 
1 1 1 14  6  21 o 395.3176 38.16557 31.47961       5.786453      31.82924       7.105561      30.79121       9.970345  393.7760 47.41782 375.3319 71.00241 18.44412       85.38028 
1 1 1 14  6  22 o 139.2591 58.50071 1.251257       5.357101      1.744612       8.582997      0.9364079      6.856630  170.9207 73.01363 152.1464 65.13306 18.77426       97.84327 
1 1 1 14  6  23 o 200.0858 59.39398 8.662866       4.949405      13.22794       6.880157      3.766665       7.125310  242.6376 69.47414 169.8546 69.01714 72.78305       97.92867 
1 1 1 14  6  24 o 267.7337 48.26455 15.16190       4.833723      18.68884       6.756862      11.46493       6.917811  291.2406 61.66074 226.0534 70.84554 65.18719       93.92091 
1 1 1 14  7  0  o 783.7908 26.62708 120.1016       8.104975      0.000000       0.000000      120.1016       8.104975  ?        ?        783.7908 26.62708 0.000000       26.62708 
1 1 1 14  7  1  o 372.9344 33.40116 27.49481       4.786266      26.31293       5.357454      32.16777       10.65289  363.6883 38.51781 392.1550 72.62357 -28.46664      82.20587 
1 1 1 14  7  2  o 143.7549 54.32719 3.046519       4.150659      7.072320       4.547677      -17.03702      10.15742  187.5323 57.22132 129.7853 63.14487 57.74701       85.21475 
1 1 1 14  7  3  o 714.1619 23.04837 99.48326       6.392414      99.48326       6.392414      0.000000       0.000000  714.1619 23.04837 ?        ?        0.000000       23.04837 
1 1 1 14  7  4  o 317.2069 36.66821 20.00896       4.433853      23.72462       4.884871      2.629082       10.56475  345.6961 36.95837 198.4798 82.67458 147.2163       90.55941 
1 1 1 14  7  5  o 564.4337 25.47404 62.18814       5.583912      62.18814       5.583912      0.000000       0.000000  564.4337 25.47404 ?        ?        0.000000       25.47404 
1 1 1 14  7  6  o 423.2771 31.14157 35.24798       5.083147      35.24798       5.083147      0.000000       0.000000  423.2771 31.14157 ?        ?        0.000000       31.14157 
1 1 1 14  7  7  o 597.3832 32.11457 70.08363       7.423117      52.83200       12.28117      80.01435       9.317826  509.6804 63.41731 637.0774 37.83091 -127.3970      73.84398 
1 1 1 14  7  8  o 390.9948 45.99400 30.61027       6.850429      26.14780       11.67653      32.95240       8.459241  349.4386 86.50453 403.2336 55.48907 -53.79498      102.7719 
1 1 1 14  7  9  o 212.3496 68.51071 8.946370       6.430613      4.060600       11.08912      11.42188       7.893368  208.8754 85.62419 237.7563 75.81973 -28.88087      114.3684 
1 1 1 14  7  10 o 727.8516 26.02036 103.4906       7.355025      100.0361       12.77991      105.2014       8.993767  709.4597 46.64441 732.7979 31.60308 -23.33820      56.34231 
1 1 1 14  7  11 o 466.2612 36.48151 42.97220       6.553208      47.44225       11.36553      40.74603       8.020705  482.4192 62.10723 451.4754 46.40625 30.94373       77.52966 
1 1 1 14  7  12 o 1562.258 21.48921 475.8976       13.03770      439.3192       21.68348      496.6099       16.31665  1494.747 37.35367 1594.222 26.35446 -99.47498      45.71493 
1 1 1 14  7  13 o 1021.264 18.51990 203.1615       7.345216      194.5285       15.66916      205.5929       8.315456  993.3986 40.61572 1026.925 20.85064 -33.52631      45.65508 
1 1 1 14  7  14 o 868.2216 17.46966 146.8020       5.890376      145.2690       9.806956      147.6672       7.367342  861.3899 29.31612 870.0663 21.80371 -8.676453      36.53542 
1 1 1 14  7  15 o 712.4218 22.58316 99.07600       6.248128      93.60771       8.885682      104.4241       8.787511  690.3857 33.14141 729.6958 31.00959 -39.31012      45.38665 
1 1 1 14  7  16 o 295.6987 46.96882 17.80529       5.213356      23.92523       7.696934      12.61767       7.086443  339.3570 60.62747 244.7266 70.63521 94.63042       93.08611 
1 1 1 14  7  17 o 458.0830 31.51595 41.46117       5.572526      47.66201       8.222905      36.19480       7.578019  487.5179 43.90262 423.3547 46.87861 64.16321       64.22650 
1 1 1 14  7  18 o 408.3887 50.70405 34.04861       7.868605      34.04861       7.868605      0.000000       0.000000  408.3887 50.70405 ?        ?        0.000000       50.70405 
1 1 1 14  7  19 o 295.4131 66.75153 18.79834       7.477667      18.79834       7.477667      0.000000       0.000000  295.4131 66.75153 ?        ?        0.000000       66.75153 
1 1 1 14  7  20 o 132.5934 55.94128 0.8037364      4.932877      -1.489316      6.899455      3.201648       7.055445  141.5490 62.84145 168.5995 68.61174 -27.05051      93.04095 
1 1 1 14  7  21 o 202.3431 58.65309 8.740935       4.876771      12.03439       6.970694      5.583527       6.825198  234.4035 70.69281 181.8138 69.43571 52.58980       99.08981 
1 1 1 14  7  22 o 313.1316 42.40746 20.15696       5.024327      23.80701       7.172782      16.64078       7.040020  333.7062 57.41788 273.7117 66.81397 59.99448       88.09608 
1 1 1 14  7  23 o 405.9005 33.28097 33.11515       5.200039      36.87032       7.194654      29.00793       7.524353  423.0209 44.45979 369.7332 53.99469 53.28772       69.94354 
1 1 1 14  8  0  o 402.4926 28.19978 31.84765       4.380056      33.07074       5.717743      30.11049       6.814183  408.5467 36.41943 387.2750 46.22024 21.27167       58.84459 
1 1 1 14  8  1  o 527.5305 28.07340 54.57967       5.730662      54.57967       5.730662      0.000000       0.000000  527.5305 28.07340 ?        ?        0.000000       28.07340 
1 1 1 14  8  2  f 790.0872 20.20924 121.6530       6.200876      141.3394       7.143654      61.48593       12.48870  851.3984 21.60526 551.3010 59.26153 300.0974       63.07706 
1 1 1 14  8  3  o 185.3408 58.74630 6.792180       4.744229      6.792180       4.744229      0.000000       0.000000  185.3408 58.74630 ?        ?        0.000000       58.74630 
1 1 1 14  8  4  f 278.9817 48.44334 15.83133       5.058130      15.83133       5.058130      0.000000       0.000000  278.9817 48.44334 ?        ?        0.000000       48.44334 
1 1 1 14  8  5  o 474.9742 28.71828 44.26971       5.272414      44.26971       5.272414      0.000000       0.000000  474.9742 28.71828 ?        ?        0.000000       28.71828 
1 1 1 14  8  6  o 1045.458 22.65848 213.1670       9.199522      213.1670       9.199522      0.000000       0.000000  1045.458 22.65848 ?        ?        0.000000       22.65848 
1 1 1 14  8  7  o 705.1602 28.39232 97.23708       7.775291      84.54991       13.18121      104.0074       9.628923  650.0360 52.66708 728.1775 34.04964 -78.14148      62.71522 
1 1 1 14  8  8  o 397.4477 44.89693 31.60030       6.808378      26.86675       11.55888      34.11502       8.424955  354.0631 85.11436 410.5327 54.16622 -56.46957      100.8882 
1 1 1 14  8  9  f 299.0531 58.24871 18.46637       6.521667      26.28669       11.21921      14.47525       8.014896  350.4270 83.60698 262.7357 74.90131 87.69135       112.2512 
1 1 1 14  8  10 o 302.8955 56.12313 18.86849       6.358690      21.61731       11.23224      17.57207       7.713775  317.2894 88.05054 288.9378 69.57590 28.35159       112.2217 
1 1 1 14  8  11 o 652.4400 29.01326 83.29999       7.351317      90.40748       13.50209      80.30537       8.764211  672.0831 52.13898 638.4330 35.48844 33.65009       63.07062 
1 1 1 14  8  12 o 803.8752 24.86737 126.2014       7.763302      113.4115       13.59493      132.3902       9.456837  755.3137 46.57418 822.3685 29.61089 -67.05487      55.19021 
1 1 1 14  8  13 o 217.5462 66.09766 9.672388       6.077410      0.1688022      11.41773      13.42938       7.178868  193.3182 83.42138 253.0938 70.44847 -59.77563      109.1884 
1 1 1 14  8  14 o 569.4164 29.15559 63.66248       6.425704      64.11152       11.84976      63.47544       7.647756  563.6788 54.82523 567.2316 34.88641 -3.552734      64.98359 
1 1 1 14  8  15 o 161.0948 59.92078 4.167820       5.008384      10.36195       7.538957      -0.7255110     6.700753  226.7184 74.25185 145.3168 63.30281 81.40158       97.57348 
1 1 1 14  8  16 o 214.7304 59.48591 9.638782       5.131305      8.857681       7.966764      10.19255       6.708023  215.9064 76.23317 222.3396 69.77631 -6.433243      103.3452 
1 1 1 14  8  17 o 213.9520 62.24166 9.588295       5.482952      16.29178       7.447493      1.654980       8.101906  275.4028 69.60141 170.4796 71.79662 104.9232       99.99555 
1 1 1 14  8  18 o 399.3064 37.81511 31.90801       5.794206      29.29196       7.579147      35.58736       8.988397  377.0020 53.24867 414.3582 57.39863 -37.35623      78.29446 
1 1 1 14  8  19 o 149.9059 58.51414 3.119942       4.924241      1.295122       7.061453      4.847323       6.870337  157.8434 66.78097 178.4343 69.26431 -20.59084      96.21456 
1 1 1 14  8  20 o 173.1160 69.00607 4.079082       6.977807      4.079082       6.977807      0.000000       0.000000  173.1160 69.00607 ?        ?        0.000000       69.00607 
1 1 1 14  8  21 o 538.6322 31.64047 57.76603       6.589493      58.92545       7.872485      55.05276       12.04309  541.2551 37.68774 508.3083 62.31236 32.94672       72.82305 
1 1 1 14  8  22 o 500.8627 39.63709 50.88777       7.646910      50.88777       7.646910      0.000000       0.000000  500.8627 39.63709 ?        ?        0.000000       39.63709 
1 1 1 14  8  23 o 367.1031 39.88526 27.56520       5.594791      20.91371       8.755357      32.15576       7.273561  300.7069 75.17523 392.1091 48.82267 -91.40219      89.63799 
1 1 1 14  9  0  o 446.0164 34.25354 39.28821       5.887820      39.28821       5.887820      0.000000       0.000000  446.0164 34.25354 ?        ?        0.000000       34.25354 
1 1 1 14  9  1  o 304.5992 41.42249 18.62396       4.772875      21.47973       5.331363      7.095644       10.71173  327.1088 43.01074 221.6167 86.35854 105.4920       96.47653 
1 1 1 14  9  2  o 490.8611 29.60749 47.32812       5.617599      47.32812       5.617599      0.000000       0.000000  490.8611 29.60749 ?        ?        0.000000       29.60749 
1 1 1 14  9  3  o 1185.358 22.52699 274.0772       10.37005      274.0772       10.37005      0.000000       0.000000  1185.358 22.52699 ?        ?        0.000000       22.52699 
1 1 1 14  9  4  o 175.7924 69.19742 3.877645       6.935291      3.877645       6.935291      0.000000       0.000000  175.7924 69.19742 ?        ?        0.000000       69.19742 
1 1 1 14  9  5  o 760.9578 21.76416 112.9204       6.431771      112.9204       6.431771      0.000000       0.000000  760.9578 21.76416 ?        ?        0.000000       21.76416 
1 1 1 14  9  6  o 539.2006 24.38588 56.76156       5.106422      69.63171       6.393947      34.09688       8.485005  596.7578 27.58945 410.1830 54.62352 186.5748       61.19564 
1 1 1 14  9  7  o 127.6203 51.91041 1.367559       4.036215      0.8005363      5.424258      2.071010       6.041666  140.2950 58.89744 155.3405 63.38477 -15.04553      86.52478 
1 1 1 14  9  8  o 581.2064 29.51357 66.29666       6.639759      86.90337       13.29599      59.45042       7.663771  658.6075 52.41740 548.8087 36.16044 109.7989       63.68015 
1 1 1 14  9  9  o 610.0752 24.54855 72.68454       5.816171      63.52573       12.00351      75.49456       6.648803  561.2148 55.81504 621.2969 27.55601 -60.08209      62.24670 
1 1 1 14  9  10 o 205.0500 58.61235 8.646346       4.901184      1.395889       11.22445      10.35443       5.447998  197.0511 83.81880 223.3389 61.06124 -26.28778      103.7018 
1 1 1 14  9  11 o 913.5710 19.48676 162.6467       6.913689      141.8236       14.63609      168.6276       7.843996  845.5158 44.73250 929.8116 21.72273 -84.29578      49.72799 
1 1 1 14  9  12 o 1046.863 18.66988 213.5198       7.590303      189.0602       15.62629      221.0730       8.683528  978.7743 41.10979 1064.744 21.00018 -85.96973      46.16299 
1 1 1 14  9  13 o 893.9252 23.42176 156.0267       8.131089      135.6684       14.67955      165.0375       9.766144  825.9182 45.94828 918.4490 27.38042 -92.53076      53.48768 
1 1 1 14  9  14 o 802.3914 23.48108 125.7665       7.316989      107.2298       12.94448      134.4703       8.870012  733.5316 45.66643 828.7610 27.55922 -95.22943      53.33792 
1 1 1 14  9  15 o 421.4348 41.68681 35.52800       6.733249      42.08829       11.28328      31.89984       8.391069  449.6461 66.63216 394.3281 56.40047 55.31802       87.29752 
1 1 1 14  9  16 o 789.7330 27.70192 122.3528       8.496072      129.4153       14.00906      118.2439       10.68545  804.3413 45.02864 773.8063 35.55761 30.53503       57.37527 
1 1 1 14  9  17 o 636.6816 26.50247 79.53751       6.552946      61.15111       8.487845      106.6669       10.31026  553.3630 39.76164 734.0352 36.16801 -180.6721      53.75047 
1 1 1 14  9  18 o 303.8400 43.96920 18.84034       5.037413      13.17997       7.449948      23.60811       6.837362  246.8075 72.76845 337.0241 54.06753 -90.21655      90.65619 
1 1 1 14  9  19 o 406.9149 33.01171 32.99883       5.171777      27.43607       7.582942      37.83690       7.071777  362.2149 55.69012 432.3435 42.67522 -70.12860      70.16099 
1 1 1 14  9  20 o 437.4066 30.75770 38.05611       5.191529      29.07846       7.482442      46.38970       7.209049  373.1268 53.13803 479.8044 39.02705 -106.6776      65.92997 
1 1 1 14  9  21 o 680.4219 31.91773 92.05702       8.434091      84.77592       10.95665      102.6456       13.21291  644.8998 44.01079 706.3912 48.45726 -61.49146      65.46033 
1 1 1 14  9  22 o 269.4659 77.55934 16.85959       8.554570      16.85959       8.554570      0.000000       0.000000  269.4659 77.55934 ?        ?        0.000000       77.55934 
1 1 1 14  9  23 o 567.5638 25.68738 63.69948       5.661904      78.86954       8.224424      50.03298       7.806218  626.5222 33.92835 494.7007 41.00177 131.8214       53.21915 
1 1 1 14  10 0  o 759.8831 21.76501 112.6575       6.422935      108.4792       7.344898      126.2371       13.24127  745.0209 25.38571 797.8430 42.89249 -52.82202      49.84175 
1 1 1 14  10 1  o 1268.076 23.44679 313.9269       11.54666      313.9269       11.54666      0.000000       0.000000  1268.076 23.44679 ?        ?        0.000000       23.44679 
1 1 1 14  10 2  o 617.1180 25.75591 74.42336       6.172670      74.42336       6.172670      0.000000       0.000000  617.1180 25.75591 ?        ?        0.000000       25.75591 
1 1 1 14  10 3  o 266.4030 52.82762 14.61318       5.272429      14.61318       5.272429      0.000000       0.000000  266.4030 52.82762 ?        ?        0.000000       52.82762 
1 1 1 14  10 4  o 694.7853 20.95409 94.13034       5.653890      98.08615       6.411689      80.30015       11.98861  708.8834 23.29001 634.0025 49.07334 74.88086       54.31958 
1 1 1 14  10 5  o 1151.667 17.42016 258.3003       7.791246      257.9633       8.915895      259.3891       16.02553  1150.389 19.95687 1148.634 35.92550 1.755127       41.09644 
1 1 1 14  10 6  o 537.9180 25.86154 56.55271       5.402547      64.83054       6.919607      43.62792       8.646398  574.2870 31.14233 466.3635 48.44706 107.9235       57.59308 
1 1 1 14  10 7  o 112.2085 49.29319 -0.9400076     4.139630      -4.745103      5.464817      4.183167       6.341068  111.5525 51.92136 172.6447 66.67515 -61.09218      84.50682 
1 1 1 14  10 8  o 997.3129 19.80624 193.8808       7.671169      193.6818       16.54918      193.9353       8.657450  989.7335 43.05567 996.9266 22.36139 -7.193115      48.51620 
1 1 1 14  10 9  o 443.3435 33.80820 38.81087       5.777021      31.42608       12.23091      40.93148       6.554206  382.5068 84.58228 454.5207 37.46496 -72.01385      92.50829 
1 1 1 14  10 10 o 199.1693 60.55240 8.050816       5.099282      4.924370       11.17057      8.873824       5.731287  212.8377 86.44139 209.0323 64.31703 3.805344       107.7441 
1 1 1 14  10 11 o 633.6509 23.48226 78.38938       5.778538      78.49825       12.91645      78.36214       6.461197  624.8521 53.75089 633.1080 26.27890 -8.255859      59.83092 
1 1 1 14  10 12 o 160.8541 59.13480 4.257409       4.851821      18.03708       11.44462      1.238248       5.357040  291.4554 91.08741 142.2098 59.02301 149.2456       108.5386 
1 1 1 14  10 13 o 764.0215 22.14614 113.9502       6.571004      112.4567       13.81597      114.3868       7.469964  750.4203 47.65483 764.8979 25.14705 -14.47766      53.88281 
1 1 1 14  10 14 o 469.0238 29.52159 43.32347       5.349841      52.15325       11.92428      41.09824       5.986124  503.4767 62.31631 455.7015 34.07147 47.77518       71.02245 
1 1 1 14  10 15 o 636.3182 24.23270 79.22937       5.988307      59.35472       12.00309      85.81539       6.909629  538.2393 58.35835 661.6515 26.89041 -123.4122      64.25568 
1 1 1 14  10 16 o 598.4654 28.28787 70.35535       6.574568      56.10745       12.22719      76.15014       7.797757  520.3166 61.71355 620.6883 32.46233 -100.3717      69.73066 
1 1 1 14  10 17 o 510.3728 31.55209 51.57508       6.223124      36.69614       11.73315      57.39905       7.340710  410.9076 76.33639 537.2151 35.38342 -126.3076      84.13816 
1 1 1 14  10 18 f 308.8607 43.00399 19.45862       5.018262      11.33054       7.600739      25.73969       6.681570  230.7262 74.48811 353.2625 50.10701 -122.5364      89.77300 
1 1 1 14  10 19 o 428.0135 31.28946 36.44672       5.164917      32.96375       7.634190      39.38659       7.013777  399.4165 50.33405 441.1626 41.42294 -41.74612      65.18724 
1 1 1 14  10 20 o 102.3221 48.62345 -5.901178      5.251768      -1.773514      9.199157      -7.896945      6.396624  160.4713 71.81247 109.9435 52.63478 50.52774       89.03623 
1 1 1 14  10 21 o 122.9605 55.11303 -1.625274      5.441032      -2.522280      9.112976      -1.128362      6.782693  155.7114 70.42200 140.1001 62.24763 15.61125       93.98950 
1 1 1 14  10 22 o 170.3740 64.23898 5.229316       5.794905      7.862678       6.981217      -0.6052026     10.39150  196.4722 71.12983 171.8873 76.66548 24.58496       104.5803 
1 1 1 14  11 0  o 259.6547 51.24085 13.89967       4.983549      12.22701       5.689919      19.40964       10.32704  241.5567 60.72130 299.9906 84.84779 -58.43390      104.3371 
1 1 1 14  11 1  o 357.8622 40.69473 25.61245       5.555063      25.61245       5.555063      0.000000       0.000000  357.8622 40.69473 ?        ?        0.000000       40.69473 
1 1 1 14  11 2  o 414.6295 37.71758 34.14627       6.006987      34.14627       6.006987      0.000000       0.000000  414.6295 37.71758 ?        ?        0.000000       37.71758 
1 1 1 14  11 3  o 804.0882 20.04583 126.0717       6.259731      129.5661       7.152268      114.6335       12.94016  814.6949 22.60585 759.5114 44.06031 55.18353       49.52106 
1 1 1 14  11 4  o 595.8844 22.73457 69.31730       5.261102      72.62919       5.939777      57.25820       11.33417  609.5999 25.08981 531.9300 55.69211 77.66992       61.08281 
1 1 1 14  11 5  o 114.6161 50.61055 -1.184446      4.416650      -0.7716322     4.966106      -2.746434      9.660009  124.5967 54.38043 166.1624 74.02918 -41.56574      91.85614 
1 1 1 14  11 6  o 731.0982 21.09624 104.2654       5.989750      103.3678       7.546966      105.7932       9.845777  726.9380 26.73296 733.6160 34.55836 -6.678040      43.69132 
1 1 1 14  11 7  o 350.6395 36.82469 24.46064       4.939608      29.78448       6.023921      13.53353       8.630166  386.3237 40.76696 254.9991 79.00101 131.3246       88.89941 
1 1 1 14  11 8  o 128.9750 56.93397 -1.399781      5.585166      25.45021       11.64923      -9.413911      6.364340  342.5672 87.30750 106.8822 51.51147 235.6850       101.3708 
1 1 1 14  11 9  o 286.8864 52.80524 16.90964       5.666436      10.06168       11.63927      19.03685       6.487104  242.4106 91.11331 303.5982 57.11665 -61.18768      107.5358 
1 1 1 14  11 10 o 529.7557 28.74814 55.11091       5.892292      60.20823       12.67049      53.70437       6.655780  543.5769 61.07859 522.0035 33.00190 21.57336       69.42420 
1 1 1 14  11 11 o 501.9046 28.40083 49.48152       5.513093      20.14462       11.30570      58.63395       6.314783  305.5269 89.51842 546.1663 29.88514 -240.6395      94.37514 
1 1 1 14  11 12 o 198.0923 60.66727 7.984932       5.106070      -5.073365      11.10536      11.48551       5.749881  170.2862 77.30450 234.1086 62.18962 -63.82245      99.21459 
1 1 1 14  11 13 o 393.6789 35.72794 30.79026       5.402840      27.79291       11.82848      31.58048       6.073423  356.3171 86.37749 397.6597 39.86406 -41.34256      95.13261 
1 1 1 14  11 14 o 844.1243 19.17385 139.0264       6.285555      128.6254       14.21377      141.5548       7.008022  801.7236 45.84193 851.3124 21.19720 -49.58881      50.50549 
1 1 1 14  11 15 o 745.3570 20.12286 108.5056       5.824814      111.5708       13.79787      107.8408       6.425434  744.3773 47.98560 742.5842 22.28070 1.793091       52.90602 
1 1 1 14  11 16 o 335.8285 36.30195 22.59957       4.659184      -0.3924058     11.39429      27.21575       5.105526  186.6965 81.90373 368.9320 36.09657 -182.2355      89.50522 
1 1 1 14  11 17 f 445.0615 35.75047 39.55557       6.127020      27.09690       11.71380      44.24796       7.188841  345.0017 87.34346 469.3623 39.81417 -124.3606      95.98983 
1 1 1 14  11 18 o 247.7748 60.28326 13.22182       5.745424      -7.348234      11.65171      19.83009       6.604130  163.4394 75.98598 305.6725 57.74920 -142.2332      95.44025 
1 1 1 14  11 19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 14  11 20 o 465.6515 33.16760 43.42923       5.958753      16.22815       10.20526      57.49994       7.339881  264.0729 86.38539 534.9471 35.53265 -270.8742      93.40774 
1 1 1 14  11 21 o 172.9456 59.38439 6.069512       4.815998      1.960550       7.084872      9.599033       6.566347  158.3279 66.93357 209.8172 69.32502 -51.48936      96.36421 
1 1 1 14  11 22 o 480.4957 28.65055 46.03130       5.321956      49.56307       7.687371      42.78064       7.375101  492.3569 40.56511 456.3456 42.08894 36.01132       58.45517 
1 1 1 14  12 0  o 593.5916 26.49981 68.98644       6.108836      68.32236       6.859967      71.53048       13.42680  589.2878 30.07564 592.2340 59.17025 -2.946167      66.37517 
1 1 1 14  12 1  o 532.3339 31.08425 55.82252       6.398241      55.82252       6.398241      0.000000       0.000000  532.3339 31.08425 ?        ?        0.000000       31.08425 
1 1 1 14  12 2  o 229.5577 63.13919 11.03854       5.804702      11.03854       5.804702      0.000000       0.000000  229.5577 63.13919 ?        ?        0.000000       63.13919 
1 1 1 14  12 3  o 887.9992 19.37698 153.7601       6.682312      153.5461       7.738575      154.3873       13.24969  886.7417 22.47170 884.3436 38.57950 2.398132       44.64700 
1 1 1 14  12 4  o 241.7565 59.10429 12.23537       5.502645      15.40318       6.541325      4.567918       10.17680  270.5991 63.36195 203.3485 82.53494 67.25064       104.0517 
1 1 1 14  12 5  o 405.9055 31.32747 32.52209       4.900103      32.34541       5.453836      33.26199       11.16103  403.9564 35.11411 396.2375 75.28295 7.718933       83.06939 
1 1 1 14  12 6  o 201.6600 59.16992 8.361287       4.936284      3.029694       5.930068      20.39172       8.907827  160.3731 63.71284 308.9872 74.99242 -148.6141      98.40321 
1 1 1 14  12 7  o 459.1682 30.30861 41.51555       5.374228      48.66410       6.724040      28.87246       8.942275  496.1635 35.12313 372.9214 64.05289 123.2420       73.05072 
1 1 1 14  12 8  o 372.1354 40.61199 27.66563       5.773970      6.959251       11.47871      34.67955       6.680691  224.4069 88.80362 416.7908 41.83852 -192.3839      98.16591 
1 1 1 14  12 9  o 117.1448 54.51976 -5.141747      6.023491      -9.753950      11.35145      -3.334069      7.106530  158.2672 74.04964 137.6718 62.23260 20.59537       96.72769 
1 1 1 14  12 10 o 822.8699 46.84494 135.0202       14.90808      135.0202       14.90808      0.000000       0.000000  822.8699 46.84494 ?        ?        0.000000       46.84494 
1 1 1 14  12 11 o 706.0355 24.71151 97.46487       6.775694      91.09325       13.75055      99.50808       7.786664  672.3716 53.09218 712.6721 28.13414 -40.30048      60.08585 
1 1 1 14  12 12 o 542.2881 27.97633 57.79437       5.871737      41.21082       12.43560      62.55239       6.661025  440.7859 75.35313 563.5895 30.54746 -122.8036      81.30954 
1 1 1 14  12 13 o 452.0697 28.40859 40.26109       4.962141      38.81408       11.85244      40.56862       5.464051  426.8878 74.18588 453.1232 31.24152 -26.23538      80.49583 
1 1 1 14  12 14 o 155.8646 57.01727 4.138780       4.502603      1.366074       10.66551      4.740111       4.966914  189.3486 81.15111 164.8853 59.95058 24.46330       100.8939 
1 1 1 14  12 15 o 278.8842 42.98569 15.87212       4.506012      -0.1598239     10.61203      19.39841       4.976958  181.6816 79.38919 309.0039 42.60682 -127.3223      90.09986 
1 1 1 14  12 16 o 528.6210 24.60364 54.83021       5.050935      62.08941       12.90473      53.51695       5.488835  544.7516 62.10933 520.9643 27.22418 23.78729       67.81390 
1 1 1 14  12 17 o 255.1000 51.16434 13.67807       4.892438      0.000000       0.000000      13.67807       4.892438  ?        ?        255.1000 51.16434 0.000000       51.16434 
1 1 1 14  12 18 o 213.7535 59.66877 9.842681       5.142280      -1.508176      9.478532      14.57696       6.121442  164.4124 73.28403 259.0172 61.73037 -94.60478      95.81852 
1 1 1 14  12 19 o 256.8069 65.11421 14.59629       6.503129      0.000000       0.000000      14.59629       6.503129  ?        ?        256.8069 65.11421 0.000000       65.11421 
1 1 1 14  12 20 o 458.8885 34.59051 42.39042       6.119094      45.38259       13.16890      41.56649       6.910421  444.4048 79.20739 451.8294 39.78835 -7.424561      88.63929 
1 1 1 14  12 21 o 481.7749 34.48603 46.80229       6.409641      49.67232       12.91459      45.86428       7.383144  468.0910 73.46163 473.5961 40.53309 -5.505127      83.90199 
1 1 1 14  13 0  o 938.3096 23.29512 172.1415       8.488662      172.1415       8.488662      0.000000       0.000000  938.3096 23.29512 ?        ?        0.000000       23.29512 
1 1 1 14  13 1  o 474.8605 37.29296 44.80003       6.822028      44.80003       6.822028      0.000000       0.000000  474.8605 37.29296 ?        ?        0.000000       37.29296 
1 1 1 14  13 2  o 928.3574 19.64677 168.1351       7.083278      178.0217       8.321022      142.1188       13.49816  954.5831 22.44579 846.9005 41.04065 107.6826       46.77765 
1 1 1 14  13 3  o 433.3060 31.34412 37.06845       5.238869      43.35853       6.028149      17.65553       10.59014  468.3121 33.36330 286.2992 87.31163 182.0129       93.46887 
1 1 1 14  13 4  o 358.7536 36.54213 25.62990       5.020099      27.55520       5.706227      19.03717       10.55926  371.1679 40.23082 296.4070 86.41763 74.76093       95.32327 
1 1 1 14  13 5  o 683.1117 29.44078 91.51026       7.810324      91.51026       7.810324      0.000000       0.000000  683.1117 29.44078 ?        ?        0.000000       29.44078 
1 1 1 14  13 6  o 236.8421 54.17439 11.67471       4.874728      13.43183       5.938278      8.043958       8.536085  252.9122 61.13549 213.6555 78.45335 39.25665       99.46093 
1 1 1 14  13 7  f 404.4071 35.12740 32.42532       5.462068      32.68177       6.203107      31.54025       11.52391  404.7996 39.98101 383.5110 79.96412 21.28854       89.40213 
1 1 1 14  13 8  o 665.1956 20.83117 86.33826       5.381347      101.3038       7.349461      69.04134       7.901206  719.5105 26.30210 591.3741 34.55387 128.1364       43.42546 
1 1 1 14  13 9  o 694.9550 26.93545 94.55809       7.269573      92.18900       14.06003      95.42250       8.492864  675.9113 54.01467 697.1028 31.37107 -21.19147      62.46382 
1 1 1 14  13 10 o 267.1858 58.89081 14.95023       5.946053      24.17390       12.42029      12.20770       6.772592  330.7470 92.87694 240.7133 68.93060 90.03372       115.6614 
1 1 1 14  13 11 f 756.1832 21.71290 111.6948       6.376360      118.4500       14.32372      110.0253       7.120840  768.4268 48.24302 749.9152 24.45069 18.51160       54.08535 
1 1 1 14  13 12 o 353.0208 37.98343 24.94254       5.125470      10.20374       12.41504      27.97074       5.627425  243.0845 93.45484 373.6595 39.37242 -130.5750      101.4100 
1 1 1 14  13 13 o 176.8021 57.56356 6.230103       4.533458      6.717799       11.79562      6.145580       4.910623  221.2267 89.18334 177.6773 59.97502 43.54939       107.4741 
1 1 1 14  13 14 o 240.7698 48.91164 12.07262       4.417410      18.63054       11.09021      10.83596       4.815938  288.7567 89.57150 226.4213 55.25579 62.33542       105.2438 
1 1 1 14  13 15 o 289.0787 41.66673 17.02748       4.542613      10.95881       12.07974      18.02703       4.902462  241.8529 92.37255 296.8826 43.83974 -55.02968      102.2478 
1 1 1 14  13 16 o 364.2633 35.11189 26.59677       4.905525      0.000000       0.000000      26.59677       4.905525  ?        ?        364.2633 35.11189 0.000000       35.11189 
1 1 1 14  13 17 o 113.2090 50.69044 -1.560027      4.590347      0.000000       0.000000      -1.560027      4.590347  ?        ?        113.2090 50.69044 0.000000       50.69044 
1 1 1 14  13 18 o 185.5070 56.30400 7.291395       4.411549      1.898879       12.11250      8.116128       4.736903  195.1972 85.06838 194.7894 58.16959 0.4078064      103.0550 
1 1 1 14  13 19 o 154.7449 58.25528 4.118284       4.761758      9.386415       7.278021      0.1753744      6.296416  209.8567 72.94813 141.5899 61.52234 68.26672       95.42760 
1 1 1 14  13 20 o 271.1515 48.38220 15.58580       4.907905      12.03026       7.237645      18.61252       6.677765  230.1314 72.51904 290.3304 61.15683 -60.19899      94.86395 
1 1 1 14  13 21 o 399.6684 39.65726 32.73509       6.074051      26.97683       12.95854      34.35645       6.876218  323.4405 96.12595 407.0061 44.21435 -83.56558      105.8069 
1 1 1 14  14 0  o 494.4355 36.58164 48.57976       6.974404      48.57976       6.974404      0.000000       0.000000  494.4355 36.58164 ?        ?        0.000000       36.58164 
1 1 1 14  14 1  o 291.3331 76.69721 18.38584       8.796547      18.38584       8.796547      0.000000       0.000000  291.3331 76.69721 ?        ?        0.000000       76.69721 
1 1 1 14  14 2  o 488.5830 30.49781 47.07896       5.757836      52.22794       6.788949      33.88420       10.86782  513.7037 34.22590 399.3594 72.75349 114.3443       80.40201 
1 1 1 14  14 3  o 473.2853 29.68595 44.13889       5.428723      39.64573       6.226890      58.37261       11.08293  446.8356 36.19452 536.2585 53.94948 -89.42288      64.96606 
1 1 1 14  14 4  o 780.4179 23.94802 119.0885       7.258130      123.6282       8.872356      109.9038       12.61995  793.9349 28.77571 742.4444 43.96475 51.49048       52.54465 
1 1 1 14  14 5  f 571.5753 28.19751 64.04089       6.259104      62.16013       7.511250      68.31412       11.32203  560.7494 34.66172 582.3049 50.56845 -21.55548      61.30744 
1 1 1 14  14 6  o 692.7844 24.33751 93.85139       6.547904      95.47612       7.773471      89.88255       12.14945  697.8068 28.68480 670.1108 46.98260 27.69592       55.04710 
1 1 1 14  14 7  o 421.1320 33.14085 35.09644       5.376339      36.69141       6.227506      30.42867       10.65351  429.4896 37.71857 377.6578 75.28027 51.83182       84.20101 
1 1 1 14  14 8  o 366.0096 32.59694 26.54844       4.584876      26.27510       5.832558      26.99051       7.417443  361.6330 42.33104 362.8197 54.31263 -1.186676      68.86057 
1 1 1 14  14 9  o 420.3788 36.16506 35.12570       5.846682      50.85837       13.06333      31.18481       6.538072  492.6353 70.27277 393.8539 43.46944 98.78140       82.63083 
1 1 1 14  14 10 o 303.2821 46.63602 18.76651       5.316904      31.31012       11.97757      15.68819       5.933556  377.9127 83.80736 273.5199 57.67582 104.3928       101.7358 
1 1 1 14  14 11 o 103.6595 48.72635 -4.989436      5.013624      -2.966911      11.78323      -5.436537      5.540136  181.1651 81.15977 109.0571 51.24991 72.10792       95.98679 
1 1 1 14  14 12 o 511.6343 27.72418 51.57898       5.488103      43.60994       13.15491      53.25824       6.038720  448.2566 78.42356 519.2607 30.07425 -71.00415      83.99236 
1 1 1 14  14 13 o 588.4551 27.01080 68.05556       6.172750      54.40751       12.37564      72.57546       7.121906  509.1203 64.00688 606.7659 30.22366 -97.64560      70.78383 
1 1 1 14  14 14 o 214.1762 56.31771 9.750391       4.746549      0.000000       0.000000      9.750391       4.746549  ?        ?        214.1762 56.31771 0.000000       56.31771 
1 1 1 14  14 15 o 386.3797 42.08720 30.29943       6.213127      0.000000       0.000000      30.29943       6.213127  ?        ?        386.3797 42.08720 0.000000       42.08720 
1 1 1 14  14 16 o 244.2615 50.84151 12.61607       4.665952      0.000000       0.000000      12.61607       4.665952  ?        ?        244.2615 50.84151 0.000000       50.84151 
1 1 1 14  14 17 o 148.0437 54.61302 3.828649       4.143407      17.00153       12.14303      2.092846       4.407952  270.1272 94.20754 135.1624 54.50764 134.9649       108.8400 
1 1 1 14  14 18 o 271.6499 43.12673 15.33122       4.397680      12.89606       12.30570      15.68775       4.708622  244.1992 93.24110 273.7189 45.92210 -29.51967      103.9362 
1 1 1 14  14 19 o 388.0656 27.93341 30.03158       4.181600      32.89003       7.798392      28.87804       4.954016  393.9893 52.25682 378.0791 34.10736 15.91019       62.40262 
1 1 1 14  14 20 o 394.9499 32.57765 31.44259       4.952184      24.40677       7.557498      36.73681       6.555738  332.9436 60.68525 423.0941 40.38907 -90.15051      72.89702 
1 1 1 14  15 0  o 558.9391 44.15227 62.69270       9.505940      62.69270       9.505940      0.000000       0.000000  558.9391 44.15227 ?        ?        0.000000       44.15227 
1 1 1 14  15 1  o 363.4955 67.19151 27.95556       9.135706      27.95556       9.135706      0.000000       0.000000  363.4955 67.19151 ?        ?        0.000000       67.19151 
1 1 1 14  15 2  o 403.3806 44.32949 32.78171       6.829880      33.61243       8.831990      31.54589       10.77223  403.5173 58.02903 383.4569 75.02398 20.06039       94.84707 
1 1 1 14  15 3  o 155.8702 63.48969 2.320523       6.048340      8.794184       7.635856      -8.580939      9.908894  213.6082 74.69346 147.3293 69.01237 66.27893       101.6947 
1 1 1 14  15 4  o 389.6892 40.54838 30.41576       6.046620      35.90523       7.516332      20.34717       10.17948  421.7621 46.67144 304.9447 83.50487 116.8174       95.66235 
1 1 1 14  15 5  o 174.8233 62.68994 5.462676       5.407474      13.45968       6.520013      -12.15919      9.678559  251.7309 65.91550 135.3051 64.76805 116.4258       92.41078 
1 1 1 14  15 6  o 616.8938 23.82745 74.43899       5.708421      71.34219       7.324400      79.23048       9.110684  601.5062 31.46414 632.0681 37.28088 -30.56189      48.78376 
1 1 1 14  15 7  o 357.9013 35.01334 25.50398       4.804258      23.97759       5.890432      28.53682       8.303087  344.0966 45.17104 370.7182 59.69940 -26.62161      74.86281 
1 1 1 14  15 8  o 173.0391 57.91021 5.815398       4.577929      13.80016       5.471347      -12.82309      8.359273  256.4270 56.46896 119.9854 58.12070 136.4416       81.03555 
1 1 1 14  15 9  o 170.7968 61.84304 5.159921       5.277537      0.7648460      12.27530      6.156524       5.845344  198.5217 86.08034 182.9590 65.22406 15.56268       108.0000 
1 1 1 14  15 10 o 676.9713 23.32469 89.73177       6.132169      93.43017       14.14119      88.87525       6.805303  676.6660 54.26918 673.0481 26.03595 3.617859       60.19148 
1 1 1 14  15 11 o 414.4096 33.67062 34.17418       5.372016      24.04012       12.34513      36.54140       5.966543  324.0917 93.13930 427.8068 36.25360 -103.7151      99.94624 
1 1 1 14  15 12 o 133.8242 56.47589 0.7934399      5.029811      0.000000       0.000000      0.7934399      5.029811  ?        ?        133.8242 56.47589 0.000000       56.47589 
1 1 1 14  15 13 o 344.8123 38.47633 23.99126       5.064482      0.000000       0.000000      23.99126       5.064482  ?        ?        344.8123 38.47633 0.000000       38.47633 
1 1 1 14  15 14 o 749.1737 26.09964 110.4749       7.593554      0.000000       0.000000      110.4749       7.593554  ?        ?        749.1737 26.09964 0.000000       26.09964 
1 1 1 14  15 15 o 145.5002 54.39775 3.529982       4.138048      -3.632748      11.55675      4.583364       4.431894  172.7875 78.60166 157.8001 56.73605 14.98735       96.93916 
1 1 1 14  15 16 o 430.7842 27.91692 36.85005       4.645273      17.38216       11.61614      40.55597       5.068162  271.8936 92.24066 451.6007 29.05219 -179.7072      96.70765 
1 1 1 14  15 17 o 233.2385 48.18590 11.55926       4.220228      25.97785       11.64350      9.378570       4.528132  326.7298 89.24092 207.8423 55.17714 118.8874       104.9212 
1 1 1 14  15 18 f 119.0537 50.12125 0.8190497      3.946174      -15.71494      11.50569      3.023272       4.200988  138.2048 67.23286 139.9739 54.21036 -1.769119      86.36562 
1 1 1 14  15 19 o 367.9063 30.74139 27.20793       4.352024      20.53302       12.79991      28.08043       4.627726  282.6520 96.82207 373.1686 32.24953 -90.51666      102.0517 
1 1 1 14  16 0  o 578.4275 44.31636 67.25230       9.879274      67.25230       9.879274      0.000000       0.000000  578.4275 44.31636 ?        ?        0.000000       44.31636 
1 1 1 14  16 1  o 202.6232 78.52352 6.429768       8.818609      6.429768       8.818609      0.000000       0.000000  202.6232 78.52352 ?        ?        0.000000       78.52352 
1 1 1 14  16 2  o 350.8988 51.71469 25.29520       6.836026      29.54615       8.723355      18.53043       11.00442  375.6530 61.95573 289.8568 89.11108 85.79630       108.5325 
1 1 1 14  16 3  o 580.7419 27.17122 66.17918       6.128022      64.03420       7.227133      71.66667       11.55955  568.9839 32.84648 594.8649 50.51514 -25.88098      60.25505 
1 1 1 14  16 4  o 202.0863 62.71938 8.413433       5.436749      6.486944       7.082260      11.17767       8.483516  192.9073 71.35346 233.8422 78.83025 -40.93491      106.3274 
1 1 1 14  16 5  o 180.6037 60.62676 6.376458       5.017653      2.788258       6.563623      11.42215       7.783333  163.2885 66.28053 233.9257 75.36253 -70.63724      100.3624 
1 1 1 14  16 6  o 561.0486 25.04950 61.68428       5.457924      57.06504       7.115370      68.28722       8.507084  536.4533 34.33381 585.8560 37.58892 -49.40265      50.90911 
1 1 1 14  16 7  o 193.7379 57.38392 7.800219       4.623835      9.480993       5.736034      4.681494       7.813498  212.6820 64.12405 184.9704 73.24483 27.71155       97.34834 
1 1 1 14  16 8  o 326.7188 36.34788 21.40413       4.533737      22.05145       5.567555      20.13001       7.811067  329.1002 44.72025 305.8701 67.56048 23.23010       81.02048 
1 1 1 14  16 9  o 496.4562 30.38396 48.76699       5.829860      66.05930       13.52709      44.82243       6.460660  562.1577 63.04736 474.3166 35.32685 87.84106       72.27002 
1 1 1 14  16 10 o 412.2251 37.87154 34.08657       5.995033      0.000000       0.000000      34.08657       5.995033  ?        ?        412.2251 37.87154 0.000000       37.87154 
1 1 1 14  16 11 o 298.1964 47.06390 18.35501       5.269476      0.000000       0.000000      18.35501       5.269476  ?        ?        298.1964 47.06390 0.000000       47.06390 
1 1 1 14  16 12 o 388.7627 33.76676 30.21510       5.047388      0.000000       0.000000      30.21510       5.047388  ?        ?        388.7627 33.76676 0.000000       33.76676 
1 1 1 14  16 13 o 448.5402 26.71285 39.78732       4.632100      7.790765       12.18473      45.19258       5.008096  222.7895 90.35094 478.0159 27.08891 -255.2265      94.32444 
1 1 1 14  16 14 o 251.0639 43.21391 13.07100       4.061445      11.62591       11.21109      13.28931       4.357431  237.6993 89.40621 252.1279 46.20496 -14.42862      100.6398 
1 1 1 14  16 15 o 283.6795 37.82878 16.42908       4.063664      4.120132       11.67007      18.12749       4.334965  200.6676 85.41436 298.0016 38.34727 -97.33395      93.62759 
1 1 1 14  16 16 o 124.5808 50.93914 1.539365       3.912194      -1.652511      11.28657      1.975232       4.170763  174.5612 78.71169 131.0250 52.95701 43.53622       94.86819 
1 1 1 14  16 17 f 263.8499 42.10624 14.51071       4.169465      11.88978       11.70782      14.89140       4.462004  234.2829 90.56516 266.2405 44.74164 -31.95758      101.0142 
1 1 1 14  16 18 o 197.4007 51.81380 8.488115       4.022386      18.07252       11.57142      7.170802       4.289915  268.4730 92.05750 181.9847 55.58655 86.48830       107.5381 
1 1 1 14  17 0  f 588.9016 34.64738 68.92007       7.889028      68.92007       7.889028      0.000000       0.000000  588.9016 34.64738 ?        ?        0.000000       34.64738 
1 1 1 14  17 1  o 521.8817 37.11269 54.33548       7.472783      54.33548       7.472783      0.000000       0.000000  521.8817 37.11269 ?        ?        0.000000       37.11269 
1 1 1 14  17 2  o 487.3737 31.11992 47.03088       5.859439      49.74369       6.977500      40.54150       10.79176  499.6109 36.20736 438.1477 65.42716 61.46317       74.77758 
1 1 1 14  17 3  o 564.1744 27.67818 62.57259       6.064276      58.74699       7.370568      70.58909       10.66948  543.5731 35.10280 590.8427 46.88416 -47.26959      58.56902 
1 1 1 14  17 4  o 631.4889 25.64496 78.26576       6.289205      92.64105       9.148764      65.38567       8.659914  683.2475 34.59186 571.8954 39.22855 111.3521       52.30178 
1 1 1 14  17 5  o 504.3559 29.23382 50.25678       5.701431      55.67101       7.737617      43.82519       8.433312  527.8699 37.99858 464.3188 47.43464 63.55106       60.77777 
1 1 1 14  17 6  o 313.6356 42.25406 20.00089       5.015637      22.71786       6.509224      16.03015       7.869046  330.8903 52.40006 270.4019 73.16006 60.48846       89.98978 
1 1 1 14  17 7  o 183.2422 58.42101 6.868278       4.686585      10.85012       5.835644      -0.3651978     7.865389  225.0233 63.82988 156.6653 68.40556 68.35805       93.56053 
1 1 1 14  17 8  o 296.9494 41.91556 17.98341       4.699357      19.22206       5.981686      15.98624       7.595486  303.2659 52.70203 269.6819 71.39965 33.58395       88.74353 
1 1 1 14  17 9  o 350.9612 42.88900 25.08332       5.724027      0.000000       0.000000      25.08332       5.724027  ?        ?        350.9612 42.88900 0.000000       42.88900 
1 1 1 14  17 10 o 440.9615 32.72256 38.76697       5.563748      0.000000       0.000000      38.76697       5.563748  ?        ?        440.9615 32.72256 0.000000       32.72256 
1 1 1 14  17 11 o 321.5557 41.65220 21.11772       5.079200      0.000000       0.000000      21.11772       5.079200  ?        ?        321.5557 41.65220 0.000000       41.65220 
1 1 1 14  17 12 o 386.5029 29.40682 29.72949       4.380850      33.45537       12.13924      29.17158       4.697403  380.3299 84.39256 382.0041 31.95729 -1.674194      90.24064 
1 1 1 14  17 13 o 210.3175 47.44202 9.375630       3.782692      15.12199       11.55337      8.685674       4.003348  257.6995 91.71567 201.4981 51.08798 56.20140       104.9845 
1 1 1 14  17 14 o 97.95963 46.69519 -5.756969      4.920490      9.135843       10.94893      -9.525980      5.508039  220.2847 86.87026 93.69475 45.78465 126.5899       98.19713 
1 1 1 14  17 15 o 94.25584 42.44440 -1.327087      3.269159      5.863791       11.20678      -1.995918      3.417814  203.4384 84.97934 92.56506 42.35265 110.8734       94.94859 
1 1 1 14  17 16 o 153.2803 51.22317 4.779345       3.581669      -7.517946      11.65845      6.060947       3.763682  157.7285 74.19386 168.8447 52.14820 -11.11629      90.68717 
1 1 1 14  17 17 o 432.8734 31.17209 37.68758       5.205206      39.45449       12.57590      37.32231       5.717991  404.5675 82.83056 429.0524 34.61118 -24.48486      89.77101 
1 1 1 14  18 0  o 304.2773 64.13178 20.01888       7.339357      20.01888       7.339357      0.000000       0.000000  304.2773 64.13178 ?        ?        0.000000       64.13178 
1 1 1 14  18 1  o 508.1237 37.37256 51.73593       7.323044      51.73593       7.323044      0.000000       0.000000  508.1237 37.37256 ?        ?        0.000000       37.37256 
1 1 1 14  18 2  o 307.3475 46.93996 19.48756       5.425035      16.75728       6.576257      25.30357       9.598153  278.8241 62.30164 337.8610 75.09811 -59.03690      97.57674 
1 1 1 14  18 3  o 447.8438 32.57469 39.92975       5.626644      44.40851       6.930067      31.26622       9.638428  470.2680 38.27798 380.6452 67.68164 89.62280       77.75609 
1 1 1 14  18 4  o 134.0486 57.95386 -0.2507861E-01 5.531360      -5.001266      8.239179      4.058022       7.463295  140.5907 64.84837 176.6657 71.03793 -36.07503      96.18575 
1 1 1 14  18 5  f 630.2696 24.24556 78.02164       5.934534      80.24615       8.230642      75.61288       8.564721  635.1015 33.48887 615.2978 35.99950 19.80371       49.16776 
1 1 1 14  18 6  f 336.6720 42.06142 23.09654       5.379453      18.52073       7.485455      27.98396       7.736128  290.7818 67.57279 364.7727 56.43211 -73.99091      88.03786 
1 1 1 14  18 7  o 254.7522 49.60496 13.62876       4.731108      13.17798       6.242754      14.23700       7.251606  245.7209 64.57457 253.7193 70.86908 -7.998383      95.87649 
1 1 1 14  18 8  o 324.6030 36.75190 21.28849       4.551346      19.11987       6.036003      24.14642       6.929192  301.0076 53.59981 338.6541 54.53828 -37.64648      76.46806 
1 1 1 14  18 9  o 386.3096 26.16194 29.54228       3.901803      30.44032       5.566189      28.67468       5.471009  388.3962 37.36346 376.6563 37.91743 11.73993       53.23307 
1 1 1 14  18 10 o 692.6487 20.67149 94.07423       5.560487      88.18117       14.44454      95.09946       6.024784  647.2521 58.08298 695.8606 22.29417 -48.60852      62.21465 
1 1 1 14  18 11 o 447.7276 27.18019 39.75877       4.703643      6.095314       12.82379      44.99171       5.056030  215.3076 90.48294 476.2773 27.45147 -260.9696      94.55552 
1 1 1 14  18 12 o 209.6462 46.16123 9.315093       3.656608      9.954866       11.93107      9.248771       3.841468  228.0796 90.44793 208.2168 48.42186 19.86281       102.5939 
1 1 1 14  18 13 o 179.9093 48.25683 6.920305       3.441260      3.646997       11.19512      7.261868       3.616350  193.9605 83.13496 184.0177 49.51588 9.942780       96.76385 
1 1 1 14  18 14 o 159.9502 49.45170 5.379213       3.383534      8.491441       11.47465      5.082839       3.540976  215.7886 87.62042 156.7827 50.86535 59.00587       101.3145 
1 1 1 14  18 15 o 266.7210 33.32381 14.49371       3.376434      17.04188       11.50339      14.25348       3.532005  261.4863 91.66463 263.7045 35.38095 -2.218262      98.25587 
1 1 1 14  18 16 o 184.8619 46.05182 7.361420       3.293903      10.90559       11.64331      7.053093       3.434193  225.4028 89.36188 180.5368 48.11106 44.86598       101.4900 
1 1 1 14  19 0  o 237.9464 70.20428 12.58203       6.932051      12.58203       6.932051      0.000000       0.000000  237.9464 70.20428 ?        ?        0.000000       70.20428 
1 1 1 14  19 1  o 128.4600 58.93274 -3.645867      6.678417      -3.645867      6.678417      0.000000       0.000000  128.4600 58.93274 ?        ?        0.000000       58.93274 
1 1 1 14  19 2  o 260.4366 57.38868 14.61632       5.647844      13.07090       7.005611      17.48563       9.545782  242.5577 70.29551 275.3706 82.65390 -32.81291      108.5040 
1 1 1 14  19 3  o 823.0720 22.77388 133.0776       7.279521      143.6454       9.305947      116.4154       11.68515  852.5635 28.10644 760.0068 39.72827 92.55664       48.66526 
1 1 1 14  19 4  f 418.8434 39.51475 35.53930       6.351494      49.10878       10.53824      27.79798       7.959654  482.7093 57.33665 360.9706 58.80451 121.7387       82.13076 
1 1 1 14  19 5  o 308.6712 50.65528 19.99971       5.861539      25.06010       9.348070      16.72105       7.524502  333.7516 74.05786 273.3124 70.44604 60.43921       102.2116 
1 1 1 14  19 6  o 618.0357 26.12524 75.34690       6.270496      75.81628       9.108999      74.92414       8.644838  613.3291 38.43693 610.7271 36.61768 2.601990       53.08721 
1 1 1 14  19 7  o 560.2163 23.99237 61.77416       5.219837      51.03017       6.868978      76.45795       8.030235  504.1067 35.30956 618.4413 33.56070 -114.3346      48.71432 
1 1 1 14  19 8  o 482.9127 24.07209 45.92576       4.514508      41.30121       5.773579      53.20197       7.242079  454.0882 32.96457 513.9391 36.52248 -59.85092      49.19913 
1 1 1 14  19 9  o 322.7111 27.70242 20.75821       3.438181      25.95522       4.817161      15.36164       4.908777  358.5063 35.04750 269.8244 48.63412 88.68185       59.94668 
1 1 1 14  19 10 o 241.8375 45.34529 12.30650       4.102306      -0.1535147     11.73467      14.04127       4.378580  183.0207 81.56229 258.7650 45.21717 -75.74431      93.25771 
1 1 1 14  19 11 o 259.8823 37.87117 13.88919       3.709853      21.26732       12.03959      13.11515       3.899601  291.4885 93.71142 251.0626 41.44146 40.42589       102.4657 
1 1 1 14  19 12 o 153.9585 47.65619 4.955834       3.141229      2.239721       11.56270      5.172268       3.263986  188.7618 82.66570 157.0308 48.57371 31.73102       95.88025 
1 1 1 14  19 13 o 396.7635 20.88874 31.07310       3.207299      11.88993       11.94388      32.56387       3.329591  232.3981 91.01499 406.1008 21.18541 -173.7027      93.44811 
1 1 1 14  19 14 o 359.1312 67.56466 29.41730       9.077405      36.98063       12.82863      21.83327       12.84616  384.7130 87.80096 286.5242 97.00241 98.18878       130.8376 
1 1 1 14  19 15 o 160.3086 70.66008 0.6273814      8.571321      -1.044936      11.78753      2.503747       12.48596  175.4016 79.63316 191.3670 84.76810 -15.96536      116.3059 
1 1 1 14  20 0  o 270.0526 73.62748 16.83241       7.934052      16.83241       7.934052      0.000000       0.000000  270.0526 73.62748 ?        ?        0.000000       73.62748 
1 1 1 14  20 1  o 417.1364 50.76345 36.53214       8.053956      36.53214       8.053956      0.000000       0.000000  417.1364 50.76345 ?        ?        0.000000       50.76345 
1 1 1 14  20 2  o 311.8516 52.18230 20.66669       6.096445      24.05167       7.922437      15.75198       9.546173  330.2647 64.08039 259.1041 83.46043 71.16061       105.2233 
1 1 1 14  20 3  o 452.5614 42.23339 41.94461       7.336923      43.62428       11.11376      40.64709       9.767978  445.7709 66.20943 434.8845 59.38914 10.88647       88.94245 
1 1 1 14  20 4  o 391.4738 40.81720 31.34983       6.114201      36.67105       9.565443      27.67381       7.950400  411.2068 61.81086 357.8476 59.28420 53.35922       85.64577 
1 1 1 14  20 5  o 494.6199 29.38089 48.75711       5.618364      48.41795       7.832008      49.11667       8.064212  486.5667 41.85531 489.4987 42.85279 -2.931976      59.90182 
1 1 1 14  20 6  o 530.5826 25.62640 55.63489       5.280421      50.46083       7.052303      62.23689       7.966227  499.6130 36.60181 554.7554 37.19155 -55.14246      52.18145 
1 1 1 14  20 7  o 373.5492 31.50404 28.01849       4.527620      26.26389       5.839489      30.66315       7.169202  356.5821 43.03877 382.1522 49.46751 -25.57013      65.56958 
1 1 1 14  20 8  o 250.0118 42.50163 13.05946       3.978910      15.87652       5.111633      8.728247       6.338217  272.8550 50.08486 201.1178 68.13619 71.73729       84.56378 
1 1 1 14  20 9  f 96.74194 43.08475 -0.9284894     3.268769      -0.8754780E-01 3.981631      -2.666957      5.724814  112.8358 48.97574 120.3962 54.98221 -7.560486      73.63197 
1 1 1 14  20 10 o 296.4214 33.80732 17.86936       3.822160      7.918513       11.96862      18.99943       4.033357  213.7051 88.42050 305.4284 34.61517 -91.72336      94.95470 
1 1 1 14  20 11 f 333.7139 24.77340 22.17206       3.187701      29.85849       11.99757      21.58823       3.306549  343.6874 89.13519 328.8209 26.10813 14.86655       92.88011 
1 1 1 14  20 12 o 171.5491 73.51910 2.763243       8.752988      -0.4402329     11.86796      6.584195       12.96137  178.1125 80.47612 209.0837 89.53058 -30.97125      120.3833 
1 1 1 14  20 13 o 250.1692 78.99716 15.32965       8.585035      19.86673       12.03866      10.63484       12.24614  273.7112 93.89519 223.2137 90.55902 50.49741       130.4501 
1 1 1 14  20 14 o 187.6088 76.09080 6.179048       8.642885      9.378055       11.69436      2.328432       12.83022  215.0716 88.01990 191.0911 85.21249 23.98051       122.5099 
1 1 1 14  21 0  o 228.0102 75.06477 12.06954       7.701232      12.06954       7.701232      0.000000       0.000000  228.0102 75.06477 ?        ?        0.000000       75.06477 
1 1 1 14  21 1  o 165.0047 69.12297 2.982228       7.445284      2.982228       7.445284      0.000000       0.000000  165.0047 69.12297 ?        ?        0.000000       69.12297 
1 1 1 14  21 2  o 371.7654 39.06876 28.36876       5.556238      35.71367       6.817853      13.84402       9.587568  415.3360 42.88617 241.8164 83.74502 173.5196       94.08746 
1 1 1 14  21 3  o 209.4226 63.63243 9.803157       5.632431      7.828638       7.885794      11.85953       8.047591  197.7431 74.84602 227.2171 76.77731 -29.47400      107.2226 
1 1 1 14  21 4  o 108.6063 50.21776 -3.221075      4.985663      -0.3744568     6.781515      -6.569438      7.354926  142.0738 62.72511 123.1654 58.23768 18.90834       85.59245 
1 1 1 14  21 5  o 416.9168 31.07082 34.94300       4.994602      33.59103       6.697980      36.63636       7.496076  402.2346 43.57491 418.1182 46.97749 -15.88354      64.07540 
1 1 1 14  21 6  o 326.1839 37.58547 21.82938       4.674038      21.42327       6.207328      22.36114       7.103022  315.4638 52.51334 318.1046 59.68943 -2.640839      79.50144 
1 1 1 14  21 7  o 319.1924 36.48369 20.87048       4.441263      23.39699       5.737064      17.09199       7.015986  333.6329 45.46214 272.7545 66.77289 60.87848       80.78010 
1 1 1 14  21 8  o 174.8772 51.81070 6.629702       3.768943      1.655267       4.711478      15.47002       6.280861  132.9071 55.27303 260.9853 62.74295 -128.0782      83.61689 
1 1 1 14  21 9  o 475.4719 20.69376 44.55420       3.821133      45.08541       5.059008      43.84859       5.830545  474.8745 27.55048 465.7237 32.43942 9.150818       42.55990 
1 1 1 14  21 10 o 142.5997 48.96646 4.080761       3.274471      -10.85960      12.48281      5.184791       3.393300  152.7194 73.22278 156.3833 49.69538 -3.663895      88.49410 
1 1 1 14  21 11 o 324.3100 75.53102 25.43524       9.335714      23.87706       12.34709      27.51509       14.26500  295.9822 94.87381 309.9608 102.1683 -13.97855      139.4253 
1 1 1 14  21 12 o 529.4892 47.39946 59.44837       9.643595      56.11533       12.83238      63.77327       14.61754  492.4926 68.98632 518.4219 74.76585 -25.92929      101.7302 
1 1 1 14  22 0  o 247.7268 60.68785 14.03769       5.792479      10.88783       6.703472      23.32170       11.50858  215.4698 69.98995 295.1566 91.19415 -79.68672      114.9564 
1 1 1 14  22 1  o 223.2413 66.80855 11.63875       6.243440      11.63875       6.243440      0.000000       0.000000  223.2413 66.80855 ?        ?        0.000000       66.80855 
1 1 1 14  22 2  o 429.8105 33.23645 37.52579       5.504670      37.89554       6.480204      36.56752       10.43235  428.1740 39.41337 396.2061 70.37874 31.96790       80.66338 
1 1 1 14  22 3  o 147.6438 58.43819 3.398172       4.971714      8.296146       6.937751      -1.772472      7.128248  195.2234 70.87273 137.3001 62.17212 57.92334       94.27787 
1 1 1 14  22 4  o 188.7337 58.60158 7.931479       4.745690      2.398694       6.397143      14.70291       7.077086  151.9546 63.88570 248.7968 70.19411 -96.84213      94.91363 
1 1 1 14  22 5  o 115.9535 50.11366 0.2430754      4.133160      -4.530620      5.161223      8.777583       6.901040  104.4222 49.19413 198.6566 70.86436 -94.23444      86.26598 
1 1 1 14  22 6  o 165.5139 55.13840 5.845450       4.150743      8.548691       5.244733      1.314349       6.790206  194.6591 61.77460 148.6894 64.24726 45.96976       89.12807 
1 1 1 14  22 7  o 221.1629 47.03465 10.62166       3.915504      9.167074       5.084728      12.74081       6.137334  200.7799 60.33752 233.4080 65.19786 -32.62808      88.83343 
1 1 1 14  22 8  o 139.0039 50.48386 3.677126       3.520707      8.613239       4.623341      -3.136424      5.431879  195.3712 57.24622 113.1872 52.36436 82.18404       77.58322 
1 1 1 14  22 9  o 237.9102 34.88828 11.72978       3.127677      15.46514       4.074099      6.368697       4.880804  271.4043 39.83913 172.1928 59.74499 99.21149       71.80961 
1 1 1 14  22 10 o 334.1807 23.43969 22.27025       3.022764      24.97761       12.27695      22.09553       3.118774  299.1650 94.46815 332.5284 24.31924 -33.36340      97.54823 
1 1 1 14  22 11 o 150.1574 68.78654 -2.224368      9.053103      -6.090525      12.15870      2.585701       13.56198  159.7258 75.32658 191.9622 86.44553 -32.23634      114.6600 
1 1 1 14  23 0  o 193.6309 62.43440 8.728914       5.341117      11.19477       6.370913      2.896506       9.798105  215.0287 68.06824 172.6239 75.83492 42.40485       101.9030 
1 1 1 14  23 1  o 404.5511 42.25327 34.58851       6.540415      34.58851       6.540415      0.000000       0.000000  404.5511 42.25327 ?        ?        0.000000       42.25327 
1 1 1 14  23 2  o 403.9422 32.60126 33.35218       5.070678      36.15673       5.914399      25.57193       9.850899  417.8578 36.82272 315.3456 80.24081 102.5122       88.28648 
1 1 1 14  23 3  o 434.4025 32.00050 38.46072       5.360538      33.20380       6.869534      46.64597       8.571898  393.9623 45.75172 465.3821 48.12361 -71.41977      66.40107 
1 1 1 14  23 4  o 160.1071 57.93419 5.292257       4.630368      0.3341510      5.938903      12.97854       7.394462  134.4483 59.05295 228.9599 73.42363 -94.51163      94.22462 
1 1 1 14  23 5  o 91.34174 43.19719 -3.891550      4.049503      -1.935381      5.080416      -7.299716      6.705891  113.8604 51.91893 111.6232 53.55840 2.237160       74.59275 
1 1 1 14  23 6  o 125.6377 52.80120 1.405634       4.367143      1.405634       4.367143      0.000000       0.000000  125.6377 52.80120 ?        ?        0.000000       52.80120 
1 1 1 14  23 7  o 181.5815 49.94519 7.347762       3.632124      3.671024       4.591875      13.49305       5.936491  145.3219 56.56593 239.0172 63.04659 -93.69528      84.70287 
1 1 1 14  23 8  o 123.7979 48.62490 2.344530       3.417576      6.038573       4.474147      -2.829960      5.295331  166.7397 57.23887 112.1374 51.81649 54.60233       77.20905 
1 1 1 14  23 9  o 139.8097 46.32886 4.079425       2.931778      -3.870087      4.048298      12.84692       4.251480  91.38330 43.20884 242.6157 46.81860 -151.2324      63.71016 
1 1 1 14  24 0  o 248.0722 55.60127 14.32109       5.224069      11.93404       6.065395      21.17978       10.28132  219.0330 65.91697 270.4796 86.56103 -51.44662      108.8019 
1 1 1 14  24 1  o 148.0793 61.05938 3.347626       5.680349      3.347626       5.680349      0.000000       0.000000  148.0793 61.05938 ?        ?        0.000000       61.05938 
1 1 1 14  24 2  o 379.9212 37.17154 30.24369       5.414176      38.89793       6.595063      12.35536       9.481771  428.7562 40.07242 216.4887 82.04002 212.2675       91.30369 
1 1 1 14  24 3  o 145.9614 58.03822 3.669881       4.924754      3.198723       6.497352      4.306047       7.549861  152.9773 64.35348 165.2833 69.44185 -12.30602      94.67598 
1 1 1 14  24 4  o 144.0221 55.85087 3.775498       4.463604      7.518216       5.621148      -2.612374      7.343609  180.9097 64.01770 132.2378 61.07505 48.67183       88.47840 
1 1 1 14  24 5  o 219.0375 51.56507 10.87860       4.313596      11.17078       5.472711      10.39932       7.009214  216.0387 61.99232 205.4566 71.57872 10.58206       94.69193 
1 1 1 14  24 6  o 303.0726 33.02124 18.96799       3.823687      15.63310       4.569442      26.75778       6.983696  267.8271 45.56371 345.1612 53.85822 -77.33411      70.54615 
1 1 1 14  25 0  o 108.8673 50.30859 -2.223057      4.992756      -1.914060      5.734582      -3.190978      10.14951  117.9864 54.30547 146.8462 69.12116 -28.85985      87.90232 
1 1 1 14  25 1  f 216.3201 64.31818 11.74766       5.800584      11.74766       5.800584      0.000000       0.000000  216.3201 64.31818 ?        ?        0.000000       64.31818 
1 1 1 14  25 2  o 434.9323 34.54768 39.43870       5.787306      39.43870       5.787306      0.000000       0.000000  434.9323 34.54768 ?        ?        0.000000       34.54768 
1 1 1 15  0  0  o 1243.101 23.90395 301.0335       11.53033      301.0335       11.53033      301.0335       11.53033  1243.101 23.90395 1243.101 23.90395 0.000000       0.000000 
1 1 1 15  0  1  o 319.3293 49.48410 21.33124       5.697879      21.33124       5.697879      21.33124       5.697879  319.3293 49.48410 319.3293 49.48410 0.000000       0.000000 
1 1 1 15  0  2  o 356.2515 45.16498 25.98099       5.975095      25.98099       5.975095      25.98099       5.975095  356.2515 45.16498 356.2515 45.16498 0.000000       0.000000 
1 1 1 15  0  3  o 137.0904 74.06514 5.304522       5.497507      5.304522       5.497507      5.304522       5.497507  137.0904 74.06514 137.0904 74.06514 0.000000       0.000000 
1 1 1 15  0  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 15  0  5  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 15  0  6  o 155.3352 83.01408 6.948504       6.836089      6.948504       6.836089      6.948504       6.836089  155.3352 83.01408 155.3352 83.01408 0.000000       0.000000 
1 1 1 15  0  7  o 647.6406 32.71764 82.46319       8.181021      82.46319       8.181021      82.46319       8.181021  647.6406 32.71764 647.6406 32.71764 0.000000       0.000000 
1 1 1 15  0  8  o 680.4553 32.19370 90.96627       8.464038      90.96627       8.464038      90.96627       8.464038  680.4553 32.19370 680.4553 32.19370 0.000000       0.000000 
1 1 1 15  0  9  o 595.7711 34.78097 70.05952       7.984509      70.05952       7.984509      70.05952       7.984509  595.7711 34.78097 595.7711 34.78097 0.000000       0.000000 
1 1 1 15  0  10 o 545.9800 37.11880 59.12355       7.786923      59.12355       7.786923      59.12355       7.786923  545.9800 37.11880 545.9800 37.11880 0.000000       0.000000 
1 1 1 15  0  11 o 197.3528 94.82931 11.65104       8.398505      11.65104       8.398505      11.65104       8.398505  197.3528 94.82931 197.3528 94.82931 0.000000       0.000000 
1 1 1 15  0  12 o 714.9730 52.37858 102.5259       14.36418      102.5259       14.36418      102.5259       14.36418  714.9730 52.37858 714.9730 52.37858 0.000000       0.000000 
1 1 1 15  0  13 o 881.3489 31.65372 152.4402       10.80260      152.4402       10.80260      152.4402       10.80260  881.3489 31.65372 881.3489 31.65372 0.000000       0.000000 
1 1 1 15  0  14 o 701.7738 34.78458 97.20068       9.426954      97.20068       9.426954      97.20068       9.426954  701.7738 34.78458 701.7738 34.78458 0.000000       0.000000 
1 1 1 15  0  15 o 294.0115 80.89285 20.88594       7.987055      20.88594       7.987055      20.88594       7.987055  294.0115 80.89285 294.0115 80.89285 0.000000       0.000000 
1 1 1 15  0  16 o 263.4710 86.57883 18.03978       7.859842      18.03978       7.859842      18.03978       7.859842  263.4710 86.57883 263.4710 86.57883 0.000000       0.000000 
1 1 1 15  0  17 o 596.0525 37.24121 70.93932       8.543447      70.93932       8.543447      70.93932       8.543447  596.0525 37.24121 596.0525 37.24121 0.000000       0.000000 
1 1 1 15  0  18 o 127.3637 77.50347 3.726540       7.184258      3.726540       7.184258      3.726540       7.184258  127.3637 77.50347 127.3637 77.50347 0.000000       0.000000 
1 1 1 15  0  19 o 384.0988 54.80561 31.64251       7.693290      31.64251       7.693290      31.64251       7.693290  384.0988 54.80561 384.0988 54.80561 0.000000       0.000000 
1 1 1 15  0  20 o 106.5693 69.31730 0.6209787      6.906947      0.6209787      6.906947      0.6209787      6.906947  106.5693 69.31730 106.5693 69.31730 0.000000       0.000000 
1 1 1 15  0  21 o 630.2059 33.64857 79.88104       8.181624      79.88104       8.181624      79.88104       8.181624  630.2059 33.64857 630.2059 33.64857 0.000000       0.000000 
1 1 1 15  0  22 o 293.7498 69.34805 21.07107       6.870478      21.07107       6.870478      21.07107       6.870478  293.7498 69.34805 293.7498 69.34805 0.000000       0.000000 
1 1 1 15  0  23 o 100.3658 65.91673 0.6440533      6.470844      0.6440533      6.470844      0.6440533      6.470844  100.3658 65.91673 100.3658 65.91673 0.000000       0.000000 
1 1 1 15  1  0  o 868.9781 17.64084 147.1005       5.953277      143.4459       8.326473      150.9226       8.515106  856.7224 25.02609 878.7830 24.95057 -22.06061      35.33887 
1 1 1 15  1  1  o 841.6430 17.78579 137.9796       5.813385      137.5847       8.105916      138.3978       8.341896  839.1843 24.87235 841.5236 25.52528 -2.339355      35.63950 
1 1 1 15  1  2  o 701.5977 19.11130 95.91424       5.207226      103.7727       7.468848      88.48152       7.263695  728.6282 26.39488 672.5631 27.80972 56.06506       38.34149 
1 1 1 15  1  3  o 690.3382 18.82974 92.84068       5.048173      88.66280       6.880707      97.71117       7.429190  673.5840 26.30349 706.9897 27.05829 -33.40570      37.73625 
1 1 1 15  1  4  o 231.0680 50.14585 10.99351       4.370671      8.705817       5.223657      16.33347       7.980767  206.4355 60.95246 278.3649 72.94439 -71.92944      95.05833 
1 1 1 15  1  5  o 277.1941 46.94725 15.60703       4.873446      13.51434       6.895545      17.69554       6.888646  254.1846 68.36510 291.6185 62.69086 -37.43390      92.75738 
1 1 1 15  1  6  o 533.3608 26.29307 55.58038       5.446160      52.16422       7.426737      59.55460       8.010405  513.7686 37.48082 549.0531 37.79775 -35.28448      53.23046 
1 1 1 15  1  7  o 641.8475 23.33769 80.39359       5.817251      81.26991       8.040211      79.43090       8.427090  643.9035 32.15279 635.2765 34.28450 8.627014       47.00244 
1 1 1 15  1  8  o 816.7869 20.05199 130.0309       6.360544      134.5861       9.143785      125.7603       8.853569  829.4107 28.38758 801.7442 28.43509 27.66650       40.17971 
1 1 1 15  1  9  o 342.4320 39.15485 23.38796       5.113397      17.46073       7.009696      30.12937       7.475645  288.9763 64.13551 386.0289 51.12329 -97.05267      82.01801 
1 1 1 15  1  10 o 478.4758 36.27068 45.26615       6.689624      55.12632       7.807236      18.03146       12.97527  527.7551 38.35447 294.4156 97.45938 233.3394       104.7349 
1 1 1 15  1  11 o 571.7571 33.16553 64.36016       7.332579      85.87283       13.07954      54.50006       8.854948  654.6706 51.86941 523.1732 43.99086 131.4974       68.01200 
1 1 1 15  1  12 o 526.2103 31.54562 54.47316       6.416793      55.77980       9.121859      53.19319       9.028296  529.0721 44.81683 516.3748 45.48517 12.69727       63.85490 
1 1 1 15  1  13 f 652.1898 26.40472 83.16470       6.687803      69.63235       9.367136      97.23505       9.551523  592.5817 40.95468 703.3878 34.96631 -110.8062      53.85099 
1 1 1 15  1  14 o 684.7941 29.05535 91.86143       7.727057      93.61943       13.59910      91.02324       9.390167  683.1189 51.64232 679.2452 35.72295 3.873657       62.79377 
1 1 1 15  1  15 o 405.2589 37.37782 32.66034       5.816376      36.96560       8.172832      28.24208       8.279400  427.5399 50.17702 369.8111 59.68085 57.72888       77.97139 
1 1 1 15  1  16 o 321.2017 45.88985 20.94915       5.561578      19.61692       7.921675      22.24409       7.810031  303.3454 68.82310 325.0689 64.14351 -21.72351      94.07980 
1 1 1 15  1  17 o 596.9746 26.27038 69.88026       6.090461      63.56359       8.545118      76.40237       8.682961  564.7296 39.20564 620.5153 36.18895 -55.78571      53.35469 
1 1 1 15  1  18 o 477.4992 30.99345 45.12824       5.716310      37.38887       7.888368      53.68634       8.295126  428.5663 48.23430 517.2051 41.65133 -88.63889      63.72897 
1 1 1 15  1  19 o 334.7241 41.25758 22.71220       5.249618      21.24961       7.353675      24.23218       7.496549  315.6011 62.20982 338.9098 59.10667 -23.30875      85.81178 
1 1 1 15  1  20 o 169.6374 60.37043 5.404613       5.005688      4.221243       6.935844      6.691071       7.231641  173.5798 68.92181 192.5246 71.92513 -18.94479      99.61647 
1 1 1 15  1  21 o 545.8105 26.33109 58.75095       5.581343      56.31861       7.791769      61.31421       7.998723  528.6838 38.20728 552.0800 37.52985 -23.39612      53.55638 
1 1 1 15  1  22 o 206.8805 57.94260 9.301294       4.840640      17.88781       7.062457      1.693580       6.647747  283.7473 65.42845 153.6046 64.88078 130.1427       92.14336 
1 1 1 15  1  23 o 135.8847 55.21738 2.087563       4.561141      14.56168       6.548743      -9.664607      6.356411  254.4957 65.78104 103.5136 50.26752 150.9821       82.78870 
1 1 1 15  2  0  o 613.5975 21.15809 73.44699       5.041828      69.60219       6.965800      77.67752       7.306864  595.1467 30.23767 629.5778 29.88503 -34.43103      42.51390 
1 1 1 15  2  1  o 557.1649 22.61649 60.58486       4.893695      62.58750       6.957034      58.62349       6.884988  564.0208 31.89218 545.6381 32.64135 18.38263       45.63517 
1 1 1 15  2  2  o 557.3420 21.53296 60.58431       4.660725      52.33160       6.261408      70.83825       6.979415  515.7849 31.40865 601.4387 29.88131 -85.65381      43.35200 
1 1 1 15  2  3  o 343.7817 44.95438 23.75001       5.858061      0.000000       0.000000      23.75001       5.858061  ?        ?        343.7817 44.95438 0.000000       44.95438 
1 1 1 15  2  4  f 616.4791 27.34802 74.29597       6.547451      69.08794       8.106648      84.06740       11.10410  592.1122 35.41655 650.8321 44.19447 -58.71991      56.63464 
1 1 1 15  2  5  f 719.1637 30.60464 101.2722       8.547579      101.2722       8.547579      0.000000       0.000000  719.1637 30.60464 ?        ?        0.000000       30.60464 
1 1 1 15  2  6  o 639.7676 23.41519 79.87268       5.817655      74.68078       7.882094      86.08577       8.622481  616.2538 33.05531 661.6086 33.66975 -45.35486      47.18375 
1 1 1 15  2  7  o 257.4171 51.11127 13.61284       4.929327      3.602521       6.772612      24.88931       7.188177  172.4336 68.21989 349.3542 54.78311 -176.9205      87.49368 
1 1 1 15  2  8  o 690.6542 22.15492 93.05302       5.942359      98.11568       8.297585      87.72266       8.514129  707.7942 30.18678 668.7457 32.78319 39.04846       44.56432 
1 1 1 15  2  9  o 623.3738 33.48520 76.48126       8.076735      76.48126       8.076735      0.000000       0.000000  623.3738 33.48520 ?        ?        0.000000       33.48520 
1 1 1 15  2  10 o 995.7449 22.43768 193.4687       8.676688      201.8505       15.92067      189.9272       10.34862  1011.539 40.52760 985.5067 27.03927 26.03186       48.71969 
1 1 1 15  2  11 o 411.7030 36.29836 33.58113       5.744226      36.69928       11.84440      32.62220       6.568369  417.7769 75.79428 404.2556 42.47326 13.52136       86.88354 
1 1 1 15  2  12 f 878.7927 23.60945 150.7716       8.057500      0.000000       0.000000      150.7716       8.057500  ?        ?        878.7927 23.60945 0.000000       23.60945 
1 1 1 15  2  13 o 489.6406 32.45954 47.24374       6.137309      47.34325       8.801984      47.14959       8.561925  486.2525 47.20610 485.6353 45.94357 0.6171875      65.87282 
1 1 1 15  2  14 o 1056.323 20.34630 217.6139       8.346610      211.6845       11.74938      223.6546       11.85916  1039.467 29.10559 1068.623 28.57599 -29.15637      40.78875 
1 1 1 15  2  15 f 755.0577 27.15454 111.6509       7.962522      94.65278       13.59723      120.5222       9.822984  685.9788 51.41412 783.1030 32.29956 -97.12421      60.71798 
1 1 1 15  2  16 o 174.0532 70.88495 3.078403       7.537924      0.000000       0.000000      3.078403       7.537924  ?        ?        174.0532 70.88495 0.000000       70.88495 
1 1 1 15  2  17 o 299.7180 48.60535 18.44651       5.463731      11.55936       7.645275      25.63577       7.811161  234.7330 74.59362 350.3649 59.53775 -115.6319      95.44083 
1 1 1 15  2  18 o 197.7063 61.69663 8.083150       5.252777      6.730403       7.248934      9.578801       7.622211  194.7626 72.15870 217.8751 74.71436 -23.11250      103.8707 
1 1 1 15  2  19 f 454.0666 31.87573 40.94955       5.585304      41.22732       7.720354      40.64452       8.090247  450.8404 44.68317 446.4452 47.38668 4.395203       65.13127 
1 1 1 15  2  20 o 211.5765 59.68128 9.595629       5.116508      4.538300       7.122342      14.98866       7.354930  176.9077 69.96891 260.3705 70.84861 -83.46281      99.57497 
1 1 1 15  2  21 o 164.8321 60.09280 4.978026       4.995347      -0.9073284     6.879732      11.54096       7.264975  142.8156 63.10880 229.1279 72.70432 -86.31230      96.27377 
1 1 1 15  2  22 o 311.6535 42.05512 20.01146       4.960031      21.23939       7.135711      18.86353       6.899343  312.0448 61.06984 292.9010 62.55503 19.14380       87.42229 
1 1 1 15  2  23 o 510.7689 52.31135 54.90212       10.23005      0.000000       0.000000      54.90212       10.23005  ?        ?        510.7689 52.31135 0.000000       52.31135 
1 1 1 15  3  0  o 604.9243 21.47023 71.39503       5.043892      74.24921       6.978886      68.27379       7.298098  615.6582 29.18895 588.9997 32.02595 26.65851       43.33193 
1 1 1 15  3  1  o 770.6026 18.97750 115.7209       5.679334      113.2913       7.830564      118.4173       8.249375  761.1830 26.48964 778.0450 27.30161 -16.86206      38.04049 
1 1 1 15  3  2  o 389.2696 33.67929 29.95852       5.041287      30.30942       8.358983      29.75793       6.320041  385.1625 57.65627 385.8300 42.90562 -0.6675110     71.86889 
1 1 1 15  3  3  o 602.8950 26.88757 71.05602       6.295369      57.36784       7.573863      101.6501       11.32304  539.0413 36.39303 716.8597 40.84158 -177.8184      54.70363 
1 1 1 15  3  4  o 505.5695 25.43945 50.04977       4.978817      50.24603       5.891553      49.55943       9.312389  505.7125 30.13515 497.5690 48.82139 8.143524       57.37294 
1 1 1 15  3  5  o 338.2895 32.53703 22.63667       4.221863      22.55182       5.162986      22.80791       7.334463  336.0029 40.37511 333.0038 58.86740 2.999023       71.38291 
1 1 1 15  3  6  o 825.2255 20.38344 132.7429       6.532481      135.4565       9.208525      129.9939       9.268413  832.0967 28.49629 814.9752 29.28417 17.12146       40.86075 
1 1 1 15  3  7  o 703.7052 31.05322 97.03115       8.486438      97.03115       8.486438      0.000000       0.000000  703.7052 31.05322 ?        ?        0.000000       31.05322 
1 1 1 15  3  8  o 351.1991 43.79045 24.74477       5.842803      30.88491       7.299096      13.79227       9.748477  391.4726 49.09040 259.7348 84.40395 131.7378       97.64166 
1 1 1 15  3  9  f 190.6667 58.33511 7.338050       4.722385      4.506981       6.724230      10.09333       6.633615  178.0842 68.69253 222.6586 69.30880 -44.57442      97.58265 
1 1 1 15  3  10 o 450.9637 33.50175 40.13579       5.825371      31.61905       12.46801      42.51419       6.588757  383.2495 85.89579 463.4209 36.91620 -80.17142      93.49274 
1 1 1 15  3  11 o 312.8818 51.61070 19.97415       6.052475      28.50202       11.43233      16.65310       7.134311  364.6758 82.63528 281.5280 66.34099 83.14771       105.9704 
1 1 1 15  3  12 o 394.8597 37.62833 30.96192       5.700323      42.64458       12.01125      27.56574       6.476085  453.1122 70.55453 370.2808 46.02849 82.83145       84.24110 
1 1 1 15  3  13 o 678.8081 25.84015 90.07973       6.811929      81.99207       9.699701      97.95038       9.568679  643.7359 38.98298 705.8845 34.90522 -62.14862      52.32635 
1 1 1 15  3  14 o 855.4202 22.33046 142.8531       7.418311      158.4212       10.78226      128.8602       10.22228  898.6287 30.89595 810.0238 32.49540 88.60486       44.83872 
1 1 1 15  3  15 o 486.7766 31.85866 46.75764       5.989393      46.19678       8.455639      47.32240       8.484998  479.7415 45.94689 485.7457 45.51004 -6.004242      64.67056 
1 1 1 15  3  16 o 116.2378 53.51991 -3.863055      5.576688      2.511050       7.970887      -9.974586      7.804985  174.2788 72.13699 121.6297 58.20620 52.64902       92.69146 
1 1 1 15  3  17 o 152.3618 63.81419 1.395527       6.343550      -1.296653      11.14135      2.686937       7.716451  182.0177 80.37733 172.4685 71.14703 9.549255       107.3425 
1 1 1 15  3  18 o 384.3182 38.11597 29.62622       5.613837      28.65086       7.796481      30.67639       8.089981  371.3205 55.79060 384.4326 55.81916 -13.11215      78.92003 
1 1 1 15  3  19 o 604.0267 25.85323 71.70765       6.064556      64.57935       8.303747      79.85632       8.878196  568.1703 37.84949 632.7858 36.27911 -64.61548      52.42860 
1 1 1 15  3  20 o 183.3623 61.80496 6.782063       5.214782      6.910097       7.300068      6.648648       7.451907  194.1421 72.31672 193.0627 72.83383 1.079422       102.6376 
1 1 1 15  3  21 o 337.5221 41.44185 23.30202       5.317999      20.26743       7.467460      26.42485       7.575271  303.6508 65.26671 352.1499 57.36651 -48.49911      86.89453 
1 1 1 15  3  22 o 728.0116 25.69345 104.6738       7.264215      101.1337       8.916820      111.6597       12.52596  712.1635 32.24054 739.0331 43.83936 -26.86969      54.41822 
1 1 1 15  3  23 o 231.2046 61.76308 11.88290       5.650872      18.64160       7.207286      1.098648       9.104064  288.2343 65.83109 169.3393 73.77658 118.8950       98.87728 
1 1 1 15  4  0  o 329.2244 42.79714 21.78368       5.342458      29.40913       9.026093      17.67163       6.628209  376.6613 63.99471 291.2061 60.58235 85.45523       88.12233 
1 1 1 15  4  1  o 306.9808 56.54105 19.42543       6.492305      0.000000       0.000000      19.42543       6.492305  ?        ?        306.9808 56.54105 0.000000       56.54105 
1 1 1 15  4  2  o 690.9453 28.09641 93.41090       7.539151      0.000000       0.000000      93.41090       7.539151  ?        ?        690.9453 28.09641 0.000000       28.09641 
1 1 1 15  4  3  o 234.9620 63.04494 11.50579       5.872364      4.618071       7.097877      26.44870       10.45462  181.9056 70.46049 352.7265 78.35757 -170.8209      105.3783 
1 1 1 15  4  4  o 744.4366 24.33804 108.2059       7.036252      109.9503       8.911351      105.3178       11.46635  749.2106 30.62751 729.7792 40.61903 19.43146       50.87189 
1 1 1 15  4  5  o 541.4385 29.51325 57.55482       6.182329      64.66448       7.896084      46.29192       9.938311  572.6000 35.68599 478.8494 54.40831 93.75055       65.06731 
1 1 1 15  4  6  o 434.9798 45.60904 37.84840       7.589936      37.84840       7.589936      0.000000       0.000000  434.9798 45.60904 ?        ?        0.000000       45.60904 
1 1 1 15  4  7  o 513.3174 29.04242 51.74186       5.765836      51.71875       7.430186      51.77682       9.141517  511.2624 37.68779 509.0228 46.76677 2.239563       60.06247 
1 1 1 15  4  8  o 582.9832 27.98481 66.50140       6.335872      72.95996       8.224243      57.07173       9.937479  608.3740 34.95634 533.9927 48.44693 74.38129       59.74153 
1 1 1 15  4  9  o 874.0662 20.09064 148.9424       6.819713      152.4360       9.727048      145.5648       9.564077  882.5115 28.38132 862.3497 28.55826 20.16180       40.26256 
1 1 1 15  4  10 o 444.9776 37.89496 39.26472       6.486208      17.02571       12.37881      47.68124       7.615310  286.6948 95.20686 490.0081 40.37759 -203.3132      103.4152 
1 1 1 15  4  11 o 247.6377 63.80342 12.84290       6.174066      4.027256       11.08039      16.81243       7.435285  207.7852 85.43170 282.4058 68.49764 -74.62057      109.5012 
1 1 1 15  4  12 f 505.1575 30.09911 50.17176       5.878057      58.14662       12.22534      47.77379       6.703796  534.7552 59.89653 491.7356 35.34006 43.01968       69.54505 
1 1 1 15  4  13 o 585.0331 26.20541 66.93369       5.953872      66.73547       9.048762      67.08502       7.906463  580.0076 40.42514 583.0499 35.08124 -3.042297      53.52462 
1 1 1 15  4  14 o 846.4755 31.58126 140.6742       10.38178      140.6742       10.38178      0.000000       0.000000  846.4755 31.58126 ?        ?        0.000000       31.58126 
1 1 1 15  4  15 o 539.1624 29.83399 57.23111       6.222524      49.02804       8.775258      65.52727       8.824908  494.0450 46.27592 574.0543 39.83131 -80.00928      61.05730 
1 1 1 15  4  16 o 220.2876 62.50642 10.20663       5.595240      3.643612       7.779657      17.23922       8.053155  179.0844 72.34558 282.6372 72.89354 -103.5528      102.7003 
1 1 1 15  4  17 o 537.0724 30.05900 56.94711       6.244366      46.77765       8.756693      67.46859       8.906959  480.5440 47.54608 581.2928 39.69267 -100.7488      61.93656 
1 1 1 15  4  18 o 437.1092 40.58728 38.42441       6.811179      34.93307       11.70264      40.21296       8.376043  398.8332 78.35027 443.6488 49.45688 -44.81564      92.65391 
1 1 1 15  4  19 o 461.3200 32.18775 42.31687       5.730474      48.81631       8.100655      35.80632       8.107579  491.3401 42.88293 416.6805 51.17849 74.65955       66.76963 
1 1 1 15  4  20 o 127.0299 55.63305 -0.5763525     5.237320      -1.223392      7.266767      0.1230377      7.555018  145.7073 64.59937 154.8828 67.34489 -9.175522      93.31889 
1 1 1 15  4  21 o 109.7140 51.94582 -6.054502      5.887707      -9.803901      7.127699      1.998864       10.44618  112.4806 54.28639 184.7592 79.76047 -72.27856      96.48183 
1 1 1 15  4  22 o 339.8945 46.36327 24.05832       5.960279      26.84904       7.500175      19.27533       9.818894  353.9537 56.45992 284.7099 83.42638 69.24377       100.7357 
1 1 1 15  4  23 o 121.1959 53.32378 -0.5670685     4.860767      7.030655       7.130750      -7.161788      6.643419  190.5093 71.37257 114.1468 54.36893 76.36256       89.72192 
1 1 1 15  5  0  o 244.3477 48.68631 12.27516       4.457785      6.166481       5.969044      19.97878       6.703140  185.2791 65.92555 310.8817 57.64329 -125.6026      87.57241 
1 1 1 15  5  1  o 468.0471 30.85015 43.12962       5.576128      54.86812       9.488047      36.93603       6.891947  523.7167 47.15576 430.4351 41.75453 93.28168       62.98497 
1 1 1 15  5  2  o 297.9770 56.27452 18.31296       6.273436      9.755060       7.527398      37.77500       11.35156  222.5249 74.25877 425.6458 71.18586 -203.1208      102.8678 
1 1 1 15  5  3  o 439.2827 60.77743 39.45626       10.09070      0.000000       0.000000      39.45626       10.09070  ?        ?        439.2827 60.77743 0.000000       60.77743 
1 1 1 15  5  4  o 367.2730 52.72141 27.39152       7.304127      27.39152       7.304127      0.000000       0.000000  367.2730 52.72141 ?        ?        0.000000       52.72141 
1 1 1 15  5  5  o 706.8923 25.60518 97.64790       7.029251      94.72992       8.862097      102.5980       11.54256  694.8326 32.84190 719.7661 41.46912 -24.93347      52.89875 
1 1 1 15  5  6  f 793.8987 37.75433 124.0991       11.64018      0.000000       0.000000      124.0991       11.64018  ?        ?        793.8987 37.75433 0.000000       37.75433 
1 1 1 15  5  7  o 357.8770 40.44941 25.57860       5.523104      27.18607       7.378739      23.53044       8.329005  365.4654 53.57968 335.6127 66.25552 29.85272       85.20901 
1 1 1 15  5  8  o 152.9614 60.58811 2.747099       5.347955      7.554097       6.860919      -4.695854      8.537250  201.8969 70.79044 147.8140 67.36325 54.08290       97.71947 
1 1 1 15  5  9  o 356.3068 48.19870 25.65073       6.498229      31.51750       11.90641      23.16182       7.755084  383.5937 82.38361 334.1470 62.04562 49.44669       103.1345 
1 1 1 15  5  10 f 301.6763 55.49272 18.74161       6.261807      22.29556       11.69165      17.31213       7.414944  320.8540 90.11587 286.6453 67.69118 34.20865       112.7074 
1 1 1 15  5  11 o 574.9179 31.06869 64.98626       6.911012      33.72224       12.35205      79.23317       8.338291  396.9759 82.80102 634.2443 33.97610 -237.2684      89.50075 
1 1 1 15  5  12 o 326.7671 52.34375 21.79824       6.418270      16.61215       11.87241      23.93975       7.629196  282.7091 93.20831 340.4421 59.89095 -57.73300      110.7913 
1 1 1 15  5  13 o 774.0001 25.98672 117.1666       7.811249      107.5619       13.68442      121.8086       9.513385  733.7075 48.29588 787.9670 31.08845 -54.25958      57.43678 
1 1 1 15  5  14 o 417.4018 71.72430 36.66375       11.20749      0.000000       0.000000      36.66375       11.20749  ?        ?        417.4018 71.72430 0.000000       71.72430 
1 1 1 15  5  15 o 548.2733 28.84930 59.15030       6.121107      61.72985       8.747675      56.67549       8.568219  556.5448 40.75637 532.8175 41.74179 23.72729       58.33917 
1 1 1 15  5  16 o 536.8741 29.50449 56.82452       6.128006      57.86054       8.646577      55.77899       8.686175  537.7665 41.72888 527.5604 42.76434 10.20618       59.75021 
1 1 1 15  5  17 o 112.4247 52.09290 -4.128964      5.406626      -6.771599      7.596576      -1.416241      7.696654  128.6822 60.32488 150.8436 66.69871 -22.16141      89.93224 
1 1 1 15  5  18 o 271.1745 54.35689 15.47753       5.525073      17.39949       7.915235      13.65117       7.715845  281.6426 72.06882 250.2336 74.13009 31.40903       103.3885 
1 1 1 15  5  19 o 155.8095 66.42833 1.033264       7.079452      5.600662       10.38023      -2.938786      9.680105  204.1236 83.16271 161.4333 72.83408 42.69029       110.5479 
1 1 1 15  5  20 o 549.5851 32.55096 60.20216       6.916516      66.32214       8.696047      49.66447       11.41089  573.6302 39.27200 482.7158 62.32516 90.91443       73.66624 
1 1 1 15  5  21 o 150.0612 61.87454 2.273963       5.832788      4.446503       7.219564      -1.809466      9.897821  175.0342 70.04934 165.0134 74.12143 10.02086       101.9848 
1 1 1 15  5  22 o 444.3298 32.10362 39.59139       5.502429      37.21556       7.866182      41.86771       7.699707  422.0868 48.89355 450.5368 44.59190 -28.45001      66.17414 
1 1 1 15  6  0  o 547.0963 28.31331 58.77188       5.995048      60.44525       9.747866      57.75392       7.602928  549.9173 46.06851 540.3630 36.44279 9.554321       58.73997 
1 1 1 15  6  1  o 134.7005 56.87082 0.5607820      5.104027      0.7619026      8.519710      0.4481896      6.374570  171.1867 72.92585 148.4233 63.15091 22.76346       96.46873 
1 1 1 15  6  2  o 113.5745 53.43395 -6.187256      6.051835      3.655087       7.126191      -31.64815      11.46160  175.4002 69.79277 116.8542 58.58937 58.54602       91.12489 
1 1 1 15  6  3  o 627.7015 26.41627 77.04447       6.439507      77.04447       6.439507      0.000000       0.000000  627.7015 26.41627 ?        ?        0.000000       26.41627 
1 1 1 15  6  4  o 437.5339 34.16997 37.82973       5.760034      37.82845       6.915157      37.83264       10.40964  435.7816 41.35604 428.3358 64.58500 7.445801       76.69122 
1 1 1 15  6  5  o 709.4700 20.75930 98.16489       5.719719      104.6251       6.590788      78.45580       11.51192  732.0504 23.18294 626.7963 47.64941 105.2541       52.98977 
1 1 1 15  6  6  o 293.5612 37.61807 17.23924       4.190018      18.17405       5.125390      15.35574       7.275281  299.6218 45.47656 269.6809 69.14053 29.94086       82.75584 
1 1 1 15  6  7  o 715.9563 22.60309 100.0558       6.284667      111.2175       9.176265      90.19485       8.625049  753.0159 31.37862 677.8165 32.76585 75.19940       45.36760 
1 1 1 15  6  8  o 354.4229 37.48949 25.00804       5.081788      29.81521       7.286177      20.45463       7.091252  383.9468 50.05599 313.9347 60.35647 70.01205       78.41241 
1 1 1 15  6  9  o 266.1103 54.62877 14.65296       5.456491      17.65009       11.87377      13.85058       6.143617  289.3546 93.06786 257.0811 62.20837 32.27359       111.9442 
1 1 1 15  6  10 o 332.8160 43.10978 22.25829       5.441036      39.81801       11.29286      16.94954       6.209281  437.9303 68.65753 285.8383 57.92030 152.0920       89.82549 
1 1 1 15  6  11 o 137.7028 57.56773 0.9276398      5.148922      -8.865539      10.93246      3.719152       5.836812  157.1973 73.25684 164.7780 63.87603 -7.580688      97.19420 
1 1 1 15  6  12 o 447.5826 38.32114 39.77761       6.596776      39.50363       12.16899      39.89164       7.850353  433.1765 75.05650 446.0977 45.97251 -12.92126      88.01676 
1 1 1 15  6  13 f 564.9920 31.88099 62.87987       6.966658      52.72451       12.21928      67.77073       8.479895  506.3946 63.53238 585.0489 37.52026 -78.65430      73.78437 
1 1 1 15  6  14 o 418.2368 41.76147 35.00855       6.692375      19.94528       11.52660      42.66856       8.219703  302.1761 90.85399 460.5415 46.59912 -158.3653      102.1074 
1 1 1 15  6  15 o 257.4630 68.25252 14.16183       6.934884      15.57181       8.138633      10.42466       13.24998  268.8050 75.07693 248.0597 96.21801 20.74529       122.0428 
1 1 1 15  6  16 o 490.3846 45.13900 48.47488       8.499898      48.47488       8.499898      0.000000       0.000000  490.3846 45.13900 ?        ?        0.000000       45.13900 
1 1 1 15  6  17 o 232.8994 59.87543 11.56091       5.445563      14.77580       7.815420      8.527341       7.591825  260.3071 73.87817 209.5209 74.37048 50.78624       104.8282 
1 1 1 15  6  18 o 930.5691 23.63901 169.8558       8.542912      160.7724       10.56178      187.0431       14.52844  902.5164 30.13382 968.4235 38.63008 -65.90704      48.99316 
1 1 1 15  6  19 o 365.9490 44.61985 27.39886       6.209976      26.59385       7.826991      28.76657       10.20214  354.0152 59.00760 359.5050 75.47691 -5.489807      95.80533 
1 1 1 15  6  20 o 154.9805 67.38436 0.2577376      7.563209      0.2577376      7.563209      0.000000       0.000000  154.9805 67.38436 ?        ?        0.000000       67.38436 
1 1 1 15  6  21 o 153.6484 62.58752 2.790719       5.878004      -4.241800      9.994799      6.509133       7.267708  156.7676 71.98412 188.6882 71.74876 -31.92055      101.6346 
1 1 1 15  6  22 o 400.1886 34.92887 32.36827       5.374059      36.95864       7.913921      28.44016       7.320817  419.9361 49.47614 365.7709 53.08823 54.16522       72.56892 
1 1 1 15  7  0  o 371.2308 39.77931 27.52297       5.645628      27.66565       9.398513      27.44242       7.061633  362.6990 69.25030 367.5331 50.83544 -4.834137      85.90603 
1 1 1 15  7  1  o 241.7065 73.65427 12.15608       7.538374      12.15608       7.538374      0.000000       0.000000  241.7065 73.65427 ?        ?        0.000000       73.65427 
1 1 1 15  7  2  o 305.2893 43.16018 18.79776       4.974436      22.21032       5.468273      2.423168       11.97830  332.2370 43.41995 206.1532 87.08501 126.0838       97.30925 
1 1 1 15  7  3  o 219.6510 55.27081 10.03818       4.710888      9.046813       5.199671      14.57998       11.12941  209.3165 60.53179 267.5333 90.28976 -58.21678      108.7030 
1 1 1 15  7  4  o 1075.954 18.11392 225.5741       7.568927      230.2436       8.696170      210.9836       15.37182  1086.481 20.61000 1034.404 38.26546 52.07654       43.46283 
1 1 1 15  7  5  o 346.6086 35.82914 23.88564       4.753243      26.98026       5.361046      12.51229       10.27758  368.0742 38.05417 251.5193 86.72885 116.5549       94.71016 
1 1 1 15  7  6  o 239.6053 51.24055 11.86900       4.623683      12.65770       5.195921      8.868343       10.13480  246.6860 55.57051 227.6916 85.13058 18.99445       101.6627 
1 1 1 15  7  7  o 485.2209 41.40255 46.86653       7.727136      0.000000       0.000000      46.86653       7.727136  ?        ?        485.2209 41.40255 0.000000       41.40255 
1 1 1 15  7  8  o 611.8595 26.53881 73.23650       6.306104      66.78085       13.42731      75.06335       7.142862  572.2687 61.37528 618.8622 29.72010 -46.59344      68.19244 
1 1 1 15  7  9  o 461.2312 32.62702 41.97050       5.806476      28.95234       12.56402      45.50613       6.547665  364.4306 89.44005 479.7042 35.39677 -115.2736      96.18967 
1 1 1 15  7  10 o 653.4780 25.21479 83.47114       6.399033      97.21316       13.44464      79.44640       7.276009  696.8568 50.01216 636.7694 29.42274 60.08740       58.02511 
1 1 1 15  7  11 o 723.9171 22.54562 102.3088       6.338390      98.56284       13.77659      103.3146       7.138829  701.1653 50.94131 726.9640 25.28635 -25.79871      56.87194 
1 1 1 15  7  12 o 427.7381 33.74715 36.18663       5.560335      45.95740       12.29696      33.67547       6.234043  469.9382 69.47394 411.1256 39.53256 58.81262       79.93404 
1 1 1 15  7  13 o 754.3967 22.77484 111.1849       6.672416      120.8497       14.16628      108.4295       7.563987  777.4654 47.14148 744.2659 26.16946 33.19952       53.91808 
1 1 1 15  7  14 o 453.4032 32.39671 40.65639       5.666878      29.64486       11.99866      43.81781       6.429100  367.2496 85.69424 469.9529 35.48805 -102.7033      92.75185 
1 1 1 15  7  15 o 231.4583 59.29541 11.32747       5.353785      16.43601       7.935130      7.058890       7.253492  275.6399 72.97929 198.0834 72.38242 77.55647       102.7871 
1 1 1 15  7  16 o 500.7512 45.04523 50.60502       8.666150      50.60502       8.666150      0.000000       0.000000  500.7512 45.04523 ?        ?        0.000000       45.04523 
1 1 1 15  7  17 o 247.6964 74.90034 13.33124       7.817548      13.33124       7.817548      0.000000       0.000000  247.6964 74.90034 ?        ?        0.000000       74.90034 
1 1 1 15  7  18 o 194.9521 73.98611 6.606552       7.718565      6.606552       7.718565      0.000000       0.000000  194.9521 73.98611 ?        ?        0.000000       73.98611 
1 1 1 15  7  19 o 168.4199 61.93008 5.104268       5.321774      -3.619067      7.643557      13.31137       7.413943  139.1473 63.54001 245.0064 72.68451 -105.8591      96.54207 
1 1 1 15  7  20 o 189.2727 61.53716 7.529306       5.181625      8.066893       7.519382      7.043188       7.150383  201.6841 73.69729 192.6411 71.60820 9.043076       102.7571 
1 1 1 15  7  21 o 179.2526 70.63058 5.219823       7.232348      0.000000       0.000000      5.219823       7.232348  ?        ?        179.2526 70.63058 0.000000       70.63058 
1 1 1 15  7  22 o 340.8398 44.15767 24.13407       5.707609      26.65505       10.04118      22.93074       6.937331  337.0356 78.22282 325.3661 56.97876 11.66949       96.77494 
1 1 1 15  8  0  o 196.5452 65.38372 7.585592       5.837308      2.572507       8.978828      11.25550       7.682363  183.6443 76.33265 233.9811 74.81889 -50.33676      106.8856 
1 1 1 15  8  1  o 647.8028 23.62960 82.00912       5.944661      85.37416       6.702205      69.59676       12.87210  660.4908 26.12901 585.2303 57.37410 75.26044       63.04374 
1 1 1 15  8  2  o 513.2842 27.05711 51.72123       5.374405      56.65591       5.967158      30.51940       12.36871  536.9161 28.72170 374.2233 86.79146 162.6927       91.42042 
1 1 1 15  8  3  o 844.1611 20.05140 138.9949       6.573520      142.8308       7.423711      125.0664       14.14620  855.2656 22.35075 791.8900 46.19942 63.37555       51.32195 
1 1 1 15  8  4  o 607.2069 23.83269 72.04573       5.620019      78.32224       6.348344      49.30349       12.08421  632.7563 25.83426 488.7519 65.29795 144.0045       70.22272 
1 1 1 15  8  5  o 422.1826 30.52309 35.14283       4.970732      39.47833       5.544510      17.38799       11.22023  447.2352 32.13693 285.8539 90.31602 161.3813       95.86327 
1 1 1 15  8  6  o 512.4398 28.47687 51.60026       5.644781      57.49532       6.684452      36.94646       10.53894  540.1890 32.00607 421.6475 66.56966 118.5416       73.86412 
1 1 1 15  8  7  o 609.9954 26.14285 72.79355       6.193090      90.42952       9.039137      57.19053       8.502208  677.1819 34.48524 536.2639 41.13849 140.9180       53.68061 
1 1 1 15  8  8  o 635.0756 26.27979 78.90223       6.481496      84.56795       14.11205      77.38757       7.296620  646.5096 56.78191 628.2618 29.90564 18.24786       64.17579 
1 1 1 15  8  9  o 575.9404 28.39604 64.96776       6.351309      71.71616       13.34978      62.99336       7.220889  594.3104 58.60344 565.3359 33.03313 28.97443       67.27222 
1 1 1 15  8  10 o 243.1293 59.02365 12.36363       5.517014      28.51452       11.99026      8.025888       6.213872  362.2725 86.43164 202.4523 67.46502 159.8201       109.6447 
1 1 1 15  8  11 f 289.9716 50.79626 17.24212       5.511779      22.66651       12.11963      15.82767       6.188816  321.8615 92.22258 275.2107 59.62792 46.65076       109.8203 
1 1 1 15  8  12 o 133.5086 56.64726 0.4231064      5.104271      17.60007       11.14052      -4.140750      5.742467  286.5488 89.92062 117.4636 54.16604 169.0852       104.9747 
1 1 1 15  8  13 o 351.1021 40.48259 24.73431       5.418753      26.54083       11.69927      24.24091       6.114115  347.0590 86.97502 345.7125 46.73788 1.346527       98.73745 
1 1 1 15  8  14 o 189.7290 64.18918 7.028146       5.625084      5.413905       11.58592      7.526013       6.434324  214.5605 87.68777 197.7966 68.59912 16.76389       111.3328 
1 1 1 15  8  15 o 337.6803 43.66046 23.12378       5.591533      9.883789       10.89510      27.85801       6.514966  233.3506 88.05900 370.1886 46.33176 -136.8380      99.50387 
1 1 1 15  8  16 f 535.2026 31.89684 56.75530       6.599604      56.60509       8.736041      56.95498       10.07248  530.3084 42.78290 528.7800 49.63008 1.528381       65.52496 
1 1 1 15  8  17 o 194.6733 69.52666 7.269169       6.644853      5.668798       7.755626      11.68679       12.88549  189.3238 73.56372 247.6188 95.20645 -58.29497      120.3158 
1 1 1 15  8  18 o 134.3362 59.89253 -1.614329      6.335042      -7.368456      7.403490      14.11770       12.24163  123.5143 58.41094 256.8938 94.00840 -133.3795      110.6771 
1 1 1 15  8  19 f 362.4561 58.10505 27.97601       7.902637      27.97601       7.902637      0.000000       0.000000  362.4561 58.10505 ?        ?        0.000000       58.10505 
1 1 1 15  8  20 o 148.8371 59.12130 3.042417       5.105468      3.992212       7.423276      2.189874       7.032969  173.2753 70.43057 159.7004 67.05560 13.57484       97.24669 
1 1 1 15  8  21 o 413.0766 37.69989 34.68869       5.981178      49.28372       10.81147      28.25164       7.180013  478.2633 59.49479 365.0948 52.11909 113.1686       79.09506 
1 1 1 15  8  22 o 309.4458 48.51979 20.24406       5.639128      13.90310       10.01330      23.18917       6.824178  243.7888 85.51851 327.6805 55.61382 -83.89165      102.0113 
1 1 1 15  9  0  o 466.1216 39.68801 43.31147       7.115934      45.54722       8.785350      39.04673       12.13368  475.2080 48.27465 428.2346 75.73012 46.97342       89.80808 
1 1 1 15  9  1  o 418.3129 32.99551 34.63500       5.316721      38.07368       5.956422      21.15599       11.79284  438.1255 35.30699 310.3562 91.56743 127.7693       98.13856 
1 1 1 15  9  2  o 333.3820 40.35947 22.30279       5.118907      25.72983       5.706806      8.193172       11.57954  358.0010 41.83597 230.1564 89.76012 127.8447       99.03094 
1 1 1 15  9  3  o 558.2112 25.18274 60.95915       5.459207      63.16646       6.079286      51.76469       12.40749  567.8085 27.56911 500.2387 65.43586 67.56976       71.00639 
1 1 1 15  9  4  o 531.1278 27.21686 55.39174       5.595046      55.38100       6.200587      55.43880       12.98087  530.3902 30.22815 517.7704 66.06181 12.61981       72.64918 
1 1 1 15  9  5  o 434.3425 31.01542 37.22134       5.197239      42.54198       5.789815      15.14723       11.79300  464.1887 32.31915 271.7213 92.93652 192.4674       98.39575 
1 1 1 15  9  6  o 470.7946 36.37941 43.93793       6.599823      43.93793       6.599823      0.000000       0.000000  470.7946 36.37941 ?        ?        0.000000       36.37941 
1 1 1 15  9  7  o 618.2612 41.19585 75.95766       9.834672      0.000000       0.000000      75.95766       9.834672  ?        ?        618.2612 41.19585 0.000000       41.19585 
1 1 1 15  9  8  o 407.5892 48.98369 33.55127       7.598296      29.29263       12.78328      35.87786       9.448567  365.3716 90.54909 417.8582 59.94170 -52.48657      108.5916 
1 1 1 15  9  9  f 732.9688 29.77102 105.3486       8.474366      95.47449       14.49328      110.4782       10.44616  687.8952 54.70396 748.9386 35.91553 -61.04340      65.44042 
1 1 1 15  9  10 o 274.3642 66.04784 15.91216       6.952818      5.020524       11.90178      21.55482       8.566574  216.7779 88.76670 318.5247 71.05862 -101.7468      113.7051 
1 1 1 15  9  11 o 189.4177 69.67973 6.151303       6.737973      -7.985882      12.29172      12.22430       8.056250  170.8492 78.94592 242.5841 76.51747 -71.73491      109.9426 
1 1 1 15  9  12 o 332.0650 52.97199 22.65125       6.601655      6.250270       11.58546      30.53713       8.033479  219.7343 88.45433 385.8210 55.18776 -166.0867      104.2586 
1 1 1 15  9  13 o 228.8220 72.40040 10.89795       7.208319      17.72087       11.84974      6.890116       9.081928  285.7817 93.06615 207.6535 79.90680 78.12814       122.6638 
1 1 1 15  9  14 o 369.4562 40.94630 27.47472       5.776170      35.12730       12.42735      25.36593       6.523662  399.5010 82.81915 352.1458 49.03295 47.35516       96.24574 
1 1 1 15  9  15 o 400.2370 34.71657 31.94040       5.342674      13.99120       11.01855      37.45754       6.108840  257.6535 89.74627 433.0291 36.67014 -175.3755      96.94891 
1 1 1 15  9  16 o 468.4606 29.43242 43.43252       5.327385      43.94775       11.70348      43.29786       5.983198  453.3140 68.62637 466.5290 33.24115 -13.21503      76.25321 
1 1 1 15  9  17 o 533.7348 28.17100 56.32371       5.818549      44.92791       8.458210      66.56126       8.016858  468.9054 47.08374 577.1929 35.94308 -108.2875      59.23499 
1 1 1 15  9  18 o 276.7455 50.86545 16.11998       5.265327      11.65459       7.789139      19.87744       7.145074  231.1873 75.46210 302.6310 62.84970 -71.44362      98.20700 
1 1 1 15  9  19 o 497.2683 36.56614 49.81355       7.011978      50.65913       8.383109      47.84396       12.79426  497.6399 43.82443 463.3554 73.55844 34.28452       85.62374 
1 1 1 15  9  20 o 222.1754 85.78325 9.906735       10.49441      9.906735       10.49441      0.000000       0.000000  222.1754 85.78325 ?        ?        0.000000       85.78325 
1 1 1 15  9  21 o 100.9404 49.78780 -13.64311      7.011965      -8.454711      9.444939      -20.01440      10.46637  137.9672 65.45845 121.5661 60.12261 16.40102       88.87934 
1 1 1 15  10 0  o 533.0637 29.10479 55.96027       6.002413      61.96471       6.901658      37.31712       12.16121  560.2539 31.85209 416.4305 78.06618 143.8234       84.31420 
1 1 1 15  10 1  o 617.9798 25.24411 74.76939       6.058461      78.57632       6.879023      61.60690       12.79112  632.9225 27.98648 547.2117 61.24011 85.71075       67.33197 
1 1 1 15  10 2  o 138.8081 57.10640 1.485192       4.954684      0.8195432      5.461215      4.582428       11.78023  140.0093 58.95420 212.8027 87.85802 -72.79343      105.8047 
1 1 1 15  10 3  o 606.7730 24.50687 72.02522       5.774869      74.87276       6.439811      60.33325       13.04916  618.1973 26.82366 540.9716 63.31002 77.22571       68.75803 
1 1 1 15  10 4  o 662.5780 25.88282 85.94380       6.660035      85.94380       6.660035      0.000000       0.000000  662.5780 25.88282 ?        ?        0.000000       25.88282 
1 1 1 15  10 5  o 994.4807 24.64482 193.4410       9.518095      193.4410       9.518095      0.000000       0.000000  994.4807 24.64482 ?        ?        0.000000       24.64482 
1 1 1 15  10 6  o 415.0921 36.89071 34.24728       5.884902      34.24728       5.884902      0.000000       0.000000  415.0921 36.89071 ?        ?        0.000000       36.89071 
1 1 1 15  10 7  o 780.3915 25.32685 119.1362       7.675767      119.8046       8.656902      116.6786       16.59936  781.8059 28.51252 759.2548 56.70499 22.55109       63.46983 
1 1 1 15  10 8  o 753.0301 29.95352 111.2509       8.759678      107.1710       14.93577      113.3900       10.81500  729.3844 53.09262 758.2792 36.72563 -28.89478      64.55694 
1 1 1 15  10 9  o 212.4536 72.71016 8.773129       7.218460      3.189502       12.00620      11.93407       9.033488  208.8264 87.64426 242.7731 81.34778 -33.94667      119.5783 
1 1 1 15  10 10 o 209.3199 74.14712 8.205604       7.542589      8.892903       11.69301      7.715837       9.870694  234.4074 90.53741 218.2463 83.46605 16.16109       123.1406 
1 1 1 15  10 11 o 825.2891 30.02115 133.7727       9.621913      142.1649       15.33151      128.3194       12.35887  842.6564 47.03735 804.9452 39.53524 37.71118       61.44548 
1 1 1 15  10 12 o 773.3389 30.37000 117.5987       9.121003      95.42690       14.20397      133.1564       11.89825  685.6971 53.77059 820.2809 37.35015 -134.5839      65.46992 
1 1 1 15  10 13 o 401.1639 48.60588 32.76555       7.417924      27.72701       12.15122      35.75874       9.365577  351.2738 88.97459 414.6177 59.90148 -63.34384      107.2598 
1 1 1 15  10 14 o 424.1834 39.76647 36.12066       6.474402      29.28672       11.92826      38.97487       7.708759  360.9380 86.27066 438.4321 45.95781 -77.49417      97.74839 
1 1 1 15  10 15 o 575.7441 30.80538 65.62067       6.862885      58.97196       12.86289      68.26652       8.114326  529.3975 63.85369 585.2972 35.87138 -55.89972      73.23967 
1 1 1 15  10 16 o 250.3151 60.59674 13.49714       5.827536      28.63303       11.05423      7.671648       6.857897  356.0650 81.67796 198.4129 70.65685 157.6521       107.9985 
1 1 1 15  10 17 o 116.8033 51.00105 -0.4658476     4.372271      -11.31280      8.010013      4.137665       5.218239  118.5047 57.27966 159.6544 60.77541 -41.14973      83.51413 
1 1 1 15  10 18 o 193.4963 65.55376 7.749480       5.866869      -5.477310      10.56338      13.64943       7.055042  158.3364 73.17152 247.1243 70.21173 -88.78792      101.4089 
1 1 1 15  10 19 o 186.7001 64.74642 7.150602       5.731840      10.07079       10.46119      5.897838       6.851888  223.6394 85.83192 181.9419 69.55072 41.69749       110.4736 
1 1 1 15  10 20 o 409.4672 38.03375 34.14536       5.978968      35.69695       10.68465      33.43801       7.214239  396.7559 71.99552 400.1910 47.33593 -3.435089      86.16290 
1 1 1 15  10 21 o 420.0161 42.59408 36.42256       6.851635      33.68724       8.086975      43.38079       12.89828  396.9589 53.84798 429.2762 80.32154 -32.31735      96.70137 
1 1 1 15  11 0  o 444.5329 33.87264 39.20701       5.803632      38.61850       6.430899      41.78994       13.47260  439.9588 38.01178 438.0844 82.20867 1.874329       90.57130 
1 1 1 15  11 1  o 911.1942 20.42697 162.1421       7.228412      165.8896       8.295423      150.3210       14.73321  920.9069 23.19502 867.4638 43.87649 53.44305       49.63019 
1 1 1 15  11 2  o 656.1328 23.95141 84.23453       6.103104      91.39784       6.924623      59.30413       12.91825  682.9750 26.10738 535.3890 63.35955 147.5860       68.52757 
1 1 1 15  11 3  o 338.0157 47.52201 23.23878       6.065911      23.23878       6.065911      0.000000       0.000000  338.0157 47.52201 ?        ?        0.000000       47.52201 
1 1 1 15  11 4  o 179.1927 62.64828 5.969610       5.371578      5.969610       5.371578      0.000000       0.000000  179.1927 62.64828 ?        ?        0.000000       62.64828 
1 1 1 15  11 5  o 412.7143 36.73162 33.87884       5.825780      33.87884       5.825780      0.000000       0.000000  412.7143 36.73162 ?        ?        0.000000       36.73162 
1 1 1 15  11 6  o 583.3315 27.40150 66.67887       6.207514      66.67887       6.207514      0.000000       0.000000  583.3315 27.40150 ?        ?        0.000000       27.40150 
1 1 1 15  11 7  f 114.4547 52.36730 -3.270282      5.224966      -5.227870      6.198810      1.533563       9.710512  118.7384 55.27681 184.1534 78.13406 -65.41499      95.71028 
1 1 1 15  11 8  o 547.7054 35.03740 59.35442       7.413531      67.11012       13.58379      56.06436       8.847333  571.6259 62.19371 529.6121 43.39672 42.01373       75.83754 
1 1 1 15  11 9  o 442.4270 77.63715 41.79667       12.85296      41.79667       12.85296      0.000000       0.000000  442.4270 77.63715 ?        ?        0.000000       77.63715 
1 1 1 15  11 10 o 168.7699 65.29253 4.100640       6.089073      7.737186       12.28938      2.917409       7.010034  230.4778 91.67047 168.4933 68.45946 61.98447       114.4123 
1 1 1 15  11 11 o 370.4212 43.51608 27.69295       6.140724      49.95767       13.03987      21.34843       6.960879  486.2254 71.16354 319.7267 58.20488 166.4987       91.93508 
1 1 1 15  11 12 o 248.2384 57.07913 13.01390       5.387731      4.420109       11.35833      15.50888       6.120052  207.4404 86.00768 270.5793 59.83040 -63.13890      104.7712 
1 1 1 15  11 13 o 228.8627 56.79908 11.10511       5.024504      23.88966       11.95772      8.363896       5.537031  323.7290 91.21017 201.0407 63.43789 122.6884       111.1020 
1 1 1 15  11 14 o 537.4492 26.67918 56.79437       5.568495      71.68903       13.36451      53.66531       6.125546  587.1209 59.43217 520.6200 30.42919 66.50092       66.76915 
1 1 1 15  11 15 o 167.8791 64.08823 4.537706       5.812957      -5.462612      10.88763      8.524912       6.874808  163.0281 74.95907 205.3242 70.92544 -42.29611      103.1953 
1 1 1 15  11 16 o 477.2254 34.99287 45.57388       6.440100      28.01495       12.48301      51.94249       7.517831  344.3692 91.70477 508.1483 38.37860 -163.7791      99.41168 
1 1 1 15  11 17 o 198.2913 70.29233 7.921344       6.779920      0.000000       0.000000      7.921344       6.779920  ?        ?        198.2913 70.29233 0.000000       70.29233 
1 1 1 15  11 18 o 293.4758 53.32341 18.37151       5.853549      11.19762       10.64348      21.48222       7.008666  231.1841 87.08266 314.7035 59.52686 -83.51935      105.4838 
1 1 1 15  11 19 o 342.6718 40.79447 24.14495       5.322156      11.98370       7.930809      34.10873       7.178611  229.9783 76.19775 404.8909 46.49709 -174.9126      89.26408 
1 1 1 15  11 20 f 246.3595 54.84607 13.25979       5.112482      20.98900       7.779151      7.383250       6.783057  304.0076 67.63515 190.8985 69.95955 113.1091       97.30803 
1 1 1 15  12 0  o 416.0080 39.71294 34.67773       6.338032      15.05904       7.180163      103.9055       13.48775  264.4316 69.13863 717.5426 48.69023 -453.1110      84.56293 
1 1 1 15  12 1  o 240.9882 59.78722 12.29602       5.568556      9.703301       6.324488      21.23866       11.74574  216.2146 67.73562 308.4091 91.48493 -92.19458      113.8315 
1 1 1 15  12 2  o 497.4219 31.21351 48.87681       5.999137      58.90883       6.708823      8.843259       13.40183  546.1023 31.77058 240.6103 95.72050 305.4920       100.8553 
1 1 1 15  12 3  o 479.9974 34.60878 45.68233       6.408110      45.68233       6.408110      0.000000       0.000000  479.9974 34.60878 ?        ?        0.000000       34.60878 
1 1 1 15  12 4  o 161.0552 62.35049 3.672144       5.555648      3.672144       5.555648      0.000000       0.000000  161.0552 62.35049 ?        ?        0.000000       62.35049 
1 1 1 15  12 5  o 572.9474 30.87303 64.70811       6.844098      69.68736       7.749518      47.05653       14.59098  593.7946 33.74481 466.2844 83.64944 127.5102       90.19946 
1 1 1 15  12 6  o 384.8774 41.28933 29.70653       6.075059      30.16122       6.950708      28.23530       12.50296  385.9531 47.36738 356.5440 90.22243 29.40915       101.9007 
1 1 1 15  12 7  o 748.1065 24.41101 109.5127       7.092137      108.3698       8.203472      112.8946       14.11136  743.1806 28.42336 749.6102 48.73839 -6.429626      56.42090 
1 1 1 15  12 8  o 510.0702 37.65434 51.72847       7.406136      72.48057       14.17871      43.94197       8.685143  593.0811 62.50043 466.1730 48.69215 126.9080       79.22897 
1 1 1 15  12 9  o 498.4214 37.78352 49.45072       7.259138      51.15087       13.66114      48.78181       8.569002  490.8798 73.95647 492.3980 45.31981 -1.518188      86.73779 
1 1 1 15  12 10 o 493.7047 32.29249 48.24598       6.157400      54.45827       13.45755      46.60113       6.924747  507.9444 70.08863 483.6980 37.14765 24.24643       79.32442 
1 1 1 15  12 11 o 681.5889 24.26182 91.03766       6.422053      98.06477       14.26381      89.25101       7.192270  693.6038 53.36320 673.9995 27.47758 19.60431       60.02207 
1 1 1 15  12 12 o 146.2313 59.17245 2.262669       5.213842      -10.73586      11.89463      5.354185       5.800820  157.4708 74.33663 175.1308 64.61651 -17.66000      98.49481 
1 1 1 15  12 13 o 496.6211 29.46071 48.80095       5.656542      55.81642       13.71994      47.36425       6.208787  509.8159 71.24281 488.0912 32.94789 21.72464       78.49268 
1 1 1 15  12 14 o 143.5460 57.08592 2.578799       4.765094      12.45344       12.12706      0.7758412      5.181882  248.2882 93.06544 135.0177 57.17001 113.2705       109.2226 
1 1 1 15  12 15 o 175.2607 61.52489 5.946731       5.183185      0.000000       0.000000      5.946731       5.183185  ?        ?        175.2607 61.52489 0.000000       61.52489 
1 1 1 15  12 16 o 166.6970 60.33023 5.169663       5.021642      0.000000       0.000000      5.169663       5.021642  ?        ?        166.6970 60.33023 0.000000       60.33023 
1 1 1 15  12 17 o 177.8254 60.35801 6.457122       4.973810      0.000000       0.000000      6.457122       4.973810  ?        ?        177.8254 60.35801 0.000000       60.35801 
1 1 1 15  12 18 o 251.0203 61.19937 13.97354       5.912073      22.49781       12.48769      11.51097       6.711931  298.8958 95.37085 226.1758 69.60404 72.72000       118.0691 
1 1 1 15  12 19 o 177.9140 64.88553 6.244755       5.824690      22.80418       12.90045      2.004496       6.527976  296.9965 97.12346 152.8921 64.42117 144.1043       116.5464 
1 1 1 15  12 20 o 285.2333 48.45141 17.31676       5.175039      11.37281       8.041640      21.51833       6.761039  223.2856 76.73258 313.4029 57.67499 -90.11734      95.99111 
1 1 1 15  13 0  o 272.1856 69.36958 16.01024       7.354171      19.93954       9.225781      9.161925       12.17973  301.0576 78.20464 234.9317 91.93630 66.12589       120.6990 
1 1 1 15  13 1  o 154.9854 66.10818 0.6998981      7.017379      7.245536       8.591178      -12.42179      12.16387  206.3882 78.12096 156.3617 74.21459 50.02647       107.7529 
1 1 1 15  13 2  o 933.2316 29.15558 171.1898       10.56669      171.1898       10.56669      0.000000       0.000000  933.2316 29.15558 ?        ?        0.000000       29.15558 
1 1 1 15  13 3  o 463.9673 44.22393 43.30673       7.871974      43.30673       7.871974      0.000000       0.000000  463.9673 44.22393 ?        ?        0.000000       44.22393 
1 1 1 15  13 4  o 303.9716 67.29868 19.72349       7.734739      19.72349       7.734739      0.000000       0.000000  303.9716 67.29868 ?        ?        0.000000       67.29868 
1 1 1 15  13 5  o 149.2735 62.15952 1.461290       5.969587      0.4947015      6.918443      4.278009       11.81026  153.2409 65.50913 210.6781 87.55501 -57.43721      109.3496 
1 1 1 15  13 6  o 342.3110 45.94254 23.79591       5.953355      18.00795       6.722558      44.83512       12.81700  292.1506 61.21101 458.6190 74.52078 -166.4684      96.43721 
1 1 1 15  13 7  o 139.4503 57.65879 1.420400       5.084502      6.977942       6.091513      -11.34571      9.232367  191.3789 66.72550 132.6076 63.41856 58.77133       92.05546 
1 1 1 15  13 8  f 442.0429 28.34998 38.54263       4.841159      44.91425       6.616296      31.20040       7.102384  475.1090 36.12936 391.7728 47.66328 83.33615       59.80902 
1 1 1 15  13 9  o 662.6222 26.68756 86.19647       6.867566      93.67234       14.47177      84.02361       7.802022  676.6317 55.56396 653.0482 30.76338 23.58350       63.51173 
1 1 1 15  13 10 o 263.0226 58.47575 14.68112       5.818366      2.233228       12.42035      18.18080       6.585678  203.7670 87.45835 292.8387 59.92760 -89.07170      106.0202 
1 1 1 15  13 11 o 150.9486 60.62270 2.647731       5.428014      -14.04330      11.67214      7.253402       6.131342  147.2967 70.67108 192.5935 66.95490 -45.29677      97.35173 
1 1 1 15  13 12 o 173.0620 61.76968 5.586535       5.244075      13.27548       12.36444      3.900061       5.790697  254.2747 94.23420 163.0202 63.50346 91.25450       113.6344 
1 1 1 15  13 13 o 338.0142 44.46541 23.39648       5.695287      0.000000       0.000000      23.39648       5.695287  ?        ?        338.0142 44.46541 0.000000       44.46541 
1 1 1 15  13 14 o 505.3109 30.33401 50.72293       5.925180      0.000000       0.000000      50.72293       5.925180  ?        ?        505.3109 30.33401 0.000000       30.33401 
1 1 1 15  13 15 o 506.8487 28.83968 50.99608       5.653241      0.000000       0.000000      50.99608       5.653241  ?        ?        506.8487 28.83968 0.000000       28.83968 
1 1 1 15  13 16 o 292.7836 43.59550 17.76274       4.805770      -3.453943      12.35347      21.54621       5.216697  176.9903 80.80409 323.4043 42.57020 -146.4140      91.33194 
1 1 1 15  13 17 o 406.7775 30.98119 33.15861       4.857414      27.67460       13.26550      34.00776       5.219948  329.5608 97.08353 411.1479 32.96921 -81.58719      102.5289 
1 1 1 15  13 18 o 153.4096 56.63275 4.312261       4.457119      9.640944       12.25884      3.500540       4.784568  223.7371 90.66372 148.6693 57.77628 75.06781       107.5082 
1 1 1 15  13 19 o 170.0320 56.91191 6.051755       4.421460      2.216013       12.41392      6.609040       4.731762  192.1921 84.85828 176.6279 58.87263 15.56424       103.2808 
1 1 1 15  14 0  o 353.4013 56.25999 26.02106       7.462539      25.64110       9.355769      26.68559       12.37295  343.6956 72.38037 341.8955 91.41757 1.800049       116.6023 
1 1 1 15  14 1  o 655.5122 54.11885 87.79993       13.65389      0.000000       0.000000      87.79993       13.65389  ?        ?        655.5122 54.11885 0.000000       54.11885 
1 1 1 15  14 2  o 116.4080 56.51929 -12.68460      8.026400      -12.68460      8.026400      0.000000       0.000000  116.4080 56.51929 ?        ?        0.000000       56.51929 
1 1 1 15  14 3  o 327.4422 64.32813 22.76769       7.888384      22.76769       7.888384      0.000000       0.000000  327.4422 64.32813 ?        ?        0.000000       64.32813 
1 1 1 15  14 4  o 242.0125 59.07582 12.41866       5.503768      16.08222       6.249832      -0.2367873     11.61596  275.5634 60.09383 189.4460 82.91339 86.11739       102.4007 
1 1 1 15  14 5  o 379.3889 36.04428 28.74092       5.246876      26.51281       5.850814      37.89290       11.85781  362.3392 42.37952 418.9678 75.66225 -56.62860      86.72254 
1 1 1 15  14 6  o 505.9488 29.19360 50.52293       5.711806      46.16639       7.287257      57.46310       9.197697  480.3586 39.41066 534.0715 44.75845 -53.71283      59.63655 
1 1 1 15  14 7  o 394.9843 35.44555 31.13581       5.379260      27.53526       6.611978      38.18415       9.251025  367.2924 47.46489 429.3158 56.88723 -62.02335      74.08827 
1 1 1 15  14 8  o 529.0498 27.44433 55.17476       5.619310      54.19199       6.812282      57.26723       9.940247  522.3047 33.76535 530.6489 48.78114 -8.344116      59.32705 
1 1 1 15  14 9  o 262.4390 60.47384 14.73547       6.036782      -1.833256      12.79464      19.48015       6.846797  190.4052 84.98669 302.6633 60.36734 -112.2581      104.2447 
1 1 1 15  14 10 o 151.3479 62.14650 2.163585       5.853944      -14.68478      12.95650      6.485150       6.561898  155.8745 74.69942 188.0410 68.82516 -32.16649      101.5722 
1 1 1 15  14 11 o 202.4589 62.74418 8.652323       5.443277      20.60502       13.07466      6.146266       5.986774  297.0413 97.80807 181.7443 65.85828 115.2970       117.9141 
1 1 1 15  14 12 o 237.5793 61.62091 12.24300       5.733622      0.000000       0.000000      12.24300       5.733622  ?        ?        237.5793 61.62091 0.000000       61.62091 
1 1 1 15  14 13 o 633.0743 25.77483 78.96244       6.336923      0.000000       0.000000      78.96244       6.336923  ?        ?        633.0743 25.77483 0.000000       25.77483 
1 1 1 15  14 14 o 369.9921 42.10260 28.00433       5.941903      22.60758       13.37913      29.33032       6.631820  303.2354 98.89659 376.8170 46.29195 -73.58163      109.1947 
1 1 1 15  14 15 o 213.6939 55.05233 9.903325       4.596902      1.905953       12.25409      11.21306       4.959054  194.3739 85.11296 226.9545 56.48764 -32.58060      102.1522 
1 1 1 15  14 16 o 253.7459 47.85909 13.66256       4.543250      15.69310       12.83669      13.37178       4.857672  257.7596 95.91947 249.2768 51.86705 8.482788       109.0447 
1 1 1 15  14 17 o 214.0296 53.76128 10.02165       4.462671      11.34177       11.88639      9.805035       4.814904  230.7876 90.67165 210.7128 57.31872 20.07486       107.2697 
1 1 1 15  14 18 o 130.0078 52.51746 2.053115       4.099419      11.01286       12.55884      0.9846259      4.336972  229.1658 92.15005 124.3705 52.46185 104.7953       106.0372 
1 1 1 15  15 0  o 257.4599 61.02448 14.21601       6.008466      8.703522       6.778754      34.42041       12.97773  207.1632 70.46295 389.1074 87.94962 -181.9442      112.6950 
1 1 1 15  15 1  o 231.8701 72.88564 11.48327       7.315854      11.48327       7.315854      0.000000       0.000000  231.8701 72.88564 ?        ?        0.000000       72.88564 
1 1 1 15  15 2  o 238.8408 69.25320 12.30304       6.797867      12.30304       6.797867      0.000000       0.000000  238.8408 69.25320 ?        ?        0.000000       69.25320 
1 1 1 15  15 3  o 310.2535 49.26771 19.87266       5.737756      21.75982       6.451820      12.73477       12.54763  323.4504 53.21356 253.6639 94.74683 69.78653       108.6676 
1 1 1 15  15 4  o 150.7325 60.06508 2.787298       5.285237      5.960804       6.035942      -7.643244      10.94281  181.4606 66.07107 157.8221 73.46221 23.63852       98.80325 
1 1 1 15  15 5  o 300.7364 47.93102 18.65305       5.410054      22.17759       6.123796      6.121942       11.54688  327.8198 49.65622 214.8689 87.64548 112.9509       100.7346 
1 1 1 15  15 6  o 299.5660 49.01587 18.57362       5.505126      15.62270       6.957903      23.51298       9.001904  268.1898 66.99899 327.5852 72.66138 -59.39548      98.83593 
1 1 1 15  15 7  o 149.1854 58.38624 3.078299       4.912631      1.460099       5.928173      6.625626       8.777187  147.5406 61.73324 201.4042 78.25845 -53.86351      99.67637 
1 1 1 15  15 8  o 435.7281 31.03678 37.72009       5.217620      34.67441       6.382451      43.85636       9.059372  414.5085 40.15176 461.3612 51.43824 -46.85269      65.25379 
1 1 1 15  15 9  o 275.0670 65.74046 16.50983       6.927003      0.000000       0.000000      16.50983       6.927003  ?        ?        275.0670 65.74046 0.000000       65.74046 
1 1 1 15  15 10 o 599.8469 30.96837 71.43844       7.189563      0.000000       0.000000      71.43844       7.189563  ?        ?        599.8469 30.96837 0.000000       30.96837 
1 1 1 15  15 11 o 459.3150 33.98434 42.21037       6.018991      0.000000       0.000000      42.21037       6.018991  ?        ?        459.3150 33.98434 0.000000       33.98434 
1 1 1 15  15 12 o 328.0464 44.84142 22.20769       5.563119      0.000000       0.000000      22.20769       5.563119  ?        ?        328.0464 44.84142 0.000000       44.84142 
1 1 1 15  15 13 o 302.9977 42.60005 18.93415       4.874312      -3.404019      12.39251      23.02250       5.301632  177.7532 81.06667 334.9972 41.65027 -157.2440      91.14027 
1 1 1 15  15 14 o 398.8511 31.08339 31.86071       4.776661      26.82097       12.02826      32.80431       5.204657  330.4712 90.88622 403.7683 33.49429 -73.29712      96.86163 
1 1 1 15  15 15 o 361.2663 33.80778 26.38259       4.688054      29.04046       12.03333      25.90700       5.090239  342.7669 89.44904 356.4600 37.32388 -13.69305      96.92370 
1 1 1 15  15 16 o 288.6799 41.95385 17.35458       4.565770      20.49668       12.73199      16.89088       4.891081  281.7393 96.56458 282.8117 46.12268 -1.072418      107.0141 
1 1 1 15  15 17 o 136.0832 53.57524 2.718579       4.157943      15.29402       12.15565      1.052235       4.424856  249.9573 93.27630 125.7217 53.00905 124.2355       107.2867 
1 1 1 15  16 0  o 284.0822 57.20298 17.19632       6.092578      26.35488       6.920838      -14.34435      12.84342  355.9567 51.56682 154.9647 74.29232 200.9919       90.43498 
1 1 1 15  16 1  o 372.2867 52.36711 28.81595       7.361896      28.81595       7.361896      0.000000       0.000000  372.2867 52.36711 ?        ?        0.000000       52.36711 
1 1 1 15  16 2  o 208.9664 70.83762 9.004192       6.850807      9.004192       6.850807      0.000000       0.000000  208.9664 70.83762 ?        ?        0.000000       70.83762 
1 1 1 15  16 3  o 189.5425 64.07249 7.246211       5.604606      16.70501       6.458907      -21.58357      11.27617  278.5165 61.36996 128.1893 63.21085 150.3272       88.10155 
1 1 1 15  16 4  o 459.1249 32.25398 41.96136       5.714489      43.03485       6.639286      38.89298       11.22472  463.1250 37.22891 423.0536 70.82423 40.07144       80.01290 
1 1 1 15  16 5  o 308.8756 47.70269 19.75007       5.537751      15.15932       7.284832      26.03443       8.523315  262.0761 70.17603 347.0665 65.64109 -84.99039      96.09073 
1 1 1 15  16 6  o 812.2086 21.06758 129.2571       6.645235      114.5396       8.446838      153.1599       10.76466  761.7114 28.55457 879.2398 31.52572 -117.5284      42.53510 
1 1 1 15  16 7  o 117.8467 53.01578 -1.913895      5.085866      -9.304487      6.422061      10.51813       8.329248  106.2578 51.34288 224.0358 78.02962 -117.7779      93.40617 
1 1 1 15  16 8  o 211.2053 59.76252 9.613769       5.122164      10.48988       6.406841      8.061803       8.527164  219.9746 68.05484 207.1865 77.96473 12.78813       103.4889 
1 1 1 15  16 9  o 308.6383 57.92267 20.39781       6.687671      0.000000       0.000000      20.39781       6.687671  ?        ?        308.6383 57.92267 0.000000       57.92267 
1 1 1 15  16 10 o 147.8054 61.97613 1.634663       5.994462      0.000000       0.000000      1.634663       5.994462  ?        ?        147.8054 61.97613 0.000000       61.97613 
1 1 1 15  16 11 o 815.2419 24.42759 130.9513       7.733838      110.3816       15.20296      138.1327       8.983011  726.4624 54.27952 835.5788 27.68258 -109.1164      60.93104 
1 1 1 15  16 12 o 350.3975 37.14954 24.94449       4.978141      19.69705       12.27096      25.97826       5.446466  283.4651 94.81150 356.4172 40.04139 -72.95215      102.9200 
1 1 1 15  16 13 o 140.5465 54.13265 3.103517       4.170981      -13.10061      11.68509      5.469593       4.465126  145.3609 69.99088 165.1889 57.15394 -19.82799      90.36202 
1 1 1 15  16 14 o 169.1997 61.76303 5.537384       5.279282      3.063877       11.18041      6.247135       5.988998  189.7672 82.21800 178.5818 65.69307 11.18546       105.2396 
1 1 1 15  16 15 o 315.0655 35.59194 20.27909       4.278574      34.57948       12.06463      18.22182       4.575996  376.0548 84.65186 296.1679 40.87428 79.88690       94.00343 
1 1 1 15  16 16 o 262.8209 42.70752 14.53001       4.209401      21.33356       12.32670      13.63190       4.478626  284.3375 95.02699 252.2177 47.46557 32.11984       106.2220 
1 1 1 15  16 17 o 191.9345 51.00963 8.074299       3.867224      3.741404       11.47624      8.629339       4.107457  190.9387 83.01198 197.9149 52.55638 -6.976242      98.25050 
1 1 1 15  17 0  o 155.8801 63.09721 2.957084       5.930483      2.693245       6.948150      3.665100       11.38208  162.6709 67.34275 198.0262 84.32347 -35.35530      107.9143 
1 1 1 15  17 1  f 362.6464 54.87497 27.77413       7.486749      27.77413       7.486749      0.000000       0.000000  362.6464 54.87497 ?        ?        0.000000       54.87497 
1 1 1 15  17 2  o 654.6187 36.73785 86.00744       9.301894      86.00744       9.301894      0.000000       0.000000  654.6187 36.73785 ?        ?        0.000000       36.73785 
1 1 1 15  17 3  o 773.4995 24.18289 117.7201       7.264341      114.6706       8.629280      125.1381       13.45869  761.1364 29.19336 784.3440 44.36619 -23.20764      53.10943 
1 1 1 15  17 4  o 365.4959 43.60851 27.38857       6.067657      25.72683       7.197134      31.47201       11.28214  348.8550 54.94086 370.7958 80.64457 -21.94077      97.58096 
1 1 1 15  17 5  o 288.4719 57.35799 17.87034       6.199515      8.309847       8.321393      29.79599       9.293872  207.1930 77.20367 368.7702 67.37812 -161.5772      102.4706 
1 1 1 15  17 6  o 152.5655 60.75024 3.127683       5.402801      -5.326267      7.147301      14.39912       8.252811  126.9539 59.18615 252.0955 77.11495 -125.1416      97.20965 
1 1 1 15  17 7  o 169.4758 61.10661 5.437750       5.144714      6.404349       6.758626      4.106009       7.933145  186.0517 69.52793 178.1003 72.64742 7.951416       100.5574 
1 1 1 15  17 8  o 211.1757 54.71075 9.633679       4.523138      11.56227       5.551273      5.824344       7.801847  229.4921 61.17413 187.3951 73.51157 42.09695       95.63590 
1 1 1 15  17 9  o 320.6343 32.66641 20.69942       4.010798      22.61061       5.273951      18.07799       6.176660  331.6295 41.88411 289.3036 57.00324 42.32590       70.73647 
1 1 1 15  17 10 o 228.3016 58.65442 11.44490       5.228161      -1.186925      12.33768      14.20965       5.772020  183.2766 82.50050 254.2958 59.50270 -71.01924      101.7197 
1 1 1 15  17 11 o 254.8751 49.94965 13.87727       4.767318      16.38127       12.17662      13.42397       5.180897  261.1788 94.02870 248.3600 55.15122 12.81879       109.0094 
1 1 1 15  17 12 o 484.0876 32.74400 47.15054       6.119588      36.68472       13.88654      49.67288       6.817253  380.8162 94.37508 495.3239 35.67882 -114.5077      100.8942 
1 1 1 15  17 13 o 226.6623 48.35286 11.05670       4.126486      0.1670761      11.47647      12.67358       4.422237  179.3742 80.24539 242.9639 48.56549 -63.58971      93.79728 
1 1 1 15  17 14 o 335.8340 32.87716 22.88729       4.232928      39.03563       12.30912      20.72151       4.507855  401.6207 81.70007 317.4723 37.27162 84.14844       89.80019 
1 1 1 15  17 15 o 335.7742 28.94265 22.68715       3.737231      37.07223       12.48464      21.27126       3.916840  385.6191 85.59921 323.9966 31.52857 61.62256       91.22102 
1 1 1 15  17 16 o 441.2229 30.60523 39.24342       5.211808      46.30770       13.02266      37.89615       5.687119  438.1809 79.45348 431.5884 34.21111 6.592438       86.50581 
1 1 1 15  18 0  o 122.2140 57.01807 -4.909105      6.652534      -11.09791      8.410421      5.434689       10.87312  121.7383 58.80677 200.3806 83.70363 -78.64240      102.2963 
1 1 1 15  18 1  o 330.1570 66.37797 24.25470       8.215745      24.25470       8.215745      0.000000       0.000000  330.1570 66.37797 ?        ?        0.000000       66.37797 
1 1 1 15  18 2  o 208.1076 75.20730 8.996375       7.799475      8.996375       7.799475      0.000000       0.000000  208.1076 75.20730 ?        ?        0.000000       75.20730 
1 1 1 15  18 3  o 354.2541 46.92061 26.14060       6.296308      33.88484       7.911695      12.76414       10.39802  401.0815 52.01871 239.4350 86.78928 161.6465       101.1846 
1 1 1 15  18 4  o 378.8081 42.02312 29.45995       6.077916      25.47491       7.515270      36.99448       10.33372  343.5480 58.42014 409.1927 67.37341 -65.64478      89.17449 
1 1 1 15  18 5  o 477.5184 34.17317 45.85649       6.295398      47.11044       9.158358      44.73325       8.667947  474.6841 50.45382 463.4368 48.89954 11.24731       70.26202 
1 1 1 15  18 6  o 208.0917 60.12474 9.491337       5.131998      7.153653       6.606747      13.04780       8.148997  189.7715 69.12041 239.0396 77.12322 -49.26804      103.5646 
1 1 1 15  18 7  o 283.3361 46.06572 16.83844       4.894703      12.28694       6.014266      25.76686       8.423505  234.4563 64.17914 340.2785 66.12508 -105.8222      92.14927 
1 1 1 15  18 8  o 175.0504 56.16721 6.466917       4.326675      7.740532       5.180638      3.530283       7.866635  189.9267 61.51538 172.4183 71.53951 17.50842       94.35064 
1 1 1 15  18 9  o 97.09106 44.01608 -1.657967      3.584867      -0.7466896     4.663287      -2.974560      5.605221  117.5173 51.94233 117.6690 53.98523 -0.1517105     74.91602 
1 1 1 15  18 10 o 297.1637 45.64815 18.57508       5.099525      18.58742       12.76238      18.57273       5.562912  270.8851 96.39653 294.7761 50.40516 -23.89096      108.7795 
1 1 1 15  18 11 o 288.7359 42.42577 17.42307       4.615417      29.29936       12.32176      15.48481       4.977818  338.4052 91.54350 268.5561 49.55392 69.84915       104.0952 
1 1 1 15  18 12 o 358.4989 32.27382 26.02612       4.445142      20.88859       12.55152      26.76290       4.753207  280.6615 95.87929 362.6997 34.14715 -82.03821      101.7785 
1 1 1 15  18 13 o 133.2917 51.52836 2.837258       3.790215      8.006393       11.84845      2.247999       4.000420  209.9194 87.50612 129.9956 52.10153 79.92386       101.8425 
1 1 1 15  18 14 f 158.4549 51.18470 5.329626       3.588524      -7.769383      11.75029      6.677018       3.768569  154.6922 73.28265 174.7370 51.81704 -20.04485      89.75161 
1 1 1 15  19 0  o 130.5475 59.09764 -2.048945      6.435421      -9.524568      7.828087      13.53682       11.30306  119.0682 57.31981 240.2975 89.89164 -121.2293      106.6118 
1 1 1 15  19 1  o 319.6252 68.20060 23.29729       8.207626      23.29729       8.207626      0.000000       0.000000  319.6252 68.20060 ?        ?        0.000000       68.20060 
1 1 1 15  19 2  o 164.4672 68.05145 3.267124       7.089922      3.267124       7.089922      0.000000       0.000000  164.4672 68.05145 ?        ?        0.000000       68.05145 
1 1 1 15  19 3  o 439.3453 32.85188 38.90527       5.564673      38.38358       6.686528      40.08064       10.03651  432.4561 40.27673 426.8565 62.38591 5.599548       74.25777 
1 1 1 15  19 4  o 358.9118 39.80916 26.48734       5.455324      20.61209       6.589756      39.28349       9.725141  307.1131 57.36077 423.7298 60.84456 -116.6167      83.62009 
1 1 1 15  19 5  o 182.6494 61.56499 7.071486       5.174366      2.929642       6.872401      12.49263       7.862432  160.8639 66.81569 232.3225 75.81552 -71.45856      101.0561 
1 1 1 15  19 6  o 197.4367 59.21989 8.591911       4.901542      5.238389       6.245653      13.96923       7.908794  171.7615 66.21717 243.8615 75.63988 -72.10004      100.5291 
1 1 1 15  19 7  o 102.8395 47.37305 -2.689179      4.376204      -6.517630      5.360476      4.961358       7.577707  100.3585 48.08225 177.3515 71.48640 -76.99306      86.15224 
1 1 1 15  19 8  o 110.4662 48.73684 -0.5987868     4.087180      3.387839       4.920216      -9.474239      7.341362  148.1369 58.29273 114.0375 55.05205 34.09939       80.17961 
1 1 1 15  19 9  o 135.6257 49.78439 3.336425       3.436925      -2.566379      4.464560      11.92362       5.384867  104.3924 47.99950 229.9873 59.74945 -125.5949      76.64169 
1 1 1 15  19 10 f 348.8566 37.49255 25.04655       4.999779      31.79093       12.89885      23.85408       5.423803  347.1949 93.55441 337.8462 42.26342 9.348724       102.6578 
1 1 1 15  19 11 o 192.9991 52.97127 8.251842       4.090734      -5.247244      12.53953      9.859571       4.327484  166.3605 77.83381 210.8306 52.93136 -44.47005      94.12668 
1 1 1 15  19 12 o 230.3911 46.11465 11.45535       3.982051      -1.660368      12.60384      12.90970       4.197025  176.1353 80.86180 245.0909 45.77815 -68.95561      92.92077 
1 1 1 15  19 13 o 219.6971 42.42909 10.30416       3.488996      9.695910       12.47844      10.35574       3.633932  216.4765 89.98399 219.4931 44.16078 -3.016556      100.2362 
1 1 1 15  20 0  o 321.6479 47.98230 22.14149       5.810276      21.28485       6.896046      24.23767       10.78743  307.6858 59.86644 306.4189 86.73687 1.266846       105.3911 
1 1 1 15  20 1  f 312.9609 58.34274 21.81059       6.830087      21.81059       6.830087      0.000000       0.000000  312.9609 58.34274 ?        ?        0.000000       58.34274 
1 1 1 15  20 2  o 178.8870 66.52665 6.448946       6.172985      6.448946       6.172985      0.000000       0.000000  178.8870 66.52665 ?        ?        0.000000       66.52665 
1 1 1 15  20 3  o 432.5476 32.47122 37.87306       5.414765      35.19789       6.355673      44.95531       10.34121  412.5000 40.18459 450.2320 60.68978 -37.73203      72.78770 
1 1 1 15  20 4  o 126.7955 56.43249 -0.8204102     5.597977      2.182751       7.062560      -5.895860      9.181425  156.2850 66.48311 141.0190 66.17574 15.26599       93.80422 
1 1 1 15  20 5  o 264.0332 51.54596 15.20300       5.095773      12.64233       6.630080      18.89889       7.965271  232.2890 68.69303 281.5500 72.43203 -49.26099      99.82550 
1 1 1 15  20 6  o 192.2230 58.86112 8.251838       4.806768      15.76563       6.185537      -3.202911      7.637311  263.0170 61.63372 136.3587 62.72788 126.6583       87.94034 
1 1 1 15  20 7  o 260.9647 48.00117 14.69565       4.685500      23.65283       5.957179      0.1660006      7.587215  332.9034 47.41825 149.7274 66.21310 183.1760       81.44118 
1 1 1 15  20 8  o 249.9583 45.48864 13.40125       4.253015      11.02320       5.234118      18.02254       7.296516  219.7140 59.75967 276.2299 68.38181 -56.51588      90.81459 
1 1 1 15  20 9  f 186.5912 49.95840 7.681358       3.692200      6.637542       4.501925      9.825998       6.453028  174.2853 57.39322 205.8415 68.75536 -31.55621      89.56160 
1 1 1 15  20 10 o 154.7749 55.05679 4.868209       4.162851      16.47826       11.84290      3.231482       4.446609  248.8315 92.22366 141.3778 55.48530 107.4536       107.6282 
1 1 1 15  20 11 o 187.3385 49.97282 7.776260       3.702776      14.86909       12.81923      7.130627       3.867631  239.2003 94.10316 179.1608 52.31981 60.03944       107.6697 
1 1 1 15  20 12 o 100.3265 43.65645 -0.8079463E-01 3.179662      -1.664951      11.80278      0.4317428E-01  3.301732  169.7348 78.04392 103.0328 44.65962 66.70204       89.91850 
1 1 1 15  21 0  o 174.8102 62.33183 6.637015       5.338698      6.044357       6.208297      8.319250       10.45957  172.9351 66.18095 201.1456 82.88815 -28.21045      106.0677 
1 1 1 15  21 1  o 146.6006 62.37328 2.030980       6.218158      2.030980       6.218158      0.000000       0.000000  146.6006 62.37328 ?        ?        0.000000       62.37328 
1 1 1 15  21 2  o 474.4803 34.81826 46.14603       6.371037      46.14603       6.371037      0.000000       0.000000  474.4803 34.81826 ?        ?        0.000000       34.81826 
1 1 1 15  21 3  o 358.1066 36.21422 26.48342       4.967169      26.88472       5.667066      25.15312       10.31803  357.5286 41.59225 311.0826 83.61017 46.44598       93.38403 
1 1 1 15  21 4  o 161.4598 58.74970 5.319679       4.771227      1.086802       5.831816      13.88844       8.297456  138.1093 59.60850 235.3518 77.93731 -97.24249      98.11930 
1 1 1 15  21 5  o 324.7527 39.53168 22.07610       4.882840      22.22350       6.110211      21.81562       8.122348  318.5241 51.12467 300.4381 70.77839 18.08600       87.31158 
1 1 1 15  21 6  o 421.1192 30.40946 35.95145       4.939823      33.05552       6.229100      40.85887       8.108824  396.9973 40.99273 435.3100 48.80610 -38.31268      63.73727 
1 1 1 15  21 7  o 101.1006 46.58293 -2.379089      4.234806      -1.509337      5.167353      -4.158042      7.390137  117.0752 52.98134 128.7967 60.09146 -11.72144      80.11246 
1 1 1 15  21 8  o 111.8504 48.46910 0.2237207      3.887021      0.9084638      4.790123      -1.096503      6.651302  126.6395 54.33293 134.0191 60.42812 -7.379555      81.26270 
1 1 1 15  21 9  o 135.5810 49.84418 3.478498       3.447063      1.081077       4.131498      8.970415       6.253127  120.7591 51.08554 196.3195 67.65243 -75.56038      84.77372 
1 1 1 15  21 10 o 263.6974 41.24775 14.77816       4.085684      16.69375       12.60598      14.55332       4.318811  245.1736 94.19135 259.9529 44.37275 -14.77937      104.1199 
1 1 1 15  22 0  o 203.2237 61.49427 9.906067       5.268220      10.42050       5.983594      8.132276       11.11087  206.1622 66.04185 196.2715 83.43823 9.890671       106.4118 
1 1 1 15  22 1  o 252.1380 59.84435 15.01115       5.772038      15.01115       5.772038      0.000000       0.000000  252.1380 59.84435 ?        ?        0.000000       59.84435 
1 1 1 15  22 2  o 139.6052 59.33745 1.980413       5.617322      1.980413       5.617322      0.000000       0.000000  139.6052 59.33745 ?        ?        0.000000       59.33745 
1 1 1 15  22 3  o 260.7000 49.95498 15.14605       4.873528      16.07268       5.586249      12.19382       9.971088  264.4370 56.13238 217.1969 83.68546 47.24004       100.7676 
1 1 1 15  22 4  o 120.0030 51.49424 0.8158605      4.303957      1.641921       5.134237      -1.136836      7.893821  133.6048 56.75649 142.7718 64.95293 -9.166962      86.25649 
1 1 1 15  22 5  o 159.6607 56.54664 5.466587       4.386594      6.186446       5.383151      4.043875       7.567831  169.3652 62.28490 164.8032 69.39709 4.562027       93.24894 
1 1 1 15  22 6  f 241.6939 47.74212 12.90929       4.322249      9.524896       5.418352      18.83123       7.167348  200.2278 62.69060 278.1045 67.12774 -77.87663      91.84903 
1 1 1 15  22 7  o 127.4594 52.12667 2.093981       4.097765      -0.5986847     5.123923      6.872044       6.825544  120.3976 53.75745 179.2413 69.18865 -58.84376      87.61811 
1 1 1 15  22 8  o 168.6512 53.19452 6.371226       3.893584      7.324174       4.825977      4.594280       6.590035  179.1011 59.44435 163.0354 66.32459 16.06567       89.06505 
1 1 1 15  23 0  o 100.1271 47.57979 -4.455307      5.028430      -3.272021      5.710481      -8.540171      10.61003  112.2456 52.51842 136.4771 65.95636 -24.23153      84.31148 
1 1 1 15  23 1  o 212.7922 62.90902 11.23726       5.561286      11.23726       5.561286      0.000000       0.000000  212.7922 62.90902 ?        ?        0.000000       62.90902 
1 1 1 15  23 2  o 151.8658 61.20531 4.184712       5.553987      4.184712       5.553987      0.000000       0.000000  151.8658 61.20531 ?        ?        0.000000       61.20531 
1 1 1 15  23 3  o 134.2281 55.10479 2.592022       4.601258      3.149793       5.208169      0.6084840      9.821488  142.7234 58.61339 159.0722 72.40043 -16.34871      93.15231 
1 1 1 15  23 4  o 218.6574 53.28608 11.07757       4.483494      5.709465       5.590267      20.75598       7.506270  164.1422 62.80415 288.1371 68.14918 -123.9949      92.67509 
1 1 1 15  23 5  o 177.8097 53.76774 7.296459       4.028522      5.512757       4.886625      11.08041       7.117391  160.3435 59.27753 208.4682 72.15713 -48.12465      93.38349 
1 1 1 15  24 0  o 152.3191 59.19157 4.917469       5.021639      3.160876       5.738686      10.65849       10.37460  143.3883 60.40812 196.6081 81.91379 -53.21982      101.7792 
1 1 1 15  24 1  o 112.5415 51.03045 -0.9606534     4.821177      -3.574278      5.494146      7.790631       10.05344  108.0965 50.87363 184.3091 78.88420 -76.21256      93.86610 
1 1 1 16  0  0  o 158.8105 81.93394 7.380652       6.479317      7.380652       6.479317      7.380652       6.479317  158.8105 81.93394 158.8105 81.93394 0.000000       0.000000 
1 1 1 16  0  1  o 242.9170 78.15797 14.76272       6.508395      14.76272       6.508395      14.76272       6.508395  242.9170 78.15797 242.9170 78.15797 0.000000       0.000000 
1 1 1 16  0  2  o 588.9619 32.55672 68.29461       7.394544      68.29461       7.394544      68.29461       7.394544  588.9619 32.55672 588.9619 32.55672 0.000000       0.000000 
1 1 1 16  0  3  o 171.5085 82.24140 8.632742       6.313527      8.632742       6.313527      8.632742       6.313527  171.5085 82.24140 171.5085 82.24140 0.000000       0.000000 
1 1 1 16  0  4  o 154.7540 84.88293 6.796803       7.330323      6.796803       7.330323      6.796803       7.330323  154.7540 84.88293 154.7540 84.88293 0.000000       0.000000 
1 1 1 16  0  5  o 239.8551 88.26995 15.32380       7.606647      15.32380       7.606647      15.32380       7.606647  239.8551 88.26995 239.8551 88.26995 0.000000       0.000000 
1 1 1 16  0  6  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 16  0  7  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 16  0  8  o 139.7403 82.16055 4.757442       7.556000      4.757442       7.556000      4.757442       7.556000  139.7403 82.16055 139.7403 82.16055 0.000000       0.000000 
1 1 1 16  0  9  o 598.2639 38.54198 70.99336       8.869545      70.99336       8.869545      70.99336       8.869545  598.2639 38.54198 598.2639 38.54198 0.000000       0.000000 
1 1 1 16  0  10 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 16  0  11 o 81.24101 57.85884 -10.91979      7.993082      -10.91979      7.993082      -10.91979      7.993082  81.24101 57.85884 81.24101 57.85884 0.000000       0.000000 
1 1 1 16  0  12 o 950.5457 24.21322 176.6050       8.925167      176.6050       8.925167      176.6050       8.925167  950.5457 24.21322 950.5457 24.21322 0.000000       0.000000 
1 1 1 16  0  13 o 609.8608 41.76329 74.35750       9.784804      74.35750       9.784804      74.35750       9.784804  609.8608 41.76329 609.8608 41.76329 0.000000       0.000000 
1 1 1 16  0  14 o 218.2216 95.33659 14.21600       8.405799      14.21600       8.405799      14.21600       8.405799  218.2216 95.33659 218.2216 95.33659 0.000000       0.000000 
1 1 1 16  0  15 o 490.4340 48.09640 49.30624       8.958320      49.30624       8.958320      49.30624       8.958320  490.4340 48.09640 490.4340 48.09640 0.000000       0.000000 
1 1 1 16  0  16 o 303.3027 79.53949 22.36402       8.094964      22.36402       8.094964      22.36402       8.094964  303.3027 79.53949 303.3027 79.53949 0.000000       0.000000 
1 1 1 16  0  17 o 156.8119 87.13149 7.800953       7.837885      7.800953       7.837885      7.800953       7.837885  156.8119 87.13149 156.8119 87.13149 0.000000       0.000000 
1 1 1 16  0  18 o 298.2413 77.54031 21.91982       7.760874      21.91982       7.760874      21.91982       7.760874  298.2413 77.54031 298.2413 77.54031 0.000000       0.000000 
1 1 1 16  0  19 o 1046.564 27.78847 216.9155       11.27627      216.9155       11.27627      216.9155       11.27627  1046.564 27.78847 1046.564 27.78847 0.000000       0.000000 
1 1 1 16  0  20 o 953.6807 28.58618 181.0258       10.56582      181.0258       10.56582      181.0258       10.56582  953.6807 28.58618 953.6807 28.58618 0.000000       0.000000 
1 1 1 16  0  21 o 146.4239 82.75397 7.592401       7.221985      7.592401       7.221985      7.592401       7.221985  146.4239 82.75397 146.4239 82.75397 0.000000       0.000000 
1 1 1 16  1  0  o 523.7270 36.77986 54.42467       7.433280      54.42467       7.433280      0.000000       0.000000  523.7270 36.77986 ?        ?        0.000000       36.77986 
1 1 1 16  1  1  o 394.6330 31.63750 30.80360       4.807915      29.78232       6.518264      32.02228       7.120404  384.5881 44.46200 398.1759 46.94977 -13.58780      64.66181 
1 1 1 16  1  2  o 585.6907 22.68028 67.02578       5.158753      64.43760       7.326813      69.57028       7.264741  571.3321 33.16432 594.1614 31.59741 -22.82935      45.80687 
1 1 1 16  1  3  o 439.6826 33.13080 38.24022       5.615601      29.19090       9.427513      43.21677       6.991221  372.7091 67.62312 465.9852 38.99086 -93.27603      78.05878 
1 1 1 16  1  4  o 370.4607 34.77905 27.26013       4.945084      30.41259       5.906435      19.87048       9.043004  390.2539 39.51652 303.7472 76.65742 86.50674       86.24335 
1 1 1 16  1  5  o 576.7772 38.92140 66.03857       8.667157      66.03857       8.667157      0.000000       0.000000  576.7772 38.92140 ?        ?        0.000000       38.92140 
1 1 1 16  1  6  o 720.1806 23.76805 101.3825       6.647572      105.3394       9.314518      97.27506       9.490113  731.9227 32.76930 702.7956 34.77077 29.12708       47.77901 
1 1 1 16  1  7  o 784.8295 22.75415 120.3288       6.935279      117.2032       9.782455      123.4872       9.833676  772.1211 32.62379 792.7517 31.94116 -20.63062      45.65687 
1 1 1 16  1  8  o 555.3395 39.32024 61.23988       8.425308      61.23988       8.425308      0.000000       0.000000  555.3395 39.32024 ?        ?        0.000000       39.32024 
1 1 1 16  1  9  o 359.4041 62.59663 26.85425       8.419502      26.85425       8.419502      0.000000       0.000000  359.4041 62.59663 ?        ?        0.000000       62.59663 
1 1 1 16  1  10 o 730.7992 23.15009 104.3400       6.570203      117.1618       9.578877      92.94854       9.028838  772.2756 31.93848 687.3792 33.82264 84.89642       46.51922 
1 1 1 16  1  11 o 242.3633 59.46228 12.32918       5.554630      15.76274       8.175911      9.385750       7.569910  271.5923 75.02966 218.6890 74.46103 52.90324       105.7066 
1 1 1 16  1  12 o 116.7694 54.95364 -6.440985      6.409821      0.000000       0.000000      -6.440985      6.409821  ?        ?        116.7694 54.95364 0.000000       54.95364 
1 1 1 16  1  13 o 596.0058 29.50400 69.77908       6.829036      60.28948       9.513133      79.86833       9.809098  548.1105 45.09171 633.3849 40.08473 -85.27435      60.33281 
1 1 1 16  1  14 o 142.3129 60.77590 0.4045404      5.943924      3.906305       8.404895      -3.099029      8.407062  184.9206 75.02353 151.0603 68.04075 33.86029       101.2822 
1 1 1 16  1  15 o 560.4804 30.18983 62.05862       6.547035      58.17044       9.138224      66.15919       9.384499  537.3660 44.18013 574.0850 42.39260 -36.71899      61.22921 
1 1 1 16  1  16 o 332.7562 46.24005 22.67871       5.813971      35.75706       8.427759      10.80283       8.030977  415.9622 53.40452 227.5987 76.69903 188.3635       93.46006 
1 1 1 16  1  17 o 215.0349 62.56676 9.902435       5.539979      9.082360       7.886766      10.70121       7.783678  213.2081 75.78829 225.1921 75.51076 -11.98399      106.9848 
1 1 1 16  1  18 o 492.8250 30.80251 48.28610       5.865741      53.68278       8.266125      42.81225       8.325011  514.8795 41.69788 456.5636 47.65445 58.31589       63.32188 
1 1 1 16  1  19 o 418.5668 35.08178 35.23322       5.650025      29.29744       7.797059      41.79634       8.198750  371.8212 55.71258 449.8993 47.65028 -78.07813      73.31058 
1 1 1 16  1  20 o 232.5061 58.14435 11.84463       5.236468      17.14933       7.456058      6.681457       7.355925  275.0143 69.71706 189.8979 72.18907 85.11642       100.3580 
1 1 1 16  1  21 o 523.1694 28.28540 54.51709       5.725536      59.08299       8.247812      50.27024       7.954417  538.2530 39.73801 495.0482 41.76447 43.20474       57.64877 
1 1 1 16  2  0  o 665.8223 21.70229 86.60233       5.611666      88.25685       7.840322      84.86441       8.035464  670.2920 30.11909 656.9301 31.49661 13.36194       43.57977 
1 1 1 16  2  1  o 800.0557 19.77283 124.8992       6.143516      119.8709       8.540603      130.2909       8.843816  781.8380 28.12832 815.1660 27.93609 -33.32794      39.64376 
1 1 1 16  2  2  o 355.7439 40.02643 25.35310       5.433792      18.31810       8.952123      29.45700       6.837416  291.2884 77.70244 381.6663 47.13068 -90.37793      90.87888 
1 1 1 16  2  3  o 295.5628 36.79930 17.49311       4.132465      17.65280       5.517859      17.28913       6.236233  293.2914 50.25234 287.9627 57.77384 5.328644       76.57098 
1 1 1 16  2  4  o 582.6177 24.74158 66.39833       5.598079      63.25715       6.390321      76.76291       11.60786  567.1509 29.11131 618.2045 48.74496 -51.05359      56.77623 
1 1 1 16  2  5  o 448.4525 32.71095 39.75177       5.657598      42.14930       7.884543      37.20710       8.122882  458.3915 44.86584 428.8478 49.69384 29.54373       66.95088 
1 1 1 16  2  6  o 342.9389 42.75153 23.66605       5.570080      20.75555       7.650336      26.94948       8.125703  314.0323 64.87699 360.6594 60.13164 -46.62708      88.45811 
1 1 1 16  2  7  o 409.2167 51.10243 33.97946       7.944218      33.97946       7.944218      0.000000       0.000000  409.2167 51.10243 ?        ?        0.000000       51.10243 
1 1 1 16  2  8  o 415.6645 35.92738 34.29217       5.742566      46.75985       8.105990      21.73038       8.136525  483.5855 43.63225 320.8141 67.44708 162.7714       80.32983 
1 1 1 16  2  9  o 217.7673 61.03094 9.885128       5.368604      10.49754       7.597253      9.274298       7.587462  227.7865 74.53531 218.0407 74.54581 9.745834       105.4163 
1 1 1 16  2  10 o 118.9704 53.57554 -2.330081      5.209235      -11.08855      7.578717      5.513637       7.172037  116.3694 56.11607 187.7319 71.30128 -71.36255      90.73524 
1 1 1 16  2  11 o 529.7629 26.40678 54.94625       5.432816      49.75639       8.212288      58.98518       7.244686  499.1029 42.78233 546.3174 34.32093 -47.21457      54.84755 
1 1 1 16  2  12 o 677.6078 30.96673 90.22582       8.148952      122.7122       14.66929      75.72637       9.800195  782.1516 48.53329 616.7059 41.15570 165.4456       63.63388 
1 1 1 16  2  13 o 139.3743 59.13432 0.5758171      5.562050      -1.581022      12.18900      1.143034       6.250778  189.7160 83.90924 150.2668 63.16203 39.44925       105.0248 
1 1 1 16  2  14 o 423.2442 38.74409 35.83311       6.297652      30.45943       8.984247      41.02410       8.830202  380.8770 62.93747 448.2560 51.67039 -67.37897      81.43067 
1 1 1 16  2  15 o 189.7377 66.27808 6.927050       6.011446      2.355098       8.417416      11.68629       8.588091  175.7070 73.54345 236.5011 79.31664 -60.79410      108.1655 
1 1 1 16  2  16 o 343.5033 44.51561 24.06503       5.798767      24.04641       8.059497      24.08503       8.349584  335.2531 64.24089 334.4353 66.62720 0.8177795      92.55310 
1 1 1 16  2  17 o 270.8427 54.85099 15.53861       5.571573      14.49350       7.692806      16.69164       8.080253  256.0787 73.50349 273.9964 74.13653 -17.91769      104.3982 
1 1 1 16  2  18 o 536.1386 29.17202 56.99447       6.051098      59.44453       8.555824      54.54244       8.559267  542.2390 40.93129 518.2661 42.91217 23.97290       59.30282 
1 1 1 16  2  19 o 503.1679 30.34870 50.41584       5.902605      44.62734       8.167105      56.74573       8.540498  465.9770 45.71994 528.0890 41.99033 -62.11203      62.07657 
1 1 1 16  2  20 o 196.7261 62.28433 8.354237       5.334049      5.373717       7.385414      11.60432       7.712160  181.1300 71.37288 227.6432 75.12642 -46.51318      103.6246 
1 1 1 16  2  21 o 516.7189 29.27426 53.28833       5.850323      44.27981       8.116512      63.02967       8.440187  461.8162 45.86217 556.2048 39.32766 -94.38864      60.41526 
1 1 1 16  3  0  f 600.4484 28.22736 70.73784       6.582242      64.16051       11.28958      74.12513       8.101764  562.7060 52.25839 612.2703 34.20966 -49.56433      62.45991 
1 1 1 16  3  1  o 441.7960 28.95601 38.46394       4.940596      24.99664       6.768930      53.81876       7.227729  349.6198 51.38671 521.0096 35.94119 -171.3899      62.70855 
1 1 1 16  3  2  o 101.6158 47.05531 -3.494728      4.401480      -7.363497      5.918293      1.293426       6.584064  107.3252 51.17387 154.8586 64.94407 -47.53340      82.68311 
1 1 1 16  3  3  o 458.3200 31.14498 41.46001       5.510617      37.95277       6.195771      54.73867       12.05564  436.9775 36.85363 515.9716 61.36755 -78.99414      71.58327 
1 1 1 16  3  4  o 612.7360 24.04425 73.41808       5.721536      67.95558       6.569813      90.56870       11.64118  588.6161 28.74041 673.3754 44.77068 -84.75934      53.20174 
1 1 1 16  3  5  f 364.9621 34.31270 26.45316       4.806196      30.72781       5.819462      17.28199       8.524024  392.4652 38.68464 283.5537 75.90336 108.9116       85.19285 
1 1 1 16  3  6  o 451.7046 44.58524 40.92673       7.719154      40.92673       7.719154      0.000000       0.000000  451.7046 44.58524 ?        ?        0.000000       44.58524 
1 1 1 16  3  7  o 251.0475 57.40955 13.18826       5.475460      13.16166       7.746478      13.21482       7.740465  249.7513 74.34340 250.1886 74.27834 -0.4372864     105.0914 
1 1 1 16  3  8  o 507.2635 30.98505 50.70613       6.074720      52.52470       8.422869      48.73478       8.769515  513.0195 42.66338 492.8271 46.36485 20.19241       63.00685 
1 1 1 16  3  9  o 592.5236 26.35339 68.72077       6.064152      80.35342       8.753093      57.98410       8.409250  637.7061 35.48424 539.9535 40.39531 97.75256       53.76720 
1 1 1 16  3  10 o 208.8913 61.37890 9.027851       5.308388      12.77857       7.696089      5.624031       7.331558  246.6012 74.25954 189.5245 72.06409 57.07661       103.4781 
1 1 1 16  3  11 o 669.6437 25.39759 87.75008       6.604871      87.08566       13.36427      87.96481       7.597589  656.8277 52.83916 669.6284 29.21554 -12.80072      60.37818 
1 1 1 16  3  12 o 680.0115 24.92916 90.50293       6.583425      93.19788       14.02099      89.74073       7.456500  678.5576 53.64383 676.3525 28.38794 2.205078       60.69213 
1 1 1 16  3  13 o 312.6119 49.87704 20.06146       5.851767      19.06416       12.44544      20.34453       6.630421  294.7016 95.33380 312.5509 56.71379 -17.84937      110.9278 
1 1 1 16  3  14 o 541.1902 45.18516 58.99781       9.409864      0.000000       0.000000      58.99781       9.409864  ?        ?        541.1902 45.18516 0.000000       45.18516 
1 1 1 16  3  15 o 437.5478 44.29702 38.73090       7.423386      55.65886       13.30096      31.07264       8.946342  512.3845 68.56255 384.0070 62.11052 128.3775       92.51237 
1 1 1 16  3  16 o 148.5014 61.30468 1.896629       5.734805      -2.178213      7.963679      6.285877       8.265201  149.3018 66.81503 196.5024 76.05656 -47.20059      101.2366 
1 1 1 16  3  17 o 390.8658 39.33480 30.85141       5.889698      32.12790       8.238398      29.51700       8.423260  391.7240 55.72550 373.0117 60.19683 18.71225       82.03042 
1 1 1 16  3  18 f 694.3488 25.24393 94.92573       6.807109      99.02882       9.642254      90.84899       9.611233  703.7142 35.39505 673.0994 36.90895 30.61475       51.13786 
1 1 1 16  3  19 f 213.1101 62.69727 9.916913       5.535795      12.55938       7.691640      7.077186       7.973563  236.7177 74.77648 196.5655 75.05473 40.15221       105.9468 
1 1 1 16  3  20 o 615.7524 30.08987 75.43168       7.195392      74.46681       8.954195      77.19039       12.08903  606.3079 38.22383 607.0725 51.77186 -0.7646484     64.35361 
1 1 1 16  3  21 o 670.3499 27.98567 89.26083       7.285599      101.7069       9.291754      69.39613       11.73878  712.0396 33.60204 572.4846 53.41669 139.5549       63.10658 
1 1 1 16  4  0  o 836.7856 19.70926 136.6736       6.404904      133.5550       8.572303      140.6146       9.636633  825.3854 26.74316 846.1047 29.32738 -20.71930      39.68994 
1 1 1 16  4  1  o 654.4114 22.34170 83.70034       5.677997      82.47445       7.692081      85.16802       8.416532  647.7690 30.57706 656.7850 33.10402 -9.015991      45.06476 
1 1 1 16  4  2  o 1140.028 17.54081 253.3608       7.765924      259.9878       10.82733      246.3394       11.14491  1152.802 24.18458 1121.638 25.58563 31.16443       35.20679 
1 1 1 16  4  3  f 1012.136 22.77087 200.2225       8.950487      185.7331       10.55793      237.2382       16.87511  973.2277 27.93421 1094.485 39.70168 -121.2571      48.54424 
1 1 1 16  4  4  o 305.5218 50.61341 19.14877       5.795091      19.14877       5.795091      0.000000       0.000000  305.5218 50.61341 ?        ?        0.000000       50.61341 
1 1 1 16  4  5  o 383.0587 35.62926 29.17482       5.239536      31.44074       6.012169      22.01933       10.68386  396.7320 39.54879 317.2105 85.00456 79.52142       93.75437 
1 1 1 16  4  6  o 317.9148 49.04388 20.62518       5.860351      19.45781       8.024212      21.95961       8.579168  302.1987 69.78275 321.0618 70.71716 -18.86307      99.35064 
1 1 1 16  4  7  o 335.0156 43.82099 22.64423       5.564667      27.91673       8.006247      17.71687       7.739771  367.9212 57.95051 288.3221 69.85748 79.59912       90.76524 
1 1 1 16  4  8  o 852.3367 21.47018 141.8324       7.106813      143.1513       10.00690      140.4903       10.09478  854.0420 30.17119 845.8994 30.72911 8.142578       43.06482 
1 1 1 16  4  9  o 700.4240 23.93720 95.90369       6.511219      88.65031       9.160344      103.3108       9.256924  669.8892 35.33621 724.8212 32.88575 -54.93195      48.27132 
1 1 1 16  4  10 o 452.1031 30.25522 40.29628       5.281434      45.43386       7.953340      36.24377       7.063705  476.5331 43.45406 425.2262 43.38205 51.30695       61.40242 
1 1 1 16  4  11 o 259.2263 62.05873 14.18019       6.164598      13.88187       11.37112      14.30437       7.336221  261.8833 91.17357 259.1157 70.86306 2.767609       115.4738 
1 1 1 16  4  12 o 395.6833 39.10569 31.29516       5.930546      32.73171       12.24575      30.85499       6.778501  386.8250 83.92841 390.9158 45.50143 -4.090759      95.46915 
1 1 1 16  4  13 f 858.7144 22.34581 144.2086       7.451999      138.9374       14.91326      145.9628       8.603046  832.0081 46.33870 862.9420 25.67099 -30.93384      52.97429 
1 1 1 16  4  14 o 339.8156 44.97779 23.49136       5.789799      27.33665       11.82357      22.27845       6.640434  348.5585 87.48276 327.5667 54.08767 20.99176       102.8529 
1 1 1 16  4  15 o 125.4848 57.02410 -2.990345      6.062479      -9.507674      8.455215      3.905349       8.697186  128.9824 61.40796 185.7816 75.95541 -56.79924      97.67374 
1 1 1 16  4  16 o 184.6616 69.99487 5.777897       6.902923      14.56726       12.47169      1.896116       8.288239  261.8790 95.03104 171.1840 72.38328 90.69496       119.4581 
1 1 1 16  4  17 o 314.5854 50.22658 20.61922       5.929817      13.80043       8.346200      27.56974       8.426431  249.5078 77.75481 358.6264 62.79032 -109.1186      99.94216 
1 1 1 16  4  18 o 132.7664 57.75401 -0.1716282     5.561262      -9.767201      7.733763      10.10306       8.002757  119.4076 57.35269 219.1086 76.47533 -99.70094      95.59188 
1 1 1 16  4  19 o 406.2878 43.26716 33.88240       6.721809      35.48051       8.414995      31.06504       11.17302  409.8241 54.20229 365.8438 80.79800 43.98029       97.29443 
1 1 1 16  4  20 o 484.5174 36.74238 47.53150       6.862142      44.98700       8.550646      52.13553       11.50183  464.6425 48.08190 490.2083 61.78961 -25.56580      78.29320 
1 1 1 16  4  21 o 215.8623 62.43604 10.40141       5.531518      13.31075       7.965791      7.692041       7.687146  239.3238 76.15059 196.6483 74.01996 42.67548       106.1973 
1 1 1 16  5  0  f 520.8901 26.33067 53.32328       5.309146      47.33558       6.990634      61.48380       8.161043  487.7482 37.18585 555.9406 38.02812 -68.19232      53.18764 
1 1 1 16  5  1  o 326.6089 38.62177 21.40440       4.803944      19.40785       6.316773      24.14316       7.398299  305.7542 55.23053 340.8599 57.96444 -35.10571      80.06426 
1 1 1 16  5  2  o 905.5312 22.88092 160.3241       8.046461      163.8612       9.278545      149.5952       16.15950  914.5123 26.12536 863.2385 48.39759 51.27380       54.99874 
1 1 1 16  5  3  o 427.5085 36.91347 36.36823       6.068442      36.36823       6.068442      0.000000       0.000000  427.5085 36.91347 ?        ?        0.000000       36.91347 
1 1 1 16  5  4  o 404.4350 34.26360 32.45624       5.330995      28.62120       5.953264      47.97780       11.97672  377.7493 41.25165 480.2140 65.96292 -102.4647      77.79978 
1 1 1 16  5  5  o 268.0591 50.16756 14.81892       5.030573      19.81407       5.716319      -2.334008      10.59281  311.3873 48.87992 174.8396 77.73154 136.5477       91.82287 
1 1 1 16  5  6  o 394.7956 38.96727 31.11447       5.896533      32.36589       8.266301      29.81806       8.413563  397.5645 55.01393 379.9047 58.93595 17.65982       80.62244 
1 1 1 16  5  7  o 693.2094 38.54042 95.26829       10.33452      0.000000       0.000000      95.26829       10.33452  ?        ?        693.2094 38.54042 0.000000       38.54042 
1 1 1 16  5  8  o 136.5926 58.20713 0.3080130      5.430803      9.133085       7.901818      -7.592503      7.476452  217.9471 75.99593 125.5245 59.15782 92.42260       96.30695 
1 1 1 16  5  9  o 547.6970 28.24175 58.95758       5.986583      57.93025       8.412303      60.01171       8.521365  539.4977 40.44543 549.2256 40.23120 -9.727905      57.04720 
1 1 1 16  5  10 o 658.2541 26.50991 84.86277       6.776879      63.65819       13.31711      92.27297       7.872454  556.2836 62.73911 685.6776 29.56393 -129.3940      69.35576 
1 1 1 16  5  11 o 283.8106 54.48296 16.72368       5.786720      17.89962       11.62317      16.33615       6.672440  287.7356 92.03156 277.9208 63.24369 9.814819       111.6672 
1 1 1 16  5  12 o 497.9374 32.22553 49.02769       6.198239      34.94728       12.79734      53.34304       7.084667  398.6176 85.24803 518.5308 35.39317 -119.9132      92.30332 
1 1 1 16  5  13 o 336.8776 51.49804 23.36405       6.523387      27.34538       11.76364      21.59606       7.839119  349.6886 86.98203 318.3981 65.58031 31.29044       108.9342 
1 1 1 16  5  14 o 444.2928 35.52483 39.34815       6.078297      37.21598       12.51563      40.00628       6.953382  410.8867 81.31228 446.2921 40.56178 -35.40533      90.86773 
1 1 1 16  5  15 o 216.4994 60.67850 9.991559       5.306647      9.048844       8.498569      10.59401       6.793886  216.2401 78.45033 223.3056 70.24457 -7.065552      105.3032 
1 1 1 16  5  16 o 440.7117 36.29549 38.91177       6.156815      45.19467       8.897891      33.14040       8.527987  469.2169 49.58080 397.6905 56.83351 71.52646       75.42085 
1 1 1 16  5  17 o 116.1478 54.55212 -5.668181      6.262499      -7.298481      7.881945      -2.876853      10.31348  128.6561 60.66634 166.1243 75.04370 -37.46822      96.49850 
1 1 1 16  5  18 o 272.2110 72.54441 16.72411       7.807832      25.83945       11.63761      9.262321       10.52928  329.3540 88.91165 221.4839 85.81081 107.8700       123.5669 
1 1 1 16  5  19 o 134.5612 59.83598 -1.150144      6.279818      -2.420579      7.805575      1.181125       10.57364  144.1088 65.17477 180.8914 79.13931 -36.78256      102.5221 
1 1 1 16  5  20 o 141.5131 59.22096 1.669315       5.456756      0.5629361      7.841478      2.708136       7.598302  156.7516 68.37620 165.8166 69.66500 -9.065018      97.61412 
1 1 1 16  5  21 o 295.5482 51.80786 18.74297       5.729592      20.26385       8.301799      17.35962       7.917583  295.0137 72.88551 272.5405 73.23737 22.47327       103.3248 
1 1 1 16  6  0  f 958.6751 19.02057 179.3885       7.081461      180.4617       9.476762      178.0316       10.65604  959.5848 25.43013 951.8530 28.82691 7.731812       38.44064 
1 1 1 16  6  1  o 337.5078 40.39908 22.92054       5.189975      16.37819       6.473138      34.69573       8.684243  278.2184 61.54190 410.5795 55.91811 -132.3611      83.15191 
1 1 1 16  6  2  o 242.8119 58.58798 12.43338       5.461228      12.20029       5.980205      13.60418       13.40269  239.8611 63.28266 264.9116 98.12386 -25.05049      116.7604 
1 1 1 16  6  3  o 783.2479 22.21619 119.9080       6.757668      126.7688       7.699645      96.90231       14.09950  804.7386 24.63700 691.8405 52.87751 112.8981       58.33535 
1 1 1 16  6  4  o 552.3216 33.01733 60.28592       7.049661      64.67207       8.655944      51.64533       12.14911  570.0870 39.33788 499.0270 64.17636 71.05994       75.27333 
1 1 1 16  6  5  o 816.9301 25.91333 130.7072       8.221216      131.4586       10.16289      129.2845       13.98440  817.4366 32.01365 804.4363 44.94324 13.00024       55.17942 
1 1 1 16  6  6  o 567.5620 56.72289 65.64041       12.33514      0.000000       0.000000      65.64041       12.33514  ?        ?        567.5620 56.72289 0.000000       56.72289 
1 1 1 16  6  7  o 378.6862 44.83034 28.90126       6.464975      33.91199       8.166374      20.48838       10.58159  407.9160 52.78846 306.1824 85.63825 101.7336       100.6009 
1 1 1 16  6  8  o 485.7914 35.38210 46.76257       6.629278      41.67952       8.380785      55.25951       10.83562  454.5345 48.21384 521.6094 54.28630 -67.07486      72.60562 
1 1 1 16  6  9  o 237.6952 63.21943 11.91859       5.937215      11.80677       7.498833      12.10646       9.719710  237.7583 73.63797 245.4520 84.35900 -7.693665      111.9776 
1 1 1 16  6  10 o 238.9444 70.56466 12.04310       7.000513      -8.353813      12.86189      20.62913       8.344858  173.8718 80.48785 310.6129 70.75883 -136.7411      107.1686 
1 1 1 16  6  11 o 259.0997 66.87038 14.32118       6.774130      12.30976       11.98343      15.26580       8.212149  253.2313 92.95959 266.2812 75.78455 -13.04994      119.9366 
1 1 1 16  6  12 o 111.9543 53.30815 -7.614194      6.376343      -6.097680      11.70843      -8.253604      7.602654  170.2014 78.06345 124.2484 58.88538 45.95306       97.78236 
1 1 1 16  6  13 o 388.5649 40.43764 30.36594       6.012682      45.69297       12.60785      25.85387       6.840696  462.1457 72.64490 354.5007 51.16989 107.6450       88.85741 
1 1 1 16  6  14 o 416.0344 40.88733 34.86409       6.520775      3.017646       11.76507      48.98481       7.834163  202.3342 85.93391 493.6081 41.24582 -291.2740      95.31975 
1 1 1 16  6  15 o 286.1646 54.07409 17.22624       5.789213      4.609986       11.49400      21.51474       6.701294  206.5570 86.15289 319.8214 55.99408 -113.2644      102.7505 
1 1 1 16  6  16 o 221.4278 67.94073 10.56609       6.400393      5.458313       8.262007      18.23176       10.12150  190.2436 75.32250 282.4395 85.18536 -92.19591      113.7103 
1 1 1 16  6  17 o 297.8889 57.50300 18.98643       6.411381      25.58261       8.237715      8.851880       10.21087  343.4936 64.11131 218.9332 84.59261 124.5604       106.1422 
1 1 1 16  6  18 o 218.0575 63.39039 10.42246       5.689034      0.9611180      7.951602      20.34433       8.142824  161.1989 69.58891 300.6149 70.89947 -139.4160      99.34461 
1 1 1 16  6  19 o 232.5701 67.78856 12.16268       6.498170      -6.473310      11.11900      21.82939       8.008087  158.0594 73.73239 311.5903 68.08163 -153.5308      100.3572 
1 1 1 16  6  20 o 123.3385 55.38524 -1.570780      5.522031      -13.05235      7.920270      9.289296       7.702928  111.7258 54.66030 208.2838 74.80776 -96.55807      92.64960 
1 1 1 16  6  21 o 529.9266 29.37465 56.14034       6.021626      60.63851       8.683456      51.97341       8.357617  543.2354 41.47351 501.4592 43.34201 41.77615       59.98818 
1 1 1 16  7  0  o 507.2453 30.20708 50.81326       5.923571      49.99165       7.336502      52.35199       10.04013  500.6791 38.01512 506.9059 51.72638 -6.226776      64.19321 
1 1 1 16  7  1  o 474.9966 34.80485 44.80353       6.375640      49.01372       7.188946      29.29078       13.79936  496.0270 37.59874 358.2236 96.86538 137.8034       103.9065 
1 1 1 16  7  2  o 254.3919 68.46220 13.85688       6.912672      17.78955       8.150288      3.776354       13.04881  286.7671 72.99642 215.9784 91.04562 70.78874       116.6953 
1 1 1 16  7  3  o 463.5045 40.50558 42.95796       7.217932      41.28577       8.551210      47.10161       13.46096  451.0911 49.63408 469.3844 76.47830 -18.29330      91.17276 
1 1 1 16  7  4  f 386.0339 47.51715 30.21634       6.973279      29.87370       8.350428      31.00588       12.67575  379.8091 58.49002 373.7756 88.66353 6.033508       106.2182 
1 1 1 16  7  5  o 143.2104 62.09467 -0.3690204     6.387059      -6.096653      7.885022      10.56018       10.89205  134.8384 62.62885 239.1820 88.48429 -104.3436      108.4059 
1 1 1 16  7  6  o 603.0841 31.90534 71.73789       7.445975      80.67165       9.287319      55.66251       12.45815  637.7263 37.66688 519.1056 63.09465 118.6207       73.48285 
1 1 1 16  7  7  o 858.6989 24.69513 144.2856       8.235315      152.6405       10.48104      130.8045       13.31360  881.3966 30.61999 810.5184 42.44414 70.87817       52.33631 
1 1 1 16  7  8  o 104.9569 50.64114 -9.207901      6.192465      -7.406153      7.727464      -12.44143      10.35209  128.7742 60.51942 141.1193 67.39596 -12.34508      90.58044 
1 1 1 16  7  9  o 750.5353 28.56986 110.5338       8.327359      105.3239       15.24412      112.7496       9.941796  720.7570 54.87320 756.4317 33.84287 -35.67468      64.47021 
1 1 1 16  7  10 o 212.6748 70.16804 9.127061       6.727906      8.673949       12.57946      9.308600       7.962415  236.3013 93.13725 218.6364 76.28392 17.66490       120.3901 
1 1 1 16  7  11 o 607.6160 33.44873 73.04544       7.862506      79.06008       13.96242      70.25255       9.514443  620.6725 58.61966 592.8613 41.58721 27.81128       71.87323 
1 1 1 16  7  12 o 563.6822 33.97852 63.00786       7.403414      51.45198       13.03801      68.50697       8.994073  492.6857 70.12038 585.6340 39.78186 -92.94830      80.61926 
1 1 1 16  7  13 o 376.5826 46.96353 28.93083       6.719020      52.19094       12.53447      19.55237       7.959129  497.0496 66.61043 300.1353 69.63139 196.9142       96.36119 
1 1 1 16  7  14 o 376.2856 54.07455 29.42367       7.674988      32.45281       12.22651      27.45382       9.859595  378.8952 85.16367 353.6338 74.16074 25.26141       112.9277 
1 1 1 16  7  15 o 560.9310 38.73600 63.14637       8.386542      58.50473       12.95569      66.49419       11.00287  524.8546 64.94793 569.4952 50.26520 -44.64063      82.12687 
1 1 1 16  7  16 o 375.9264 38.13564 28.54427       5.490456      17.46978       8.596906      36.17289       7.135157  278.0774 76.98295 420.9391 44.31274 -142.8618      88.82563 
1 1 1 16  7  17 o 531.8381 30.05864 56.24282       6.182936      49.65128       8.908225      62.36972       8.588520  491.1577 47.28709 555.1811 40.10400 -64.02341      62.00322 
1 1 1 16  7  18 o 375.9814 40.85529 28.91602       5.869431      30.31463       8.422528      27.59555       8.183873  374.8177 59.87740 356.4521 61.33119 18.36554       85.71358 
1 1 1 16  7  19 o 172.7241 62.63404 5.797666       5.416318      0.9291598      7.695862      10.57605       7.624302  157.4281 68.20988 218.5129 74.72648 -61.08488      101.1763 
1 1 1 16  7  20 o 760.9373 23.22946 114.2770       6.864612      115.5063       9.964731      113.1667       9.470193  758.1852 33.84249 751.4871 32.44960 6.698120       46.88593 
1 1 1 16  8  0  o 392.2891 35.29708 30.68964       5.319831      28.39913       7.393155      33.14894       7.660733  371.3015 52.75501 402.7064 50.06445 -31.40497      72.72923 
1 1 1 16  8  1  o 134.0701 60.57524 -2.899807      6.723635      4.913758       7.879567      -23.82537      12.89485  186.9888 73.70909 139.2263 68.44696 47.76242       100.5884 
1 1 1 16  8  2  o 439.8745 86.34147 42.67627       14.22287      0.000000       0.000000      42.67627       14.22287  ?        ?        439.8745 86.34147 0.000000       86.34147 
1 1 1 16  8  3  f 433.3427 44.08168 37.81634       7.315234      38.66727       8.566689      35.52530       14.05666  435.4046 51.67168 397.5318 92.74745 37.87283       106.1699 
1 1 1 16  8  4  o 486.3104 39.06092 47.16642       7.314828      46.65874       8.643626      48.44741       13.73015  480.9120 46.87696 475.9446 76.90580 4.967407       90.06637 
1 1 1 16  8  5  o 802.2836 22.07557 125.8007       6.878090      122.7624       7.701454      137.7746       15.28878  791.7982 25.04553 828.5298 47.71741 -36.73169      53.89090 
1 1 1 16  8  6  o 484.9803 29.93587 46.38086       5.610680      49.95695       6.340064      33.46606       12.04852  502.6828 32.65364 392.2569 81.74377 110.4259       88.02445 
1 1 1 16  8  7  o 672.4439 26.66166 88.62343       6.962597      93.81846       9.896319      83.53150       9.797622  687.9245 37.18095 648.2937 39.09829 39.63080       53.95461 
1 1 1 16  8  8  o 184.5313 65.70179 6.232202       5.929503      0.1351075      8.293653      12.60732       8.480639  164.7828 71.10310 245.3621 78.62609 -80.57938      106.0081 
1 1 1 16  8  9  o 187.7182 67.14577 6.444849       6.199814      20.67646       12.66864      1.963079       7.109315  305.3737 95.89963 163.4413 67.92784 141.9325       117.5199 
1 1 1 16  8  10 o 272.5006 57.40350 15.60465       5.883030      -9.448136      12.03252      23.47492       6.744086  163.1948 76.31815 337.3222 53.24812 -174.1275      93.05817 
1 1 1 16  8  11 o 111.7752 53.00515 -6.895472      6.177881      -8.483077      12.27431      -6.356833      7.149487  167.3289 77.85934 125.2231 58.64566 42.10587       97.47508 
1 1 1 16  8  12 o 567.2875 64.39684 67.41158       13.93579      67.41158       13.93579      0.000000       0.000000  567.2875 64.39684 ?        ?        0.000000       64.39684 
1 1 1 16  8  13 o 582.4447 30.19283 67.10394       6.806028      60.90634       12.98193      69.45309       7.992493  538.4376 63.29109 590.7357 34.99458 -52.29810      72.32139 
1 1 1 16  8  14 o 327.9520 61.87729 22.99240       7.591835      33.99848       12.48656      16.53782       9.562265  386.5786 85.44532 271.2941 83.01096 115.2845       119.1290 
1 1 1 16  8  15 o 366.7484 48.58128 27.78457       6.749042      27.78997       12.09390      27.78213       8.133286  344.5495 89.55741 361.2856 60.07765 -16.73608      107.8418 
1 1 1 16  8  16 o 203.4588 66.81190 8.745377       6.102354      10.43209       10.78743      7.951604       7.400226  229.8317 87.40815 201.2301 73.17490 28.60155       113.9945 
1 1 1 16  8  17 o 350.0103 47.05957 25.45240       6.234628      21.95260       8.214070      30.20895       9.575978  313.2601 69.35067 368.8980 69.38873 -55.63797      98.10357 
1 1 1 16  8  18 o 199.7571 63.27738 8.664688       5.504935      15.58711       7.975334      2.365322       7.607961  259.6129 74.93520 164.5583 69.45265 95.05455       102.1712 
1 1 1 16  8  19 o 477.6547 35.97462 46.22956       6.624268      42.79990       11.57574      47.89958       8.077624  434.8972 70.98789 481.6010 43.66320 -46.70389      83.34120 
1 1 1 16  8  20 o 542.9116 32.51393 59.32042       6.823752      68.61214       12.29144      55.18080       8.204174  564.5281 56.83761 518.1575 41.10794 46.37067       70.14540 
1 1 1 16  9  0  o 524.2526 37.77917 54.85175       7.640126      53.08741       9.003146      59.39161       14.44190  512.5199 45.71286 527.6715 72.38183 -15.15161      85.60838 
1 1 1 16  9  1  o 307.5781 63.10934 20.10643       7.285602      23.21355       8.587280      12.12411       13.76389  328.4210 69.49608 256.1777 98.42149 72.24335       120.4844 
1 1 1 16  9  2  o 593.7103 34.05524 69.84966       7.819289      77.06609       9.508992      54.78045       13.74101  621.5645 39.59932 508.2009 71.60877 113.3635       81.82861 
1 1 1 16  9  3  o 150.2521 60.75855 2.351462       5.493110      7.272181       6.052243      -20.64932      13.08499  193.5946 66.56581 146.5908 71.39841 47.00381       97.61526 
1 1 1 16  9  4  o 830.1895 22.00926 134.7450       7.095952      138.5007       7.912729      119.3189       16.03666  841.0756 24.22497 766.4604 54.22612 74.61517       59.39125 
1 1 1 16  9  5  f 669.9990 24.44245 87.88764       6.359850      95.93197       7.085748      54.55057       14.42463  699.5923 26.08031 506.0894 75.71882 193.5029       80.08447 
1 1 1 16  9  6  o 301.6139 47.66091 18.61456       5.397190      18.29229       5.921025      20.19793       13.12436  297.1687 53.26220 302.3651 97.90863 -5.196411      111.4583 
1 1 1 16  9  7  o 472.7917 27.41660 43.99779       5.012367      39.23605       6.023091      54.72357       9.039634  444.4116 35.18613 521.8310 45.04754 -77.41943      57.16069 
1 1 1 16  9  8  o 632.7894 35.49984 79.36496       8.688728      102.3935       15.38990      68.59048       10.52691  708.5546 56.39548 583.7006 46.83335 124.8539       73.30630 
1 1 1 16  9  9  o 437.4901 44.30410 38.58644       7.423524      34.48006       13.18262      40.49334       8.983308  393.0822 88.48896 444.8383 53.04654 -51.75613      103.1709 
1 1 1 16  9  10 o 329.8745 53.60620 22.55476       6.631607      23.63801       12.27632      22.10841       7.880324  322.5549 92.93226 322.0118 65.25026 0.5431519      113.5518 
1 1 1 16  9  11 o 267.5796 62.26136 15.32429       6.348299      8.741197       12.78340      17.47923       7.313904  234.3999 93.41149 284.3735 67.27779 -49.97362      115.1174 
1 1 1 16  9  12 o 396.7427 43.67514 31.93321       6.617870      19.64734       12.72684      36.48635       7.747716  293.5789 96.49017 422.5457 48.06971 -128.9668      107.8010 
1 1 1 16  9  13 o 381.5403 39.19152 29.36730       5.724604      28.58562       12.40427      29.57884       6.452884  350.9543 90.44394 380.9248 44.45636 -29.97055      100.7793 
1 1 1 16  9  14 o 499.0464 30.46542 49.44580       5.876124      33.17270       12.63804      53.93406       6.637182  378.7719 87.65279 520.3010 33.01846 -141.5291      93.66553 
1 1 1 16  9  15 o 222.1112 59.53310 10.68458       5.239686      28.79507       11.98841      6.408147       5.825556  350.0636 88.21723 182.1771 65.09566 167.8865       109.6345 
1 1 1 16  9  16 o 223.0475 59.84818 10.85570       5.291926      5.644664       11.50279      12.25473       5.960115  207.0294 86.25395 235.7905 63.61855 -28.76106      107.1777 
1 1 1 16  9  17 o 363.6923 46.53710 27.50740       6.422229      13.22040       11.39003      34.16671       7.776228  243.7906 90.42578 403.4731 50.75091 -159.6825      103.6942 
1 1 1 16  9  18 o 353.5117 86.42780 30.39579       11.76613      30.39579       11.76613      0.000000       0.000000  353.5117 86.42780 ?        ?        0.000000       86.42780 
1 1 1 16  9  19 o 186.3988 75.56028 5.550945       8.517965      2.428061       10.98090      10.26901       13.49716  185.4402 80.90166 229.2577 94.27822 -43.81755      124.2315 
1 1 1 16  10 0  o 563.6525 36.96663 63.33371       8.047056      71.31374       9.772354      46.52549       14.18265  595.8119 42.51301 459.4514 82.51877 136.3605       92.82619 
1 1 1 16  10 1  o 474.4652 82.24677 49.34906       14.60563      0.000000       0.000000      49.34906       14.60563  ?        ?        474.4652 82.24677 0.000000       82.24677 
1 1 1 16  10 2  o 327.9110 48.74075 22.05532       6.018119      19.33795       6.654487      34.25914       14.10224  303.1751 58.63946 387.4157 94.56014 -84.24060      111.2664 
1 1 1 16  10 3  o 199.0172 62.76255 8.134750       5.420382      11.12698       5.944563      -6.622565      13.20158  228.8640 64.24973 180.0462 82.69408 48.81778       104.7203 
1 1 1 16  10 4  o 159.8193 62.09926 3.605587       5.526642      6.077452       6.096939      -7.783967      13.08738  183.6702 66.47597 176.0488 81.38804 7.621384       105.0860 
1 1 1 16  10 5  o 607.2300 26.49687 72.33009       6.248500      77.68520       6.905779      48.14743       14.67507  628.8661 28.27655 469.6036 83.52863 159.2625       88.18501 
1 1 1 16  10 6  o 961.1481 45.87991 184.8804       17.12540      0.000000       0.000000      184.8804       17.12540  ?        ?        961.1481 45.87991 0.000000       45.87991 
1 1 1 16  10 7  o 236.9482 65.03723 11.96138       6.166386      17.61953       6.939452      -9.273726      13.44358  287.6709 63.78812 174.6893 81.35065 112.9816       103.3772 
1 1 1 16  10 8  o 514.0109 38.95957 52.76731       7.719222      48.25397       13.78465      54.82921       9.317086  472.6434 77.80714 520.9877 46.53938 -48.34427      90.66348 
1 1 1 16  10 9  o 204.9901 72.32000 8.140135       7.168458      -8.370752      13.18600      15.06711       8.540819  174.3517 80.98438 262.7294 78.02917 -88.37764      112.4590 
1 1 1 16  10 10 o 831.1132 25.83403 135.6446       8.338354      134.5734       15.59847      136.0731       9.866367  814.4007 49.55484 830.5606 30.58849 -16.15991      58.23519 
1 1 1 16  10 11 o 487.8252 33.79873 47.36882       6.363667      49.76995       14.04324      46.74836       7.138676  476.1812 78.68788 482.9039 38.38191 -6.722717      87.54972 
1 1 1 16  10 12 o 424.3312 36.74706 36.11340       5.995796      23.41452       12.58493      39.84219       6.819495  315.7815 94.93080 444.6055 39.92110 -128.8240      102.9833 
1 1 1 16  10 13 o 121.0374 54.35299 -1.882114      5.318377      25.55234       11.77232      -8.917208      5.961407  330.4741 89.51321 101.8328 49.26798 228.6412       102.1761 
1 1 1 16  10 14 f 232.5698 59.15902 11.71824       5.355824      9.142917       12.46966      12.30080       5.930732  229.6935 92.01256 237.2193 63.22866 -7.525848      111.6431 
1 1 1 16  10 15 o 680.8945 23.51172 91.20415       6.217164      60.85233       13.51847      99.34591       7.001547  529.2656 67.29101 709.8707 25.39726 -180.6050      71.92426 
1 1 1 16  10 16 o 199.6698 63.73251 8.592991       5.576268      0.000000       0.000000      8.592991       5.576268  ?        ?        199.6698 63.73251 0.000000       63.73251 
1 1 1 16  10 17 o 182.0696 62.98159 6.848655       5.421980      0.000000       0.000000      6.848655       5.421980  ?        ?        182.0696 62.98159 0.000000       62.98159 
1 1 1 16  10 18 o 562.9739 28.90408 63.27364       6.298089      0.000000       0.000000      63.27364       6.298089  ?        ?        562.9739 28.90408 0.000000       28.90408 
1 1 1 16  10 19 o 590.1988 33.56284 70.30456       7.661028      67.53828       9.073770      77.17188       14.29661  573.1103 41.03986 591.2273 63.24703 -18.11700      75.39533 
1 1 1 16  11 0  o 527.8730 53.13357 57.20248       10.74444      43.25413       15.88196      68.97378       14.58998  432.0320 97.03090 571.4366 67.01694 -139.4045      117.9248 
1 1 1 16  11 1  o 318.4239 81.09889 22.60388       10.05617      5.512658       14.96216      36.68552       13.58109  231.0818 97.45673 402.8060 89.17365 -171.7242      132.0975 
1 1 1 16  11 2  o 923.4874 46.12214 171.2737       16.54125      0.000000       0.000000      171.2737       16.54125  ?        ?        923.4874 46.12214 0.000000       46.12214 
1 1 1 16  11 3  o 540.1014 35.09961 57.97260       7.322221      55.17727       8.319017      67.58524       15.42681  524.6120 41.16289 563.8704 72.09891 -39.25836      83.02190 
1 1 1 16  11 4  o 222.2531 96.08240 2.492704       15.20220      0.000000       0.000000      2.492704       15.20220  ?        ?        222.2531 96.08240 0.000000       96.08240 
1 1 1 16  11 5  o 323.4688 53.69130 21.70886       6.508224      19.95765       7.368021      27.92609       13.88287  306.0304 64.05100 347.7213 98.38687 -41.69083      117.3989 
1 1 1 16  11 6  o 160.5738 64.84505 2.873828       6.247778      11.22934       6.912073      -34.43512      14.60590  230.0655 70.60648 136.5633 68.11613 93.50215       98.10751 
1 1 1 16  11 7  o 296.7036 61.37566 18.70233       6.838749      18.70233       6.838749      0.000000       0.000000  296.7036 61.37566 ?        ?        0.000000       61.37566 
1 1 1 16  11 8  o 217.1713 74.87572 9.527179       7.660182      -4.036718      13.09958      16.57556       9.442998  185.8593 84.21023 273.6196 82.22563 -87.76030      117.6963 
1 1 1 16  11 9  o 435.8310 46.63576 38.67790       7.770922      29.86428       13.56847      42.97993       9.479604  357.5938 95.78201 455.8983 54.62999 -98.30447      110.2662 
1 1 1 16  11 10 o 634.1425 34.20775 80.00135       8.393245      67.37433       14.80212      85.98516       10.18972  561.3653 69.37316 654.5093 40.28403 -93.14404      80.22118 
1 1 1 16  11 11 o 340.6756 56.41056 24.45046       7.202120      19.79236       13.07086      26.48126       8.630446  291.9226 97.85191 350.1858 65.87886 -58.26315      117.9620 
1 1 1 16  11 12 o 385.2183 50.61970 30.77906       7.389413      29.17322       13.10493      31.52763       8.947463  349.8298 94.31326 384.0719 62.10720 -34.24213      112.9261 
1 1 1 16  11 13 o 244.8753 68.20001 13.26870       6.725910      10.61216       12.18479      14.43285       8.066098  235.7047 92.03384 253.3986 75.96007 -17.69385      119.3321 
1 1 1 16  11 14 o 246.8442 75.15324 13.74638       7.850864      0.000000       0.000000      13.74638       7.850864  ?        ?        246.8442 75.15324 0.000000       75.15324 
1 1 1 16  11 15 o 168.2340 69.02189 3.431439       7.213255      0.000000       0.000000      3.431439       7.213255  ?        ?        168.2340 69.02189 0.000000       69.02189 
1 1 1 16  11 16 f 543.7983 38.32240 60.05462       8.041393      0.000000       0.000000      60.05462       8.041393  ?        ?        543.7983 38.32240 0.000000       38.32240 
1 1 1 16  11 17 f 492.9048 28.28261 48.47414       5.391248      25.38237       12.72383      53.52702       5.951941  312.9813 95.75374 517.3043 29.75213 -204.3231      100.2695 
1 1 1 16  11 18 o 337.5031 38.99425 23.46606       5.016918      17.44980       12.33527      24.65849       5.491638  262.4938 94.62372 344.5877 41.89909 -82.09390      103.4852 
1 1 1 16  12 0  o 103.7644 52.33766 -30.05336      9.889686      -7.620373      14.78627      -48.21207      13.30324  186.4285 86.30011 111.5770 56.75006 74.85157       103.2874 
1 1 1 16  12 1  o 547.0775 39.11988 59.95807       8.256566      66.69324       9.675410      41.91190       15.83753  575.0077 43.65376 423.4773 98.20787 151.5304       107.4730 
1 1 1 16  12 2  o 489.7707 39.17487 48.08644       7.388875      44.91888       8.606307      56.96719       14.41048  469.6653 47.85307 513.9926 74.35320 -44.32721      88.42123 
1 1 1 16  12 3  f 540.4927 36.04719 58.21246       7.522998      67.77044       8.953588      35.26335       13.87385  581.7363 39.87230 392.1240 92.58780 189.6124       100.8082 
1 1 1 16  12 4  o 308.1615 57.45516 19.99215       6.623036      20.66985       7.456686      17.45949       14.41499  310.8911 63.89616 283.6788 102.2854 27.21231       120.6027 
1 1 1 16  12 5  o 751.2228 26.56353 110.8982       7.749658      110.8982       7.749658      0.000000       0.000000  751.2228 26.56353 ?        ?        0.000000       26.56353 
1 1 1 16  12 6  o 300.7250 53.64794 18.90932       6.035627      18.90932       6.035627      0.000000       0.000000  300.7250 53.64794 ?        ?        0.000000       53.64794 
1 1 1 16  12 7  o 640.9355 29.86564 81.04549       7.433856      89.04928       8.358637      50.76003       16.25941  671.0277 32.07503 471.3812 92.12141 199.6465       97.54568 
1 1 1 16  12 8  o 519.5405 40.34205 54.30001       8.075815      57.84338       14.20508      52.60782       9.816566  517.2935 72.71758 506.3714 50.59591 10.92212       88.58777 
1 1 1 16  12 9  o 170.8904 69.86333 3.261965       7.357489      21.45690       12.65555      -6.027258      9.042647  302.5889 95.95264 144.7695 67.18227 157.8194       117.1340 
1 1 1 16  12 10 o 503.0655 40.50151 51.08315       7.845648      45.66217       13.74743      53.70156       9.554358  450.7654 81.53259 511.6539 48.66996 -60.88855      94.95435 
1 1 1 16  12 11 o 95.62577 46.84460 -10.70640      5.873755      -8.347366      12.86748      -11.32736      6.601703  168.7785 78.92694 102.8046 50.21262 65.97385       93.54555 
1 1 1 16  12 12 o 513.1082 32.15480 52.51928       6.375048      48.63789       14.51660      53.44669       7.095915  460.2870 84.31701 516.0918 35.62218 -55.80478      91.53304 
1 1 1 16  12 13 o 567.4401 39.89516 65.21643       8.735696      0.000000       0.000000      65.21643       8.735696  ?        ?        567.4401 39.89516 0.000000       39.89516 
1 1 1 16  12 14 o 924.3085 28.86020 169.5042       10.35963      0.000000       0.000000      169.5042       10.35963  ?        ?        924.3085 28.86020 0.000000       28.86020 
1 1 1 16  12 15 o 253.8952 69.65357 14.72981       7.074924      0.000000       0.000000      14.72981       7.074924  ?        ?        253.8952 69.65357 0.000000       69.65357 
1 1 1 16  12 16 o 367.4061 45.50717 28.20760       6.354202      5.711651       12.60606      35.87015       7.357220  207.2156 88.50116 414.1908 46.54484 -206.9753      99.99438 
1 1 1 16  12 17 o 173.0852 65.93988 5.568169       6.145797      15.98369       12.82902      2.465943       7.001481  254.0270 95.62210 158.3931 66.72665 95.63383       116.6020 
1 1 1 16  12 18 o 152.2735 62.51090 2.913448       5.920947      3.590707       12.47791      2.716639       6.726455  195.7282 85.79174 157.2567 65.77508 38.47153       108.1045 
1 1 1 16  13 0  o 547.3367 40.40864 60.32380       8.528545      55.27702       10.35921      70.94014       15.02473  517.6862 52.24113 575.5889 68.56422 -57.90271      86.19853 
1 1 1 16  13 1  o 274.6240 59.99114 16.17072       6.219122      13.31983       6.991258      26.98080       13.61381  246.7098 69.82389 336.7907 98.10474 -90.08092      120.4156 
1 1 1 16  13 2  o 353.4724 46.54931 25.62538       6.234514      32.65688       6.971284      -2.464926      13.93372  400.0195 45.69485 194.9865 87.73216 205.0331       98.91891 
1 1 1 16  13 3  o 880.9579 24.40850 152.3789       8.350726      165.3976       9.876496      119.7346       15.63949  916.3410 27.75350 763.8401 53.05105 152.5009       59.87212 
1 1 1 16  13 4  o 375.2574 44.51345 28.70911       6.360578      28.70911       6.360578      0.000000       0.000000  375.2574 44.51345 ?        ?        0.000000       44.51345 
1 1 1 16  13 5  o 393.2766 42.43028 31.38416       6.377752      31.38416       6.377752      0.000000       0.000000  393.2766 42.43028 ?        ?        0.000000       42.43028 
1 1 1 16  13 6  o 239.5545 61.34244 12.39714       5.731592      12.39714       5.731592      0.000000       0.000000  239.5545 61.34244 ?        ?        0.000000       61.34244 
1 1 1 16  13 7  o 363.5299 46.63115 27.15722       6.431547      22.01031       7.072585      51.75108       15.46031  321.5642 58.80157 476.9299 86.66323 -155.3657      104.7289 
1 1 1 16  13 8  o 128.7432 54.91060 0.4643049      4.840809      11.03783       6.440105      -13.26923      7.339633  225.3850 67.94375 106.5714 52.23973 118.8136       85.70498 
1 1 1 16  13 9  o 286.3975 60.43346 17.71802       6.510361      10.28677       13.25529      20.08058       7.473948  238.3281 95.07494 302.9944 65.43110 -64.66634      115.4144 
1 1 1 16  13 10 o 166.7958 68.51439 3.105285       7.118253      0.000000       0.000000      3.105285       7.118253  ?        ?        166.7958 68.51439 0.000000       68.51439 
1 1 1 16  13 11 o 334.6721 54.90519 23.77582       6.888561      0.000000       0.000000      23.77582       6.888561  ?        ?        334.6721 54.90519 0.000000       54.90519 
1 1 1 16  13 12 o 128.7256 57.99702 -2.031921      6.113273      0.000000       0.000000      -2.031921      6.113273  ?        ?        128.7256 57.99702 0.000000       57.99702 
1 1 1 16  13 13 o 118.7214 54.64729 -3.388249      5.808271      0.000000       0.000000      -3.388249      5.808271  ?        ?        118.7214 54.64729 0.000000       54.64729 
1 1 1 16  13 14 o 122.1294 53.91341 -0.6930693     5.008563      -0.2090429     12.43302      -0.7868351     5.472231  185.7203 83.27219 126.9904 56.19151 58.72990       100.4577 
1 1 1 16  13 15 o 244.8371 52.81147 13.04406       4.873951      32.85278       12.68783      9.614939       5.278991  361.6730 90.54073 207.7223 61.25803 153.9507       109.3168 
1 1 1 16  13 16 o 379.4814 35.51559 29.35204       5.173172      17.03470       13.19594      31.58879       5.623298  259.1243 97.08943 392.8427 37.30672 -133.7185      104.0103 
1 1 1 16  13 17 o 267.9994 49.11062 15.47066       4.923005      13.46516       13.49849      15.77835       5.287175  239.8084 95.85036 268.9128 52.51119 -29.10439      109.2919 
1 1 1 16  14 0  o 184.5229 67.17245 6.439577       6.238398      6.112583       7.089692      7.561181       13.13036  186.6422 70.88997 225.1673 92.83807 -38.52507      116.8088 
1 1 1 16  14 1  o 446.2085 38.58151 40.16251       6.619895      43.77830       7.544088      28.05771       13.80333  464.2836 42.30466 339.4775 98.75588 124.8061       107.4356 
1 1 1 16  14 2  o 489.0752 33.55515 47.76572       6.334731      48.45875       7.093302      45.03549       14.07901  490.9627 37.48578 444.1953 84.70661 46.76740       92.63042 
1 1 1 16  14 3  o 229.2255 62.84741 11.42704       5.761883      14.92773       6.433199      -2.769118      12.95494  261.3755 63.91043 185.8386 84.01347 75.53694       105.5595 
1 1 1 16  14 4  o 475.0992 37.31998 45.38434       6.830376      45.38434       6.830376      0.000000       0.000000  475.0992 37.31998 ?        ?        0.000000       37.31998 
1 1 1 16  14 5  o 202.2898 65.74663 8.627324       5.914963      8.627324       5.914963      0.000000       0.000000  202.2898 65.74663 ?        ?        0.000000       65.74663 
1 1 1 16  14 6  f 144.5481 59.09068 2.148827       5.263052      -0.1071845     5.709632      14.90156       13.57498  134.8987 58.60016 261.7536 98.39561 -126.8549      114.5237 
1 1 1 16  14 7  o 179.3892 62.98473 6.329083       5.432182      6.974762       6.631609      5.012322       9.470312  190.3890 69.26482 193.6531 79.22641 -3.264038      105.2352 
1 1 1 16  14 8  o 337.3031 47.27813 23.61599       6.022973      22.69339       7.659098      25.11108       9.749991  322.7062 63.37578 331.8828 77.11665 -9.176666      99.81717 
1 1 1 16  14 9  o 268.7463 70.54053 16.26195       7.455397      0.000000       0.000000      16.26195       7.455397  ?        ?        268.7463 70.54053 0.000000       70.54053 
1 1 1 16  14 10 o 124.6514 57.85584 -4.553206      6.710347      0.000000       0.000000      -4.553206      6.710347  ?        ?        124.6514 57.85584 0.000000       57.85584 
1 1 1 16  14 11 o 424.8698 41.08244 36.90349       6.693992      0.000000       0.000000      36.90349       6.693992  ?        ?        424.8698 41.08244 0.000000       41.08244 
1 1 1 16  14 12 o 205.4016 62.05556 9.274847       5.367921      5.892608       12.38750      10.05679       5.956193  209.1868 88.47377 212.9532 65.57406 -3.766342      110.1252 
1 1 1 16  14 13 o 186.2794 61.49446 7.425372       5.167143      -14.55651      12.92840      11.60427       5.636941  150.7285 72.83479 227.6184 62.06123 -76.88998      95.68961 
1 1 1 16  14 14 o 255.5333 52.18512 14.17764       5.003616      48.03671       13.24697      8.543050       5.403935  451.8953 78.32137 196.7177 62.73465 255.1776       100.3488 
1 1 1 16  14 15 o 176.5086 58.84219 6.669477       4.726804      -3.746357      12.29314      8.476590       5.120454  170.5823 78.86751 195.2381 60.91265 -24.65573      99.65157 
1 1 1 16  14 16 o 292.3090 43.22231 17.98870       4.758615      20.01660       12.60404      17.65158       5.138947  273.5349 95.94627 287.1552 47.75930 -13.62024      107.1757 
1 1 1 16  15 0  o 127.4804 58.18641 -3.018763      6.400768      -6.482863      7.343493      7.934618       13.05815  124.6624 58.71430 223.4259 92.39301 -98.76352      109.4707 
1 1 1 16  15 1  o 507.5369 35.27599 51.77512       6.909840      52.94065       8.044385      48.49512       13.49485  510.2855 40.93770 462.7224 77.86124 47.56308       87.96742 
1 1 1 16  15 2  o 119.4871 55.05714 -3.619415      5.916603      -7.255617      6.756489      8.339452       12.25299  115.8343 55.07551 222.7021 90.49993 -106.8678      105.9413 
1 1 1 16  15 3  o 522.5477 36.62051 54.98421       7.384570      54.98421       7.384570      0.000000       0.000000  522.5477 36.62051 ?        ?        0.000000       36.62051 
1 1 1 16  15 4  o 711.5079 31.39077 100.6530       8.673805      100.6530       8.673805      0.000000       0.000000  711.5079 31.39077 ?        ?        0.000000       31.39077 
1 1 1 16  15 5  o 373.5636 49.36103 29.11049       6.985663      29.11049       6.985663      0.000000       0.000000  373.5636 49.36103 ?        ?        0.000000       49.36103 
1 1 1 16  15 6  o 192.3218 62.97139 7.816812       5.422418      10.07287       6.093882      -0.7614622     11.88281  214.4633 66.37553 182.9139 81.75379 31.54936       105.3062 
1 1 1 16  15 7  o 256.0020 59.77912 14.35769       5.835434      16.92903       7.441326      10.25096       9.404146  273.7571 69.78450 222.0057 82.20115 51.75137       107.8281 
1 1 1 16  15 8  o 496.3091 31.77980 49.27722       6.093184      54.53315       8.117614      42.49429       9.221722  517.4435 40.72506 448.5217 54.02925 68.92175       67.65863 
1 1 1 16  15 9  o 293.6132 58.66145 18.78865       6.454912      39.03136       15.00366      14.19090       7.150491  393.1575 98.47688 249.6622 70.59888 143.4953       121.1689 
1 1 1 16  15 10 o 833.2601 23.03214 136.8380       7.453200      102.5498       15.23285      147.6302       8.546031  693.8931 57.03233 864.0793 25.46730 -170.1862      62.46015 
1 1 1 16  15 11 o 393.5861 35.70790 31.44105       5.398571      45.59053       13.34461      28.67217       5.903203  439.9821 81.08614 372.9382 41.46074 67.04388       91.07115 
1 1 1 16  15 12 o 316.2049 41.40051 20.74324       4.961844      6.602864       12.06040      23.62436       5.443916  208.0054 87.59876 337.1702 42.52074 -129.1649      97.37328 
1 1 1 16  15 13 o 315.2679 40.77314 20.64564       4.875124      13.96590       12.20070      21.91478       5.318128  242.0574 92.74273 323.5902 43.41383 -81.53278      102.4010 
1 1 1 16  15 14 o 257.9966 47.26167 14.27953       4.560832      15.51357       12.63805      14.09475       4.890386  248.5856 94.59272 254.2554 51.29660 -5.669861      107.6063 
1 1 1 16  15 15 o 406.2841 30.88987 33.34528       4.837365      40.03654       12.67356      32.20421       5.233597  401.1978 84.03349 397.4936 34.23736 3.704224       90.74042 
1 1 1 16  16 0  o 219.0347 72.21255 10.74290       7.126174      3.865391       8.414130      28.19241       13.40248  177.6058 73.86388 330.6428 97.63493 -153.0370      122.4273 
1 1 1 16  16 1  o 425.2849 44.33210 37.39359       7.214316      40.05025       8.686910      31.48869       12.95101  435.1833 52.45761 355.1713 92.85092 80.01205       106.6447 
1 1 1 16  16 2  o 310.8337 59.37827 21.10009       6.906394      27.29635       8.348186      7.662248       12.29397  352.0035 63.40030 216.6576 89.62589 135.3460       109.7834 
1 1 1 16  16 3  o 149.9983 65.43642 0.2747892      7.183170      0.2747892      7.183170      0.000000       0.000000  149.9983 65.43642 ?        ?        0.000000       65.43642 
1 1 1 16  16 4  o 372.4164 51.14462 29.28582       7.201721      29.28582       7.201721      0.000000       0.000000  372.4164 51.14462 ?        ?        0.000000       51.14462 
1 1 1 16  16 5  o 633.0853 28.17287 79.54504       6.926620      85.88026       8.352539      65.59389       12.39489  654.4571 32.96898 553.1804 58.58802 101.2767       67.22729 
1 1 1 16  16 6  o 160.1664 63.98865 3.699708       6.012928      15.95805       7.962850      -12.56366      9.171872  262.1069 74.63541 125.2292 60.71370 136.8778       96.21121 
1 1 1 16  16 7  o 448.9887 32.30105 40.50472       5.594591      36.12287       6.952664      48.55335       9.422878  418.2500 43.43787 480.1046 51.33377 -61.85461      67.24585 
1 1 1 16  16 8  o 170.6112 59.63583 5.884754       4.867295      8.148433       5.896776      1.045314       8.621936  194.7354 65.72186 164.7752 71.79208 29.96021       97.33173 
1 1 1 16  16 9  o 122.7053 55.40446 -1.870422      5.614191      2.292136       12.97326      -2.829584      6.227517  196.1323 86.66582 125.1691 57.23319 70.96323       103.8586 
1 1 1 16  16 10 o 90.32803 44.27784 -9.430967      5.273179      -12.57527      13.18226      -8.831977      5.753567  155.6678 74.79781 98.03653 47.65773 57.63129       88.69031 
1 1 1 16  16 11 o 142.4796 58.37614 2.407615       5.151006      -12.83187      11.70823      6.065213       5.735936  143.9540 69.50134 174.6862 64.28562 -30.73218      94.67354 
1 1 1 16  16 12 o 202.3449 56.19032 9.133917       4.572687      -7.348393      12.62386      11.62312       4.905840  162.2751 76.59751 228.2965 55.80323 -66.02136      94.76909 
1 1 1 16  16 13 o 235.6922 48.56294 12.06722       4.297181      -14.93822      12.46923      15.70677       4.577599  143.8031 69.96444 271.6097 44.97100 -127.8066      83.17099 
1 1 1 16  16 14 o 140.6922 53.95201 3.384465       4.131176      4.433969       12.21865      3.249007       4.389691  194.5916 85.10461 141.5123 55.24439 53.07932       101.4630 
1 1 1 16  17 0  o 225.5735 70.52528 11.77820       6.860034      10.94075       8.202373      13.72741       12.51375  219.0503 77.35125 241.4627 93.54924 -22.41246      121.3865 
1 1 1 16  17 1  o 321.5020 57.01743 22.63335       6.858330      18.86165       8.063503      32.49848       13.04086  283.1049 72.90163 355.3629 93.30374 -72.25800      118.4071 
1 1 1 16  17 2  o 170.3258 67.33630 4.784797       6.593788      4.918798       7.704242      4.417852       12.74901  177.7977 71.93506 201.8074 87.61535 -24.00966      113.3627 
1 1 1 16  17 3  o 261.1909 70.08646 15.83365       7.257159      15.83365       7.257159      0.000000       0.000000  261.1909 70.08646 ?        ?        0.000000       70.08646 
1 1 1 16  17 4  o 654.7903 31.94467 85.93053       8.123227      85.93053       8.123227      0.000000       0.000000  654.7903 31.94467 ?        ?        0.000000       31.94467 
1 1 1 16  17 5  o 331.8877 43.45102 22.97054       5.465897      25.68552       6.323263      14.94559       10.87122  348.7254 47.95995 248.6889 88.91801 100.0365       101.0276 
1 1 1 16  17 6  o 126.2975 55.16689 -0.9063008E-01 5.119912      -0.3508968     6.482467      0.3409314      8.347420  139.0410 61.35936 158.4388 69.78892 -19.39775      92.92720 
1 1 1 16  17 7  o 274.4969 50.13506 16.20692       5.147557      21.26545       6.485348      7.594003       8.462452  312.1897 55.52660 197.4175 76.80543 114.7722       94.77488 
1 1 1 16  17 8  o 297.3145 42.06145 18.47203       4.721017      14.36836       5.648067      27.98684       8.600302  253.5453 58.54462 351.6013 65.39148 -98.05600      87.76968 
1 1 1 16  17 9  o 369.6090 29.78083 27.50585       4.238450      27.25915       5.621458      27.83087       6.452192  362.5225 40.62753 362.6248 46.91652 -0.1022949     62.06252 
1 1 1 16  17 10 o 435.6010 33.74200 38.57133       5.663517      5.947775       13.22921      45.89215       6.266836  205.8342 89.30677 475.0593 34.19696 -269.2251      95.63018 
1 1 1 16  17 11 o 309.0237 44.09452 20.20979       5.141741      46.44152       13.05525      15.39387       5.593853  436.2120 80.01411 262.1807 56.59738 174.0313       98.00776 
1 1 1 16  17 12 o 686.1970 26.31300 93.92063       7.012086      77.63213       13.76824      99.62522       8.147977  588.7578 61.10627 704.0988 29.79807 -115.3410      67.98457 
1 1 1 16  17 13 o 344.4686 34.10244 24.31828       4.502148      25.80621       13.03373      24.11670       4.797444  301.1098 97.57702 341.6141 36.73897 -40.50433      104.2642 
1 1 1 16  18 0  o 208.9568 67.23099 10.10796       6.195847      17.37175       7.242742      -9.712236      11.96397  270.9081 68.73241 150.9573 72.19398 119.9508       99.68006 
1 1 1 16  18 1  o 116.2271 53.88558 -3.502593      5.797289      -8.719543      6.741662      11.30424       11.35768  108.9922 52.64986 223.3960 88.35619 -114.4037      102.8534 
1 1 1 16  18 2  o 424.6938 44.58820 37.87190       7.244248      37.87190       7.244248      0.000000       0.000000  424.6938 44.58820 ?        ?        0.000000       44.58820 
1 1 1 16  18 3  o 346.5851 49.66374 25.76280       6.493555      25.76280       6.493555      0.000000       0.000000  346.5851 49.66374 ?        ?        0.000000       49.66374 
1 1 1 16  18 4  o 91.07381 44.40744 -8.244301      5.101815      -0.6169044     5.772459      -35.46713      10.90534  129.5803 57.50640 102.9665 52.27034 26.61385       77.71212 
1 1 1 16  18 5  o 114.5599 51.90952 -1.791119      4.978727      0.9899713      5.646892      -11.50100      10.55137  137.1850 58.92847 137.1212 66.14587 0.6385803E-01  88.58804 
1 1 1 16  18 6  o 213.4607 61.10989 10.39255       5.323622      12.04069       6.581637      7.273792       9.053757  226.4328 68.78217 195.3571 78.35182 31.07568       104.2593 
1 1 1 16  18 7  o 195.4335 58.86623 8.596626       4.835680      10.76701       6.038287      4.715660       8.074498  215.3820 65.97507 176.0304 72.71214 39.35159       98.18230 
1 1 1 16  18 8  o 402.2899 30.82968 32.74942       4.779897      39.31916       5.909585      20.31943       8.128644  438.5129 34.99276 290.4077 72.34300 148.1052       80.36170 
1 1 1 16  18 9  o 206.1753 49.61525 9.378879       3.924557      5.657740       5.192101      14.33862       5.994245  166.8180 61.19660 248.7825 62.20637 -81.96449      87.26199 
1 1 1 16  18 10 o 144.5157 58.48859 3.006854       5.094997      5.424274       12.33511      2.509582       5.594539  196.7656 85.79659 145.0298 60.26554 51.73581       104.8475 
1 1 1 16  18 11 o 209.3197 58.62565 10.07120       4.955444      -4.105139      12.73268      12.60179       5.379586  167.7042 78.45248 233.8750 59.18082 -66.17081      98.27085 
1 1 1 16  18 12 o 224.6558 51.29649 11.24694       4.377057      25.94780       12.83936      9.313744       4.655967  299.7931 96.81513 201.9126 56.92380 97.88054       112.3098 
1 1 1 16  19 0  o 117.5612 53.76500 -2.150905      5.499252      -2.117360      6.379051      -2.247977      10.85153  126.8793 57.98020 161.0455 74.33193 -34.16627      94.27057 
1 1 1 16  19 1  o 404.8840 36.66220 33.88807       5.702179      39.11153       6.606848      18.63604       11.28960  432.9319 39.73944 260.0634 90.82888 172.8685       99.14187 
1 1 1 16  19 2  o 142.1484 60.79379 1.604905       5.963016      1.604905       5.963016      0.000000       0.000000  142.1484 60.79379 ?        ?        0.000000       60.79379 
1 1 1 16  19 3  o 278.2986 59.43591 17.71007       6.228512      17.71007       6.228512      0.000000       0.000000  278.2986 59.43591 ?        ?        0.000000       59.43591 
1 1 1 16  19 4  o 291.9028 46.77985 18.37606       5.123950      16.85675       5.885600      23.13303       10.41437  272.7261 57.38655 295.5853 85.72079 -22.85922      103.1565 
1 1 1 16  19 5  o 162.6014 59.79324 5.363824       4.960944      8.175746       5.774928      -2.555331      9.691353  189.8393 65.03453 153.2072 70.54626 36.63208       95.94929 
1 1 1 16  19 6  o 445.3531 31.91966 40.36469       5.484044      49.58829       6.950309      25.14987       8.926622  490.2483 36.77357 320.6566 73.28372 169.5916       81.99268 
1 1 1 16  19 7  o 186.1087 58.90701 7.873905       4.771510      13.72720       5.935348      -2.820530      8.022780  241.6189 62.70866 139.0596 64.08922 102.5593       89.66496 
1 1 1 16  19 8  o 356.0112 34.69374 26.11919       4.735750      26.72573       5.781841      24.88282       8.254900  354.9978 42.80171 322.8749 67.98290 32.12296       80.33468 
1 1 1 16  19 9  o 390.3354 30.10503 30.94480       4.528327      32.13177       5.531794      28.53375       7.884070  393.7553 36.59389 353.6016 59.52734 40.15375       69.87572 
1 1 1 16  19 10 o 277.6981 49.61782 16.97880       5.154677      40.20451       13.13385      12.74982       5.604349  386.2862 89.33096 232.9286 61.16976 153.3576       108.2671 
1 1 1 16  19 11 o 144.6931 56.94739 3.544406       4.696485      2.889718       13.50347      3.634498       5.009213  189.3972 85.68416 147.5748 58.57981 41.82245       103.7948 
1 1 1 16  20 0  o 377.4767 40.52705 30.24545       5.848059      24.68468       6.657452      49.03416       12.23740  330.4974 53.71393 443.0790 73.70750 -112.5816      91.20297 
1 1 1 16  20 1  o 129.9501 55.77200 1.230375       5.050265      3.437037       5.761284      -6.091041      10.49419  149.9229 61.61766 145.1469 68.90370 4.776047       92.43623 
1 1 1 16  20 2  o 242.1772 58.42518 13.72362       5.431605      13.72362       5.431605      0.000000       0.000000  242.1772 58.42518 ?        ?        0.000000       58.42518 
1 1 1 16  20 3  f 221.8484 63.98851 11.88879       5.817311      11.88879       5.817311      0.000000       0.000000  221.8484 63.98851 ?        ?        0.000000       63.98851 
1 1 1 16  20 4  o 165.5520 58.19194 5.998630       4.637536      8.874704       5.355835      -2.618393      9.270556  193.9220 62.51954 147.5155 68.30333 46.40645       92.59610 
1 1 1 16  20 5  o 288.8177 48.23417 18.34588       5.219315      17.91828       6.565559      19.08009       8.603214  274.4367 62.94287 269.8673 77.80994 4.569397       100.0809 
1 1 1 16  20 6  o 256.8211 50.58755 14.74694       4.865972      12.45905       6.063812      18.88470       8.154739  226.2864 65.34802 271.1339 74.94453 -44.84750      99.43363 
1 1 1 16  20 7  o 261.2059 47.82165 15.04445       4.672277      15.49580       5.825535      14.23059       7.822614  257.1148 59.51789 234.6407 75.54823 22.47412       96.17648 
1 1 1 16  20 8  o 182.0843 55.21849 7.599907       4.244393      4.409061       5.141518      14.42656       7.520423  153.5316 59.82950 237.3828 73.78055 -83.85120      94.99020 
1 1 1 16  20 9  o 98.53988 44.91467 -1.607261      3.797213      -0.2233952     4.519989      -4.926534      7.000223  115.7651 51.15443 121.1477 57.14007 -5.382622      76.69266 
1 1 1 16  21 0  o 226.2392 61.49204 12.63638       5.544228      13.72177       6.232020      8.517259       12.14054  232.1631 65.99930 194.1161 84.86606 38.04700       107.5089 
1 1 1 16  21 1  o 117.1927 53.00551 -0.9516066     5.163911      1.616658       5.811014      -10.59484      11.26013  136.8250 59.27719 136.7669 66.52832 0.5809021E-01  89.10557 
1 1 1 16  21 2  o 251.5885 55.38270 14.81655       5.264606      14.81655       5.264606      0.000000       0.000000  251.5885 55.38270 ?        ?        0.000000       55.38270 
1 1 1 16  21 3  o 188.3651 60.31715 8.514384       4.991576      8.514384       4.991576      0.000000       0.000000  188.3651 60.31715 ?        ?        0.000000       60.31715 
1 1 1 16  21 4  o 144.6254 56.87354 3.834928       4.680678      8.747845       5.321298      -12.96359      9.839735  190.3341 62.38442 123.0890 60.36654 67.24509       86.80977 
1 1 1 16  21 5  o 129.0374 54.62196 1.686868       4.728072      1.655895       5.967921      1.739078       7.748402  139.1571 60.17989 151.9577 67.07035 -12.80060      90.11133 
1 1 1 16  21 6  o 208.8112 56.86826 10.30471       4.736247      11.38384       5.957619      8.451357       7.807567  214.1626 65.52145 189.4243 73.75198 24.73837       98.65300 
1 1 1 16  21 7  o 215.5772 54.90234 10.83549       4.608925      16.97742       5.802067      0.3323312      7.587354  269.6454 57.18000 145.0672 65.04741 124.5782       86.60668 
1 1 1 16  22 0  o 117.7634 53.16542 -0.5101733     5.167436      1.719049       5.743957      -9.972713      11.83418  134.5181 58.60371 138.0453 67.38168 -3.527206      89.30109 
1 1 1 16  22 1  f 173.0246 61.26955 7.261549       5.149749      1.371456       5.759368      30.74954       11.50103  133.2310 58.34461 313.4435 89.84623 -180.2124      107.1281 
1 1 1 16  22 2  o 142.6218 58.89802 3.348270       5.296047      3.348270       5.296047      0.000000       0.000000  142.6218 58.89802 ?        ?        0.000000       58.89802 
1 1 1 16  22 3  o 261.7663 50.96444 15.77298       4.994581      15.77298       4.994581      0.000000       0.000000  261.7663 50.96444 ?        ?        0.000000       50.96444 
1 1 1 16  22 4  o 210.6594 54.70630 10.53788       4.515394      10.65644       5.065496      10.07923       9.963058  208.5719 59.57556 197.4062 81.06906 11.16566       100.6054 
1 1 1 17  0  0  o 321.1564 69.92564 23.07140       7.641784      23.07140       7.641784      23.07140       7.641784  321.1564 69.92564 321.1564 69.92564 0.000000       0.000000 
1 1 1 17  0  1  o 265.0158 83.63828 17.57620       7.566142      17.57620       7.566142      17.57620       7.566142  265.0158 83.63828 265.0158 83.63828 0.000000       0.000000 
1 1 1 17  0  2  o 497.3796 40.88844 49.45365       7.775190      49.45365       7.775190      49.45365       7.775190  497.3796 40.88844 497.3796 40.88844 0.000000       0.000000 
1 1 1 17  0  3  o 254.7800 109.1117 18.85995       11.03344      18.85995       11.03344      18.85995       11.03344  254.7800 109.1117 254.7800 109.1117 0.000000       0.000000 
1 1 1 17  0  4  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 17  0  5  o 145.9672 85.11706 5.412660       7.996452      5.412660       7.996452      5.412660       7.996452  145.9672 85.11706 145.9672 85.11706 0.000000       0.000000 
1 1 1 17  0  6  o 237.2441 96.77778 15.89344       8.769195      15.89344       8.769195      15.89344       8.769195  237.2441 96.77778 237.2441 96.77778 0.000000       0.000000 
1 1 1 17  0  7  o 721.3780 36.21892 102.7008       10.08838      102.7008       10.08838      102.7008       10.08838  721.3780 36.21892 721.3780 36.21892 0.000000       0.000000 
1 1 1 17  0  8  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 17  0  9  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 17  0  10 o 94.04039 64.91805 -5.570281      7.964636      -5.570281      7.964636      -5.570281      7.964636  94.04039 64.91805 94.04039 64.91805 0.000000       0.000000 
1 1 1 17  0  11 f 376.6699 62.03761 30.58924       8.334939      30.58924       8.334939      30.58924       8.334939  376.6699 62.03761 376.6699 62.03761 0.000000       0.000000 
1 1 1 17  0  12 o 406.4056 53.28993 34.62724       8.009988      34.62724       8.009988      34.62724       8.009988  406.4056 53.28993 406.4056 53.28993 0.000000       0.000000 
1 1 1 17  0  13 o 156.1878 81.82679 7.569800       6.536933      7.569800       6.536933      7.569800       6.536933  156.1878 81.82679 156.1878 81.82679 0.000000       0.000000 
1 1 1 17  0  14 o 134.8221 83.25839 3.934282       8.571006      3.934282       8.571006      3.934282       8.571006  134.8221 83.25839 134.8221 83.25839 0.000000       0.000000 
1 1 1 17  0  15 o 174.6512 92.63409 10.06929       8.454984      10.06929       8.454984      10.06929       8.454984  174.6512 92.63409 174.6512 92.63409 0.000000       0.000000 
1 1 1 17  0  16 o 315.8074 81.78451 24.75453       8.668446      24.75453       8.668446      24.75453       8.668446  315.8074 81.78451 315.8074 81.78451 0.000000       0.000000 
1 1 1 17  0  17 o 189.9948 91.10381 12.06180       7.747501      12.06180       7.747501      12.06180       7.747501  189.9948 91.10381 189.9948 91.10381 0.000000       0.000000 
1 1 1 17  0  18 o 347.8829 66.88761 28.19758       8.071444      28.19758       8.071444      28.19758       8.071444  347.8829 66.88761 347.8829 66.88761 0.000000       0.000000 
1 1 1 17  0  19 o 92.32706 63.66455 -3.574416      7.610400      -3.574416      7.610400      -3.574416      7.610400  92.32706 63.66455 92.32706 63.66455 0.000000       0.000000 
1 1 1 17  0  20 o 308.3602 75.89185 24.25586       7.869267      24.25586       7.869267      24.25586       7.869267  308.3602 75.89185 308.3602 75.89185 0.000000       0.000000 
1 1 1 17  1  0  o 786.8168 21.49732 121.1577       6.568799      108.9524       9.218186      133.7492       9.362873  742.6300 31.96281 823.9524 29.26032 -81.32239      43.33345 
1 1 1 17  1  1  o 475.4439 31.18157 44.77563       5.725495      50.30782       8.013666      39.00698       8.183138  500.3495 41.61869 437.2417 49.03639 63.10776       64.31705 
1 1 1 17  1  2  o 754.4703 25.56328 111.6794       7.490087      114.9640       13.13364      110.0961       9.118260  756.2041 44.92348 747.1415 31.42542 9.062561       54.82405 
1 1 1 17  1  3  o 224.6608 56.60977 10.66734       4.937048      -0.6111605     6.755321      23.59813       7.233237  145.2166 63.40109 336.1418 57.47439 -190.9252      85.57455 
1 1 1 17  1  4  o 449.3015 32.56811 40.01751       5.644168      39.52722       6.448754      41.62277       11.66873  445.0000 37.66901 442.7460 70.20696 2.253998       79.67416 
1 1 1 17  1  5  o 273.0037 58.79683 15.71865       6.049571      7.837769       8.525605      23.71062       8.585479  210.1388 78.17603 332.9940 68.67049 -122.8551      104.0535 
1 1 1 17  1  6  o 476.9556 49.96844 46.18832       9.118124      0.000000       0.000000      46.18832       9.118124  ?        ?        476.9556 49.96844 0.000000       49.96844 
1 1 1 17  1  7  o 680.1211 37.57898 91.88702       9.887151      91.88702       9.887151      0.000000       0.000000  680.1211 37.57898 ?        ?        0.000000       37.57898 
1 1 1 17  1  8  o 298.2489 54.52388 18.50272       6.082571      23.01438       8.316777      13.31420       8.918856  328.5388 67.44325 250.6744 80.66386 77.86438       105.1440 
1 1 1 17  1  9  o 225.8841 62.73595 10.81442       5.699662      10.88008       8.151540      10.75161       7.972519  230.2717 77.27420 228.7862 76.42271 1.485443       108.6818 
1 1 1 17  1  10 o 387.8294 56.51780 31.19147       8.262220      0.000000       0.000000      31.19147       8.262220  ?        ?        387.8294 56.51780 0.000000       56.51780 
1 1 1 17  1  11 o 508.6486 31.63581 51.26019       6.218249      45.47516       8.783957      57.07156       8.803942  472.5771 48.55207 532.4714 42.93991 -59.89423      64.81620 
1 1 1 17  1  12 o 378.7618 39.60637 28.91784       5.739686      13.48899       7.960314      45.62542       8.283618  248.6590 75.66851 474.1065 45.55071 -225.4475      88.32095 
1 1 1 17  1  13 o 264.6802 58.99023 15.00137       5.908654      3.702808       11.72712      18.84549       6.840351  203.4660 86.07030 296.3989 61.44311 -92.93291      105.7514 
1 1 1 17  1  14 o 470.0981 36.19442 44.30148       6.557005      46.37977       9.243483      42.19642       9.302813  473.9497 51.02393 450.1027 54.31800 23.84702       74.52440 
1 1 1 17  1  15 o 253.6548 61.93692 14.03616       6.048364      6.160457       8.557085      21.89933       8.550275  195.1170 76.84464 313.2315 71.82085 -118.1145      105.1824 
1 1 1 17  1  16 o 247.6422 61.34887 13.44870       5.869660      20.69292       8.254397      6.038720       8.348306  303.2742 71.28750 192.1341 75.82766 111.1402       104.0757 
1 1 1 17  1  17 o 274.0161 54.30738 16.15284       5.574882      13.74348       7.705950      18.79860       8.075148  245.2717 74.40788 286.6843 72.48729 -41.41264      103.8794 
1 1 1 17  1  18 o 156.0518 61.48764 3.721411       5.481025      2.863280       7.699243      4.603168       7.804509  167.1886 70.17783 177.7866 72.23499 -10.59799      100.7116 
1 1 1 17  1  19 o 453.4265 34.01187 41.57455       5.945516      47.15874       8.521671      36.27813       8.299201  474.9416 46.81018 411.9265 53.11605 63.01508       70.79907 
1 1 1 17  1  20 o 345.1280 42.50866 24.79618       5.577089      15.71353       7.758349      34.50827       8.022680  257.5178 73.78664 401.1249 52.78223 -143.6072      90.72173 
1 1 1 17  2  0  o 261.5266 63.78152 14.72440       6.419906      12.46627       11.22582      15.82187       7.825985  247.9643 90.13233 268.6735 73.07149 -20.70918      116.0314 
1 1 1 17  2  1  o 340.0838 59.58712 24.34398       7.583008      0.000000       0.000000      24.34398       7.583008  ?        ?        340.0838 59.58712 0.000000       59.58712 
1 1 1 17  2  2  o 487.2972 30.26066 46.95554       5.698340      47.50048       7.837445      46.34441       8.299752  486.1628 41.92099 478.8792 45.16173 7.283661       61.61941 
1 1 1 17  2  3  o 704.3255 30.71521 97.73292       8.401463      97.73292       8.401463      0.000000       0.000000  704.3255 30.71521 ?        ?        0.000000       30.71521 
1 1 1 17  2  4  o 248.1788 57.85333 13.02198       5.473071      14.19951       6.275205      9.279024       11.18790  257.9598 63.14854 231.3988 88.77419 26.56097       108.9431 
1 1 1 17  2  5  o 374.2709 109.0021 33.01071       16.80760      0.000000       0.000000      33.01071       16.80760  ?        ?        374.2709 109.0021 0.000000       109.0021 
1 1 1 17  2  6  o 373.2158 61.62402 29.14346       8.620027      29.14346       8.620027      0.000000       0.000000  373.2158 61.62402 ?        ?        0.000000       61.62402 
1 1 1 17  2  7  o 184.1593 65.68151 6.238697       5.928259      -5.379473      8.166035      19.18460       8.620024  140.0054 64.57191 297.0931 74.76916 -157.0877      98.79250 
1 1 1 17  2  8  o 556.4695 30.46864 61.11369       6.559482      52.72192       9.041910      70.43664       9.530369  511.3864 46.02142 593.5170 41.61056 -82.13052      62.04361 
1 1 1 17  2  9  o 119.2171 54.64185 -3.545784      5.723114      -9.791594      8.229012      2.305481       7.964861  126.3423 60.26937 172.3073 71.77969 -45.96504      93.72684 
1 1 1 17  2  10 f 523.9910 30.68622 54.28485       6.217225      53.83878       8.872292      54.71524       8.714792  516.7339 44.65073 521.4667 43.42794 -4.732788      62.28703 
1 1 1 17  2  11 o 135.1243 60.50586 -2.112523      6.540926      -10.79850      12.81967      0.9445480      7.605369  164.6993 77.57282 161.0993 68.77168 3.600021       103.6682 
1 1 1 17  2  12 f 148.5426 64.32233 0.2826081E-01  6.835601      0.000000       0.000000      0.2826081E-01  6.835601  ?        ?        148.5426 64.32233 0.000000       64.32233 
1 1 1 17  2  13 o 603.4251 28.46467 71.81193       6.670487      57.72251       13.25510      76.59015       7.719156  519.8257 67.23502 621.0965 32.11222 -101.2708      74.51002 
1 1 1 17  2  14 o 313.2606 45.81202 20.24039       5.408585      29.34211       9.082102      15.23867       6.732626  368.2859 65.92041 263.6394 65.92939 104.6465       93.23189 
1 1 1 17  2  15 o 184.7533 66.11163 6.625823       6.010881      -3.668617      8.401881      17.41908       8.603028  146.0502 66.66309 276.6994 77.15638 -130.6492      101.9660 
1 1 1 17  2  16 o 146.2581 61.29520 1.634462       5.858460      5.826397       8.210887      -2.712557      8.361390  189.9118 75.12144 148.6599 67.32397 41.25195       100.8749 
1 1 1 17  2  17 o 228.9919 62.29645 11.62341       5.687208      13.67701       8.011042      9.536788       8.075196  244.2488 76.18772 212.6222 76.56998 31.62662       108.0163 
1 1 1 17  2  18 o 248.2682 59.56070 13.66699       5.669001      17.48275       7.891254      9.597565       8.149329  274.3295 72.84645 211.6680 76.81693 62.66148       105.8652 
1 1 1 17  2  19 x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 17  2  20 f 466.7032 37.70164 44.52299       6.774934      47.31917       8.547836      39.79852       11.11092  474.8419 46.96901 415.9373 71.35411 58.90454       85.42538 
1 1 1 17  3  0  o 324.5015 44.74646 21.50634       5.489019      20.86593       7.457938      22.26327       8.108039  312.2400 63.66240 321.2670 67.14870 -9.027069      92.53026 
1 1 1 17  3  1  o 176.6165 62.42603 5.850185       5.343614      1.791325       7.416467      10.23198       7.705861  164.0238 68.86465 222.8566 75.13036 -58.83278      101.9162 
1 1 1 17  3  2  o 691.6811 22.95089 93.68768       6.165006      96.05122       8.604265      91.19416       8.837692  697.6702 31.75672 679.1870 33.50592 18.48322       46.16423 
1 1 1 17  3  3  o 343.6302 44.05360 23.96786       5.743598      26.77838       6.470063      13.51839       12.47563  362.4458 47.07780 259.3215 94.90177 103.1242       105.9371 
1 1 1 17  3  4  o 208.2305 67.82500 8.863917       6.293564      8.863917       6.293564      0.000000       0.000000  208.2305 67.82500 ?        ?        0.000000       67.82500 
1 1 1 17  3  5  o 253.1328 53.32224 13.40506       5.076345      14.51333       6.200904      11.15310       8.839212  261.1820 62.05233 234.2775 80.45139 26.90448       101.6018 
1 1 1 17  3  6  o 368.7042 43.99180 27.48903       6.174715      26.06618       8.560352      29.03228       8.915181  350.9617 65.20676 371.3074 64.14525 -20.34564      91.46876 
1 1 1 17  3  7  o 432.3626 37.44338 37.29940       6.225042      41.53918       8.832109      33.11405       8.775243  451.3806 51.29508 399.6494 58.25233 51.73117       77.61777 
1 1 1 17  3  8  o 153.4826 62.51140 2.308246       5.862698      8.804305       8.136427      -4.706394      8.454958  214.8461 76.91360 145.2896 66.52673 69.55655       101.6932 
1 1 1 17  3  9  o 470.5964 33.98948 43.97752       6.170064      57.56269       8.949323      31.66970       8.518209  535.1829 43.43328 390.3796 57.94524 144.8033       72.41617 
1 1 1 17  3  10 o 517.8987 31.98532 53.13617       6.401660      76.31532       9.458598      33.54385       8.696028  617.9269 39.62384 401.6785 57.37652 216.2484       69.72886 
1 1 1 17  3  11 o 605.8893 27.60538 72.21918       6.495537      77.79048       9.859310      67.94636       8.634256  622.7531 40.99564 583.0313 38.34733 39.72186       56.13520 
1 1 1 17  3  12 o 139.6133 60.20047 0.1255410      5.936841      5.949686       11.84739      -1.827358      6.860355  214.7863 88.32804 139.5209 62.25621 75.26541       108.0633 
1 1 1 17  3  13 o 164.8590 66.60902 3.287488       6.595895      0.000000       0.000000      3.287488       6.595895  ?        ?        164.8590 66.60902 0.000000       66.60902 
1 1 1 17  3  14 o 150.2656 61.92394 2.143918       5.838037      -10.29394      11.92818      6.061846       6.694678  156.8122 74.15288 184.3861 69.14064 -27.57384      101.3858 
1 1 1 17  3  15 o 699.3199 26.73186 96.50905       7.259940      97.92656       10.20046      95.05389       10.33507  697.9680 37.77248 686.9214 38.90144 11.04663       54.22253 
1 1 1 17  3  16 o 688.1708 26.75468 93.59389       7.150297      97.51907       10.15083      89.72813       10.07370  695.5677 37.71907 666.2144 39.10706 29.35333       54.33315 
1 1 1 17  3  17 o 387.1837 40.77975 30.71415       6.039621      32.21699       8.364283      29.07698       8.730085  387.2905 57.34461 363.3364 64.21912 23.95410       86.09588 
1 1 1 17  3  18 o 139.9759 61.30552 -0.4976394E-01 6.360415      -4.961679      8.010750      8.328574       10.46229  135.3256 62.94521 211.0647 84.37662 -75.73904      105.2688 
1 1 1 17  3  19 o 403.1719 44.57365 33.89227       6.862315      37.73296       8.686937      27.51745       11.19170  418.6854 54.73612 333.0472 85.95011 85.63821       101.8993 
1 1 1 17  3  20 o 363.6854 48.24984 28.02949       6.646518      32.29852       8.470419      21.18956       10.72177  383.5078 58.74378 288.9486 87.79325 94.55923       105.6337 
1 1 1 17  4  0  o 593.8618 26.68344 69.33697       6.153968      69.32423       8.381357      69.35186       9.064820  589.4756 36.79563 588.2116 39.91867 1.264038       54.29013 
1 1 1 17  4  1  o 362.1019 40.11409 26.44251       5.546218      25.48771       7.491938      27.60024       8.249789  348.9495 57.27206 361.8213 60.87238 -12.87186      83.57951 
1 1 1 17  4  2  f 135.2641 57.89783 0.2819058      5.416569      1.688304       6.742229      -2.278061      9.096334  157.4486 65.85349 160.2105 71.57327 -2.761902      97.25952 
1 1 1 17  4  3  o 274.0594 60.58914 15.95960       6.277239      15.95960       6.277239      0.000000       0.000000  274.0594 60.58914 ?        ?        0.000000       60.58914 
1 1 1 17  4  4  o 351.7022 42.87131 25.02389       5.734406      25.70225       6.448994      22.46171       12.53339  354.7377 48.04840 314.7621 94.76142 39.97559       106.2468 
1 1 1 17  4  5  o 523.5190 29.46830 54.07474       5.966857      55.38983       6.861355      49.99436       12.08601  528.6252 33.59655 488.5611 65.33597 40.06406       73.46780 
1 1 1 17  4  6  o 554.0970 45.24297 61.79636       9.650686      0.000000       0.000000      61.79636       9.650686  ?        ?        554.0970 45.24297 0.000000       45.24297 
1 1 1 17  4  7  o 337.7538 47.32308 23.28428       6.036873      16.97887       8.305346      30.34726       8.790119  279.2393 74.99746 380.7097 61.55342 -101.4704      97.02290 
1 1 1 17  4  8  f 170.7041 64.17307 4.761037       5.774387      4.307939       8.035935      5.244759       8.303048  184.2930 73.85102 191.8515 75.65182 -7.558517      105.7221 
1 1 1 17  4  9  o 138.3311 59.41361 0.1658480      5.739017      4.970878       8.045571      -4.811677      8.188712  188.0947 74.37446 141.8734 65.14927 46.22128       98.87360 
1 1 1 17  4  10 o 640.3709 26.60762 80.56791       6.617067      77.61805       9.585883      83.25298       9.145534  622.8751 39.83672 646.6486 36.56756 -23.77350      54.07541 
1 1 1 17  4  11 o 158.7981 60.40424 3.981541       5.152276      6.839632       7.876919      1.844333       6.811485  198.0950 74.84597 158.4895 66.23141 39.60548       99.94258 
1 1 1 17  4  12 o 221.1383 65.85149 10.50042       6.076994      -0.7633415     12.59124      13.92095       6.938628  191.6905 85.00763 252.2346 68.88908 -60.54411      109.4166 
1 1 1 17  4  13 o 225.5288 65.19386 11.02693       6.032548      -3.959453      12.60781      15.47664       6.870001  180.2796 82.04398 265.6612 66.68914 -85.38158      105.7292 
1 1 1 17  4  14 o 282.3665 57.12421 17.07014       6.049003      -0.5962347     12.20687      22.82034       6.964207  187.7295 83.45387 327.7507 56.77059 -140.0212      100.9329 
1 1 1 17  4  15 o 291.4238 62.16357 18.52850       6.820824      0.000000       0.000000      18.52850       6.820824  ?        ?        291.4238 62.16357 0.000000       62.16357 
1 1 1 17  4  16 o 401.7121 41.91296 33.04221       6.442409      36.84325       8.941586      28.93892       9.290301  415.8911 56.85015 360.6010 68.85119 55.29010       89.28844 
1 1 1 17  4  17 o 751.4994 28.09076 112.0899       8.198231      112.8627       10.25129      110.7186       13.65544  749.4557 35.22122 730.1721 48.43113 19.28369       59.88412 
1 1 1 17  4  18 o 258.9744 65.94444 15.26521       6.649993      16.62886       8.429770      13.01832       10.82074  264.6154 77.23213 237.8721 88.15553 26.74330       117.2015 
1 1 1 17  4  19 f 119.7213 55.06326 -3.101012      5.880936      1.049575       8.312666      -7.260064      8.321138  161.1660 70.34847 130.1253 61.65165 31.04071       93.54054 
1 1 1 17  5  0  o 412.6800 52.00907 35.11881       8.150164      35.11881       8.150164      0.000000       0.000000  412.6800 52.00907 ?        ?        0.000000       52.00907 
1 1 1 17  5  1  o 223.0105 64.03898 10.62008       5.838139      4.564546       7.264553      21.66328       9.810253  179.3897 70.75486 311.4333 80.51917 -132.0435      107.1895 
1 1 1 17  5  2  o 806.2402 25.87817 127.6141       8.102630      146.7264       9.534139      77.91453       15.37450  863.5330 28.42985 609.1191 66.05199 254.4139       71.91051 
1 1 1 17  5  3  o 186.4109 64.32752 6.732979       5.654541      7.579772       6.307769      3.268064       12.75949  196.7512 67.93903 210.4346 89.43578 -13.68340      112.3142 
1 1 1 17  5  4  o 389.2080 40.35585 30.45617       6.011156      32.72734       6.816607      22.51335       12.74768  402.2076 44.37955 314.5595 95.76337 87.64816       105.5470 
1 1 1 17  5  5  o 727.0703 26.06799 103.7167       7.360578      112.6939       8.641150      79.98125       14.05070  756.8238 29.40010 623.2084 58.74784 133.6154       65.69379 
1 1 1 17  5  6  o 263.2920 59.92293 14.70616       5.989442      11.98003       8.055696      18.07600       8.956424  238.3230 76.65832 286.9572 78.22387 -48.63422      109.5238 
1 1 1 17  5  7  o 159.8025 63.94871 3.045595       6.016315      -1.180774      8.308288      7.705067       8.723607  157.9548 69.59787 209.7704 78.87318 -51.81558      105.1896 
1 1 1 17  5  8  o 441.0948 37.46925 38.87309       6.357767      51.63817       9.184421      27.12821       8.809759  504.8450 47.40028 357.0987 65.95508 147.7463       81.22105 
1 1 1 17  5  9  o 226.9146 64.01846 10.99319       5.886678      16.20184       8.033049      4.951882       8.651333  272.0307 74.05157 191.6933 76.69378 80.33736       106.6094 
1 1 1 17  5  10 o 164.8965 63.84112 4.062058       5.824712      9.857182       8.170500      -1.926791      8.305943  220.9689 77.26433 153.8860 68.59608 67.08292       103.3209 
1 1 1 17  5  11 o 345.0701 52.90012 24.78312       6.863027      36.06267       12.66930      20.09852       8.164745  399.8876 84.24000 302.6615 70.73493 97.22617       109.9991 
1 1 1 17  5  12 f 732.7995 25.65679 105.6242       7.301558      77.36375       14.61610      115.0220       8.428618  605.4178 63.09222 763.5955 28.42268 -158.1777      69.19882 
1 1 1 17  5  13 o 190.5980 66.26352 7.254904       6.005397      -8.990527      12.76897      11.86886       6.804980  166.6815 78.16154 232.8090 69.76558 -66.12753      104.7686 
1 1 1 17  5  14 o 591.4656 29.02408 69.21866       6.666777      73.21126       13.31912      67.88393       7.700916  589.1058 59.01112 582.7245 34.17870 6.381287       68.19454 
1 1 1 17  5  15 o 145.2502 62.14853 0.8513566      6.236825      -6.693149      11.84630      3.744447       7.335816  164.2962 76.46205 171.6283 69.91628 -7.332123      103.6085 
1 1 1 17  5  16 o 359.2926 46.39617 26.84663       6.322549      5.111683       13.12166      33.41868       7.215389  210.7422 90.15740 400.9186 47.24949 -190.1763      101.7884 
1 1 1 17  5  17 o 554.3104 34.79533 61.97635       7.452356      60.48132       9.450071      64.43533       12.11957  540.5522 45.43777 547.8902 57.83338 -7.338013      73.54788 
1 1 1 17  5  18 o 239.2059 62.35939 12.90859       5.852347      1.924980       8.336682      23.58051       8.217543  165.9505 71.44786 321.5774 67.92943 -155.6269      98.58602 
1 1 1 17  5  19 o 450.5379 36.24029 41.36171       6.287263      37.13732       9.076215      45.25895       8.717684  411.9633 58.36318 462.4934 49.29612 -50.53006      76.39613 
1 1 1 17  6  0  o 494.1070 40.65533 49.12144       7.732071      49.12144       7.732071      0.000000       0.000000  494.1070 40.65533 ?        ?        0.000000       40.65533 
1 1 1 17  6  1  o 611.5223 25.90056 73.46191       6.151052      79.36651       8.282724      66.20103       9.184859  632.1965 33.85892 574.0030 41.48246 58.19348       53.54644 
1 1 1 17  6  2  o 662.5181 26.55165 86.23981       6.831517      83.83598       7.579885      96.64184       15.76773  652.1879 29.92691 682.9270 60.06285 -30.73914      67.10564 
1 1 1 17  6  3  o 405.7436 38.94912 33.03422       6.061879      35.12407       6.660361      22.94834       14.63179  417.5519 41.62819 315.3822 103.4502 102.1698       111.5117 
1 1 1 17  6  4  o 91.36423 44.79030 -10.24556      5.400282      -11.79512      5.995857      -3.587552      12.42856  95.03077 46.71006 182.9658 82.54066 -87.93502      94.84087 
1 1 1 17  6  5  o 256.2960 57.62736 13.90180       5.596572      11.68825       6.252464      22.82287       12.55208  233.8408 65.97919 316.4487 94.73367 -82.60789      115.4458 
1 1 1 17  6  6  o 171.6218 61.49189 5.355804       5.201766      7.610594       6.311266      0.5795131      9.185627  197.1070 67.96378 173.4928 74.84530 23.61429       101.0984 
1 1 1 17  6  7  o 513.6140 32.99618 52.31916       6.546725      57.58884       9.063365      46.56997       9.466739  534.7091 44.03756 477.0910 51.93300 57.61807       68.09070 
1 1 1 17  6  8  o 329.0128 52.51255 22.44043       6.484113      42.43165       9.266674      3.262859       9.076137  454.1300 53.57448 185.3687 76.87193 268.7612       93.69908 
1 1 1 17  6  9  o 361.9782 44.98171 26.69022       6.187002      23.11351       8.473943      30.77368       9.054351  326.6728 68.96026 380.9819 63.42625 -54.30914      93.69315 
1 1 1 17  6  10 o 688.6552 25.67753 93.20055       6.867254      84.46283       9.417109      103.1244       10.03593  650.2264 37.45119 720.3082 35.87659 -70.08185      51.86253 
1 1 1 17  6  11 o 402.7554 42.70535 32.93373       6.577714      49.96613       12.97156      27.03806       7.631693  480.1743 71.76238 358.5908 56.68589 121.5835       91.45014 
1 1 1 17  6  12 o 330.9696 94.75327 26.11107       12.79873      26.11107       12.79873      0.000000       0.000000  330.9696 94.75327 ?        ?        0.000000       94.75327 
1 1 1 17  6  13 o 439.9930 40.10088 39.19953       6.776915      49.06038       13.20543      35.67402       7.895981  470.9932 74.68773 414.9228 50.00940 56.07040       89.88435 
1 1 1 17  6  14 f 214.7598 67.40223 10.02239       6.259197      9.177092       12.00027      10.33830       7.336164  226.5278 90.43243 218.9182 73.30841 7.609619       116.4137 
1 1 1 17  6  15 o 365.2722 45.69764 27.62864       6.340580      32.72005       13.01361      26.04376       7.260688  366.9665 91.60168 349.6176 55.31647 17.34885       107.0083 
1 1 1 17  6  16 o 522.6296 30.34518 54.55711       6.132506      42.18844       12.51377      58.46642       7.035205  427.4993 78.25851 539.3278 33.75894 -111.8285      85.22945 
1 1 1 17  6  17 o 136.9225 59.57036 0.2184324      5.918220      4.997093       8.669227      -3.952349      8.099086  184.5692 75.68931 139.6179 64.36291 44.95128       99.35519 
1 1 1 17  6  18 o 226.0331 70.12773 11.78255       6.797621      8.279078       12.74060      13.17675       8.037152  216.8905 90.60423 236.4163 76.62510 -19.52579      118.6614 
1 1 1 17  6  19 o 455.8911 35.99294 42.35637       6.320619      40.50542       9.041592      44.12539       8.839252  432.6163 55.06441 455.0322 50.89175 -22.41586      74.98039 
1 1 1 17  7  0  o 611.8018 26.89845 73.65276       6.390958      80.73041       8.577556      64.82047       9.581989  636.8098 34.81562 566.2471 43.91697 70.56268       56.04309 
1 1 1 17  7  1  o 447.2582 37.00751 40.04043       6.370258      40.76358       7.004938      36.58349       15.31560  449.9877 40.51897 393.3468 100.0317 56.64084       107.9265 
1 1 1 17  7  2  o 505.1483 33.13881 50.69064       6.465018      51.04654       7.109996      48.99168       15.53448  505.7424 36.44453 466.2524 89.03948 39.48999       96.20932 
1 1 1 17  7  3  o 344.8368 46.99302 24.33211       6.129371      25.44036       6.721527      18.86070       14.93479  351.3033 50.73755 292.0346 104.2406 59.26871       115.9328 
1 1 1 17  7  4  f 540.9517 30.61423 57.87860       6.405081      54.34056       7.047596      74.67126       15.35394  522.6601 34.92213 595.0459 67.64394 -72.38580      76.12659 
1 1 1 17  7  5  o 305.1744 50.65594 19.27958       5.793011      20.62440       6.430469      13.48760       13.34515  314.3738 54.65467 260.6675 97.64287 53.70630       111.8985 
1 1 1 17  7  6  o 246.9458 59.93406 13.00644       5.689683      15.48778       6.330216      2.573178       12.98032  269.1715 61.85465 208.5564 89.45813 60.61513       108.7601 
1 1 1 17  7  7  o 402.2507 65.00353 34.31604       9.808257      0.000000       0.000000      34.31604       9.808257  ?        ?        402.2507 65.00353 0.000000       65.00353 
1 1 1 17  7  8  o 312.8987 54.37989 20.48236       6.368163      18.93044       8.739386      22.23920       9.298479  292.2707 76.20919 316.8458 76.44670 -24.57507      107.9442 
1 1 1 17  7  9  o 327.8903 70.26103 23.46876       8.677712      23.46876       8.677712      0.000000       0.000000  327.8903 70.26103 ?        ?        0.000000       70.26103 
1 1 1 17  7  10 o 253.3402 97.13187 12.73852       13.38851      12.73852       13.38851      0.000000       0.000000  253.3402 97.13187 ?        ?        0.000000       97.13187 
1 1 1 17  7  11 o 384.6466 48.38776 30.50131       7.068156      37.45886       12.61625      27.31855       8.533031  406.5074 82.72985 356.2368 64.03283 50.27060       104.6156 
1 1 1 17  7  12 o 316.0887 57.88219 21.32598       6.843448      16.95483       12.73979      23.09886       8.113416  272.2713 96.37288 324.9186 66.53741 -52.64734      117.1109 
1 1 1 17  7  13 o 458.7809 38.84636 42.56372       6.856232      45.61120       13.19487      41.43658       8.024603  449.7570 78.39378 448.6985 46.73713 1.058502       91.26852 
1 1 1 17  7  14 o 517.3557 34.48364 53.71453       6.888665      55.57875       12.72343      52.94146       8.193427  505.2472 66.45678 509.8023 41.75045 -4.555084      78.48314 
1 1 1 17  7  15 o 228.3750 61.97259 11.55235       5.636565      16.83400       12.04322      10.07089       6.378271  265.3569 93.72523 213.7838 68.15372 51.57310       115.8851 
1 1 1 17  7  16 o 419.3164 36.07904 35.66531       5.818017      37.34353       12.16140      35.16723       6.625373  397.3568 81.54222 413.3607 41.84843 -16.00391      91.65384 
1 1 1 17  7  17 o 148.3842 59.71851 2.999418       5.279402      5.858189       10.93531      2.130582       6.028512  199.6198 83.70525 148.8583 62.26635 50.76157       104.3248 
1 1 1 17  7  18 o 331.9035 47.27362 23.33859       5.921187      21.79398       8.459607      24.82210       8.290598  304.2321 72.60957 329.4696 67.07520 -25.23758      98.84953 
1 1 1 17  8  0  o 180.4316 63.09235 6.301024       5.448112      5.923124       7.490909      6.725392       7.938114  189.0146 72.61061 196.9877 74.96580 -7.973114      104.3656 
1 1 1 17  8  1  o 332.4187 49.32378 22.83001       6.174381      23.97323       6.792588      17.39320       14.81298  339.1528 53.33234 281.7767 103.3663 57.37607       116.3139 
1 1 1 17  8  2  o 319.5393 52.14519 21.24380       6.247710      24.30347       6.821610      5.320682       15.56192  341.8382 53.10891 231.7865 98.64634 110.0517       112.0342 
1 1 1 17  8  3  o 179.8213 65.44711 5.868161       5.921593      5.779552       6.467357      6.327693       14.72807  182.4190 68.04416 231.9747 97.20090 -49.55569      118.6508 
1 1 1 17  8  4  o 432.4297 37.25172 37.43730       6.194850      33.31455       6.753810      59.29692       15.55166  405.4851 43.57252 520.8761 79.39059 -115.3910      90.56175 
1 1 1 17  8  5  o 350.0052 57.63811 25.69284       7.561741      27.12949       8.787836      21.59491       14.84187  356.0367 65.98630 306.0882 104.2622 49.94849       123.3888 
1 1 1 17  8  6  o 324.3248 63.02237 22.45616       7.651851      26.08277       9.413039      15.39097       13.13838  345.6443 72.44205 269.0655 97.55338 76.57889       121.5093 
1 1 1 17  8  7  o 489.9030 52.59173 49.40959       9.849316      45.17384       14.19663      53.34037       13.67603  449.1353 84.49276 496.8671 73.05592 -47.73187      111.6969 
1 1 1 17  8  8  o 478.8221 54.21436 47.47120       9.903656      42.68499       14.04910      52.19897       13.96307  434.1205 86.37045 488.6325 76.05579 -54.51202      115.0841 
1 1 1 17  8  9  o 311.6737 75.28675 21.68410       9.010395      32.73291       13.79858      13.47063       11.89707  371.9919 95.13746 253.0296 92.66357 118.9623       132.8069 
1 1 1 17  8  10 o 181.8556 76.04626 3.141842       8.988273      6.660215       13.43155      0.2884701      12.09580  223.9087 93.23898 190.9488 84.06313 32.95992       125.5393 
1 1 1 17  8  11 o 378.1607 58.96461 30.40589       8.377126      25.41907       13.01944      33.92907       10.94330  324.2540 96.34784 390.1706 74.94524 -65.91663      122.0643 
1 1 1 17  8  12 o 152.8901 65.96400 0.6202192      7.136470      -1.718065      12.66731      1.707459       8.637704  186.0894 83.69704 170.9549 73.14265 15.13451       111.1532 
1 1 1 17  8  13 o 143.6849 62.97848 -0.3194019     6.723737      -6.590180      11.89047      2.628290       8.152286  164.8254 76.67371 171.2587 72.06653 -6.433334      105.2257 
1 1 1 17  8  14 o 132.5761 57.61286 0.1431188E-01  5.522981      -6.316997      11.35495      1.976346       6.321084  160.7075 74.81448 152.0632 63.69572 8.644302       98.25656 
1 1 1 17  8  15 o 456.3890 36.47478 42.20724       6.410798      46.57853       12.73364      40.72309       7.419715  451.4778 75.27588 444.3584 43.55574 7.119446       86.96873 
1 1 1 17  8  16 o 120.9298 54.29252 -1.490144      5.303414      -3.028817      11.27935      -1.053433      6.009083  167.8420 76.84809 131.0214 58.37912 36.82066       96.50777 
1 1 1 17  8  17 o 223.5326 64.18899 11.38167       5.865520      0.000000       0.000000      11.38167       5.865520  ?        ?        223.5326 64.18899 0.000000       64.18899 
1 1 1 17  8  18 o 405.0735 34.59853 33.39408       5.390559      30.72464       12.30390      34.02819       5.996722  345.0280 90.64771 406.7973 38.41309 -61.76929      98.45087 
1 1 1 17  9  0  o 364.7599 56.39915 27.97823       7.731519      36.69279       8.926130      1.800339       15.47063  418.6541 56.33059 216.8600 95.27907 201.7941       110.6853 
1 1 1 17  9  1  o 205.8296 74.38055 8.224173       7.628808      11.57802       8.637131      -3.676652      16.26997  233.6113 79.53688 205.3776 93.36349 28.23375       122.6493 
1 1 1 17  9  2  o 354.2867 56.06007 26.32389       7.456532      29.33086       8.524345      16.52659       15.38685  371.9026 61.14629 277.7894 104.6914 94.11316       121.2401 
1 1 1 17  9  3  f 186.7192 80.37135 1.548737       10.54429      -1.696805      15.02655      4.697067       14.79980  204.4917 91.62761 225.0013 95.99004 -20.50963      132.7016 
1 1 1 17  9  4  o 357.5787 79.73585 28.58669       10.79058      19.79501       14.94014      38.17421       15.60170  294.4697 104.3497 400.5562 100.4702 -106.0865      144.8555 
1 1 1 17  9  5  o 189.4929 81.13325 2.037151       10.64204      2.195912       15.20633      1.884750       14.89861  218.0886 95.17247 215.3361 94.08158 2.752518       133.8250 
1 1 1 17  9  6  o 497.7111 55.34580 51.41277       10.51652      38.21582       14.39280      66.52890       15.40384  404.9676 93.41959 554.2833 73.36257 -149.3156      118.7825 
1 1 1 17  9  7  o 219.2677 84.00745 8.736259       10.01034      12.60464       14.90507      5.557691       13.51092  257.0205 101.3568 220.7227 92.82314 36.29784       137.4385 
1 1 1 17  9  8  o 229.0619 82.94484 10.71157       9.493744      18.67387       13.87611      3.704283       13.01736  284.7590 100.6020 209.9396 89.80580 74.81937       134.8549 
1 1 1 17  9  9  o 445.8345 41.06664 40.27469       7.030418      46.82032       9.487172      32.30199       10.47041  475.1000 52.28429 382.0945 73.22646 93.00552       89.97646 
1 1 1 17  9  10 o 260.9776 72.97723 15.28298       7.685003      30.06831       13.84324      8.696485       9.239517  350.8867 97.88426 213.9049 81.00333 136.9818       127.0546 
1 1 1 17  9  11 o 523.8961 40.38762 55.60840       8.153760      43.56702       13.47419      62.56554       10.24188  435.8562 82.62729 551.0493 48.34734 -115.1931      95.73262 
1 1 1 17  9  12 o 289.1570 64.49957 18.46065       7.058794      17.72845       13.18597      18.75476       8.357108  273.4358 97.91080 286.5695 74.42738 -13.13370      122.9876 
1 1 1 17  9  13 o 242.8687 69.21459 13.30430       6.845241      24.60668       12.42110      8.374418       8.203389  314.7602 94.24036 205.2831 76.62228 109.4771       121.4587 
1 1 1 17  9  14 o 596.8427 32.63268 71.43201       7.535155      45.46751       13.16638      84.07818       9.188738  442.5264 79.53624 644.9027 36.84166 -202.3763      87.65456 
1 1 1 17  9  15 o 374.1893 47.03886 29.36769       6.684525      40.86587       13.22592      25.42294       7.746771  410.8990 85.65851 339.5434 60.99029 71.35553       105.1532 
1 1 1 17  9  16 o 257.1043 71.63380 15.51970       7.418727      0.000000       0.000000      15.51970       7.418727  ?        ?        257.1043 71.63380 0.000000       71.63380 
1 1 1 17  9  17 o 234.0269 66.94748 12.70291       6.391709      0.000000       0.000000      12.70291       6.391709  ?        ?        234.0269 66.94748 0.000000       66.94748 
1 1 1 17  9  18 o 277.7650 50.44204 16.71682       5.240830      8.349140       12.34980      18.55470       5.787833  212.9354 89.09940 291.4243 53.09645 -78.48897      103.7205 
1 1 1 17  10 0  o 165.8847 70.28396 1.800577       7.839689      -0.7773384     9.101446      9.212791       15.43299  164.2995 72.59546 242.3680 100.3527 -78.06856      123.8578 
1 1 1 17  10 1  o 520.0666 83.37495 60.84739       16.27034      0.000000       0.000000      60.84739       16.27034  ?        ?        520.0666 83.37495 0.000000       83.37495 
1 1 1 17  10 2  f 160.1389 73.84717 -5.660994      10.67485      2.024108       14.92403      -13.71196      15.27514  214.4227 93.90937 173.8620 82.70833 40.56068       125.1385 
1 1 1 17  10 3  o 414.4527 70.83043 37.41000       10.99096      43.29530       15.57849      31.57718       15.50887  428.2879 96.03233 358.4839 104.7927 69.80402       142.1398 
1 1 1 17  10 4  o 302.7148 87.82238 21.21767       10.92939      -4.296162      15.69939      45.21139       15.22452  199.6317 91.12193 441.2654 91.82973 -241.6336      129.3673 
1 1 1 17  10 5  o 257.3200 89.46948 14.58696       10.94833      22.41647       14.86684      5.309384       16.18337  305.8122 104.3490 231.7738 99.66520 74.03842       144.2979 
1 1 1 17  10 6  o 208.8474 65.37051 9.299894       5.891981      10.52979       6.389066      2.305887       15.23581  220.7432 67.90553 216.4195 94.83200 4.323776       116.6373 
1 1 1 17  10 7  o 204.2482 64.27362 8.872338       5.687394      12.05977       6.188593      -8.449227      14.42663  234.7557 65.43248 179.5583 83.83669 55.19733       106.3485 
1 1 1 17  10 8  o 199.5320 78.12321 6.678111       8.798193      6.678111       8.798193      0.000000       0.000000  199.5320 78.12321 ?        ?        0.000000       78.12321 
1 1 1 17  10 9  f 301.8650 60.61295 19.72327       6.858854      28.66389       13.40086      16.54985       7.983845  342.3561 96.59213 270.5461 73.89809 71.81006       121.6181 
1 1 1 17  10 10 o 136.4392 60.60244 -1.186491      6.424130      -21.09610      12.21637      6.423565       7.552741  135.3576 66.56015 190.3260 72.95808 -54.96848      98.75796 
1 1 1 17  10 11 o 164.9939 65.39454 4.009033       6.233674      6.348302       12.85356      3.289626       7.128050  215.6843 90.61179 167.0002 68.57564 48.68416       113.6359 
1 1 1 17  10 12 o 132.0532 58.76152 -1.173463      6.066510      -9.564541      12.42716      1.451787       6.951019  159.8752 75.62791 154.4931 65.84396 5.382126       100.2747 
1 1 1 17  10 13 o 134.9146 57.99704 0.5737162      5.477186      -8.478624      12.78050      2.610336       6.062091  164.2021 77.37381 153.1906 63.11183 11.01147       99.84893 
1 1 1 17  10 14 o 533.3267 33.67900 57.33053       6.939753      0.000000       0.000000      57.33053       6.939753  ?        ?        533.3267 33.67900 0.000000       33.67900 
1 1 1 17  10 15 o 204.9519 65.09515 9.413629       5.822793      0.000000       0.000000      9.413629       5.822793  ?        ?        204.9519 65.09515 0.000000       65.09515 
1 1 1 17  10 16 o 330.8912 59.28219 24.31840       7.338143      0.000000       0.000000      24.31840       7.338143  ?        ?        330.8912 59.28219 0.000000       59.28219 
1 1 1 17  10 17 o 185.9857 66.22017 7.412427       6.023451      6.081016       11.91607      7.869393       6.981019  201.4271 86.03738 192.3140 70.89812 9.113037       111.4853 
1 1 1 17  11 0  o 201.9823 68.85204 8.493616       6.472486      4.612649       7.283381      23.06931       14.11490  177.2630 70.55064 306.1620 101.6637 -128.8990      123.7453 
1 1 1 17  11 1  o 542.9984 33.06944 58.85450       6.940312      64.38401       7.868616      39.48000       14.72891  566.6420 35.94313 405.5128 95.16309 161.1291       101.7247 
1 1 1 17  11 2  o 138.5947 63.60406 -4.086063      7.788288      1.718829       9.027841      -20.97830      15.40034  174.4180 74.70426 159.6067 77.67666 14.81131       107.7701 
1 1 1 17  11 3  o 223.2257 75.16251 10.68766       7.712367      17.57121       8.834767      -11.35772      15.81057  277.6690 78.45882 181.2496 85.60532 96.41936       116.1209 
1 1 1 17  11 4  o 457.0685 47.20578 42.94288       8.258553      46.61044       9.763339      33.71909       15.48334  472.3508 54.20543 367.4641 103.8791 104.8867       117.1712 
1 1 1 17  11 5  o 368.3159 43.06652 27.75689       6.043797      26.51923       6.565763      34.62568       15.46765  357.4992 48.54708 372.4019 103.3198 -14.90271      114.1569 
1 1 1 17  11 6  o 612.7006 35.94673 75.28266       8.515887      90.69501       10.11013      37.64227       15.79972  670.8502 38.97437 388.1546 103.0788 282.6956       110.2009 
1 1 1 17  11 7  o 511.7704 30.81138 52.16214       6.095160      48.76072       6.635397      70.53592       15.42183  493.0066 34.88181 566.7226 71.67316 -73.71603      79.71061 
1 1 1 17  11 8  o 130.4140 58.79187 -2.144198      6.292621      2.725643       8.518961      -7.991896      9.335159  174.6050 73.58232 139.8377 65.96442 34.76726       98.82137 
1 1 1 17  11 9  o 257.9763 67.14651 14.88863       6.792377      16.56758       13.87327      14.35927       7.789906  267.1606 99.65798 251.1979 74.50085 15.96268       124.4270 
1 1 1 17  11 10 o 396.3121 45.09986 32.45289       6.817668      25.51856       13.89414      34.65197       7.824384  316.4881 100.5574 406.5860 50.65125 -90.09787      112.5937 
1 1 1 17  11 11 o 429.5550 47.03977 38.34856       7.718861      0.000000       0.000000      38.34856       7.718861  ?        ?        429.5550 47.03977 0.000000       47.03977 
1 1 1 17  11 12 o 443.6236 40.85382 40.33629       6.959334      0.000000       0.000000      40.33629       6.959334  ?        ?        443.6236 40.85382 0.000000       40.85382 
1 1 1 17  11 13 o 100.9460 49.12650 -9.583057      6.158783      0.000000       0.000000      -9.583057      6.158783  ?        ?        100.9460 49.12650 0.000000       49.12650 
1 1 1 17  11 14 f 620.6964 28.82939 76.85847       6.949326      0.000000       0.000000      76.85847       6.949326  ?        ?        620.6964 28.82939 0.000000       28.82939 
1 1 1 17  11 15 o 300.5710 48.38900 19.33129       5.456638      5.393322       12.65780      22.51272       6.047414  202.6125 87.63257 324.0433 49.63617 -121.4308      100.7135 
1 1 1 17  11 16 o 194.4091 60.06935 8.480747       4.993299      16.08352       12.12844      6.929084       5.479203  250.1874 93.20930 180.0943 63.25537 70.09317       112.6464 
1 1 1 17  11 17 o 283.9852 46.81997 17.27773       4.983648      15.16698       12.52914      17.67445       5.431843  244.2524 93.88814 284.9488 50.95586 -40.69640      106.8245 
1 1 1 17  12 0  o 299.2811 59.66636 19.48130       6.691524      16.51231       7.521642      30.74881       14.65286  269.8741 70.86127 346.7932 101.9982 -76.91904      124.1973 
1 1 1 17  12 1  o 344.4145 63.19445 25.89196       8.141068      39.01390       9.709950      -5.161331      14.93729  426.2710 60.34032 188.7559 87.15275 237.5151       106.0026 
1 1 1 17  12 2  o 370.8689 56.33155 29.27537       7.858174      32.57616       9.234071      20.60822       14.96313  387.1530 63.62715 289.4019 104.2291 97.75110       122.1152 
1 1 1 17  12 3  o 212.8964 76.23286 9.423898       7.993466      10.81554       9.362712      5.682259       15.35215  226.2539 82.30263 224.7628 96.86201 1.491180       127.1061 
1 1 1 17  12 4  o 312.6405 52.35003 20.68790       6.131373      22.76861       6.652676      8.950601       15.80064  327.3713 54.22523 238.4501 100.3350 88.92113       114.0504 
1 1 1 17  12 5  o 258.8029 60.42412 14.66953       5.962760      22.16025       6.415496      -32.85450      16.15940  323.4252 52.90715 145.7255 72.51760 177.6998       89.76619 
1 1 1 17  12 6  o 434.9805 35.64658 38.14349       5.968759      33.97491       6.505392      60.32896       15.00768  407.6178 41.68168 516.8421 77.13103 -109.2243      87.67303 
1 1 1 17  12 7  o 304.9508 49.42817 19.58543       5.653355      24.76015       6.187130      -6.582653      13.91335  344.5385 47.50389 178.0411 82.86086 166.4974       95.51199 
1 1 1 17  12 8  o 149.8654 60.01392 2.990833       5.302765      -0.6900235     7.100256      7.633414       7.974057  144.9114 64.06971 199.1821 75.29419 -54.27066      98.86427 
1 1 1 17  12 9  o 216.2092 75.44061 10.16945       7.787385      0.000000       0.000000      10.16945       7.787385  ?        ?        216.2092 75.44061 0.000000       75.44061 
1 1 1 17  12 10 o 126.0923 59.24797 -6.000510      7.400346      0.000000       0.000000      -6.000510      7.400346  ?        ?        126.0923 59.24797 0.000000       59.24797 
1 1 1 17  12 11 o 301.1256 78.00362 21.51641       9.195271      0.000000       0.000000      21.51641       9.195271  ?        ?        301.1256 78.00362 0.000000       78.00362 
1 1 1 17  12 12 o 196.7513 75.75723 7.575592       8.167025      0.000000       0.000000      7.575592       8.167025  ?        ?        196.7513 75.75723 0.000000       75.75723 
1 1 1 17  12 13 o 215.6092 70.18659 10.65128       6.739837      5.686361       13.37493      12.34113       7.802969  207.7795 89.97385 229.2187 75.56361 -21.43922      117.4953 
1 1 1 17  12 14 o 352.2345 41.58746 25.85763       5.579091      11.49608       13.70219      28.71174       6.108359  230.2735 94.87835 370.3507 43.28678 -140.0772      104.2864 
1 1 1 17  12 15 o 293.5532 48.49296 18.55034       5.335283      41.14876       13.94398      14.67451       5.774711  396.5948 92.27060 254.3165 59.52268 142.2782       109.8035 
1 1 1 17  12 16 o 303.9626 45.80696 19.70412       5.239411      21.27900       12.71148      19.38181       5.750626  277.1953 96.40347 298.0186 51.55296 -20.82333      109.3222 
1 1 1 17  13 0  o 220.9327 77.93674 10.77722       8.324977      14.66888       10.03121      2.165707       14.92195  249.5317 85.70363 206.9234 92.11207 42.60832       125.8163 
1 1 1 17  13 1  o 357.8825 60.33257 27.91282       8.087111      31.14850       9.684621      20.45901       14.69905  372.1415 69.56888 283.7137 103.1358 88.42786       124.4059 
1 1 1 17  13 2  o 347.0292 62.19012 26.41602       8.073520      20.58550       9.171308      46.49102       17.01788  295.8451 78.51992 423.3713 104.2066 -127.5262      130.4776 
1 1 1 17  13 3  o 196.7304 66.48040 8.243165       6.033756      6.679106       6.642550      15.62161       14.42749  186.0637 69.04713 260.0149 100.5288 -73.95114      121.9572 
1 1 1 17  13 4  o 142.5459 60.16190 1.400447       5.708607      1.883539       6.294951      -0.8363562     13.54539  150.9335 63.41053 191.2234 86.22658 -40.28989      107.0323 
1 1 1 17  13 5  o 359.1822 44.26274 26.72967       6.043574      33.52503       6.653947      -5.295063      14.44495  403.3423 43.14865 183.5069 85.07117 219.8354       95.38821 
1 1 1 17  13 6  o 159.5273 63.67400 3.669158       5.948366      7.709658       6.510834      -16.73141      14.62986  193.3613 68.84704 159.0356 77.00084 34.32571       103.2911 
1 1 1 17  13 7  o 200.8992 64.84830 8.802362       5.760926      9.864776       6.378414      4.098505       13.42125  211.1673 68.24284 206.5859 89.79295 4.581360       112.7823 
1 1 1 17  13 8  o 374.9843 43.53728 29.12833       6.222197      25.81101       8.046478      34.06234       9.813226  341.5600 62.98162 390.4203 67.14270 -48.86035      92.05882 
1 1 1 17  13 9  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 17  13 10 o 210.9597 76.26922 9.713532       8.022476      5.168836       14.60403      11.67769       9.600817  212.8936 93.07710 227.1602 83.23418 -14.26665      124.8650 
1 1 1 17  13 11 o 539.0659 39.45804 59.58777       8.203085      58.46583       14.96637      60.06956       9.807469  495.7267 80.50197 534.8196 47.72083 -39.09286      93.58336 
1 1 1 17  13 12 o 530.7020 37.53099 57.61994       7.685267      69.72971       14.52258      52.90949       9.057467  552.6783 69.17718 501.2518 47.08060 51.42648       83.67834 
1 1 1 17  13 13 o 346.7094 51.39525 25.98729       6.710606      25.30745       13.56656      26.20751       7.721362  300.4967 99.66405 341.9276 60.35410 -41.43088      116.5141 
1 1 1 17  13 14 o 268.6910 62.50338 16.61512       6.399122      27.11183       13.48847      13.56648       7.269238  309.4133 99.16019 237.2566 72.33401 72.15675       122.7394 
1 1 1 17  13 15 o 113.2796 53.39837 -5.021611      6.097478      -3.810961      12.97963      -5.364443      6.907075  171.2769 79.81933 120.6966 56.87581 50.58030       98.01012 
1 1 1 17  14 0  o 199.9634 79.40331 7.479103       9.206433      19.26302       12.02603      -9.204298      14.30935  273.9836 93.84955 170.1642 80.68675 103.8195       123.7663 
1 1 1 17  14 1  o 626.8298 43.91676 81.23520       10.62322      98.30708       14.24590      59.85050       15.94413  678.9860 54.48468 498.2144 85.48360 180.7716       101.3707 
1 1 1 17  14 2  o 644.3752 31.14451 83.04523       7.793783      76.75298       8.960335      102.6011       15.79646  614.3125 37.74110 688.2144 59.69407 -73.90192      70.62415 
1 1 1 17  14 3  o 328.6736 53.23755 23.22001       6.562920      22.50603       7.402255      25.84365       14.18961  318.1481 62.13994 310.4786 101.8767 7.669556       119.3325 
1 1 1 17  14 4  o 174.2234 65.98699 5.627836       6.132028      7.880569       6.877038      -3.112116      13.54569  194.7092 70.58092 182.0823 83.67934 12.62697       109.4710 
1 1 1 17  14 5  o 546.9272 31.90479 60.08334       6.747208      61.86574       7.767120      54.60190       13.62086  552.2535 36.41987 487.7946 74.24439 64.45898       82.69605 
1 1 1 17  14 6  o 269.5655 64.28516 16.44409       6.635248      16.44409       6.635248      0.000000       0.000000  269.5655 64.28516 ?        ?        0.000000       64.28516 
1 1 1 17  14 7  o 207.8911 67.26733 9.673684       6.195913      9.673684       6.195913      0.000000       0.000000  207.8911 67.26733 ?        ?        0.000000       67.26733 
1 1 1 17  14 8  o 171.3619 65.53165 5.371372       6.084344      5.684837       6.621406      3.670813       15.42239  176.5360 68.14566 210.2882 93.62439 -33.75218      115.7988 
1 1 1 17  14 9  o 167.9206 70.81419 3.091793       7.898842      6.582362       13.09234      1.094110       9.904494  210.2036 89.99518 172.0029 75.87835 38.20073       117.7143 
1 1 1 17  14 10 o 112.0035 54.49644 -10.99860      7.568366      -5.747533      13.32680      -13.49837      9.195023  170.9041 80.04868 121.6711 59.39046 49.23298       99.67456 
1 1 1 17  14 11 o 172.3998 62.84632 6.057856       5.463450      -3.448327      13.15170      8.040506       6.006229  174.9205 81.12003 191.0783 66.27730 -16.15779      104.7527 
1 1 1 17  14 12 o 195.9718 60.67761 8.697748       5.091950      1.307294       13.27885      9.971815       5.513417  188.4711 85.14376 208.2273 62.88682 -19.75616      105.8500 
1 1 1 17  14 13 o 337.3316 50.26226 24.68250       6.383506      46.75340       13.63489      18.48683       7.224133  430.0559 84.65308 279.6429 67.32764 150.4130       108.1626 
1 1 1 17  14 14 o 162.2498 59.94311 5.274277       4.995356      5.699800       12.69297      5.196291       5.433857  199.1828 86.93637 163.7085 62.09000 35.47437       106.8321 
1 1 1 17  15 0  o 487.1862 50.27422 50.69587       9.375201      71.15863       12.69048      26.10990       13.91041  569.4131 58.20651 304.5958 100.9141 264.8173       116.4975 
1 1 1 17  15 1  o 351.9293 66.63919 28.36403       8.774311      32.81129       11.44533      22.02432       13.66521  364.4847 82.74842 283.0479 99.85208 81.43689       129.6832 
1 1 1 17  15 2  o 234.9699 70.31593 12.96202       6.916291      14.26288       7.998238      9.105826       13.77082  243.5997 76.14999 221.3856 93.43882 22.21402       120.5389 
1 1 1 17  15 3  o 370.1083 48.03429 29.05639       6.741315      31.58226       7.801797      21.61352       13.39242  381.9261 54.11410 282.7787 98.91758 99.14740       112.7520 
1 1 1 17  15 4  o 130.8865 58.29482 -0.8680557     5.985053      -1.647841      6.830281      1.710682       12.42094  135.6684 61.19782 188.4773 83.95965 -52.80899      103.8961 
1 1 1 17  15 5  o 404.2287 44.66040 34.22128       6.893869      34.22128       6.893869      0.000000       0.000000  404.2287 44.66040 ?        ?        0.000000       44.66040 
1 1 1 17  15 6  o 253.6662 61.83659 14.62752       6.036411      14.62752       6.036411      0.000000       0.000000  253.6662 61.83659 ?        ?        0.000000       61.83659 
1 1 1 17  15 7  o 128.9133 56.56040 -0.1093852     5.435114      -0.1093852     5.435114      0.000000       0.000000  128.9133 56.56040 ?        ?        0.000000       56.56040 
1 1 1 17  15 8  o 135.7135 58.59734 0.7547822      5.640083      1.989985       6.131110      -6.043247      14.38340  147.4624 62.29873 175.3260 82.45168 -27.86362      103.3412 
1 1 1 17  15 9  o 129.0482 57.44038 -0.7069675     5.801166      21.92244       12.64527      -6.739154      6.528733  282.2595 96.23762 112.5315 53.68170 169.7280       110.1971 
1 1 1 17  15 10 o 554.7758 37.74362 63.34323       8.083497      45.17019       14.09960      72.24117       9.865915  417.2994 89.67333 587.1944 43.57486 -169.8950      99.69992 
1 1 1 17  15 11 o 222.7646 56.86025 11.28325       4.935711      9.397011       13.31421      11.58376       5.314367  215.7177 91.50654 224.2517 59.89124 -8.534012      109.3636 
1 1 1 17  15 12 o 114.9798 51.20026 -0.7286063     4.614495      2.745816       12.17775      -1.311129      4.986346  185.6907 82.89527 116.1872 52.36069 69.50342       98.04727 
1 1 1 17  15 13 o 329.1519 39.55191 22.69622       4.954595      10.73855       13.20504      24.65542       5.345098  218.9834 91.91196 342.2969 41.02660 -123.3135      100.6528 
1 1 1 17  16 0  o 500.5848 74.46357 60.14152       14.03517      0.000000       0.000000      60.14152       14.03517  ?        ?        500.5848 74.46357 0.000000       74.46357 
1 1 1 17  16 1  o 166.7246 69.54593 3.843731       7.490911      4.375330       9.281672      2.850578       12.68651  179.4428 76.27215 189.7127 84.65590 -10.26991      113.9476 
1 1 1 17  16 2  o 374.0005 43.48419 29.46930       6.197952      26.77317       7.009424      39.13306       13.27045  349.6955 53.29895 386.8669 90.01948 -37.17139      104.6149 
1 1 1 17  16 3  o 511.9316 31.65202 53.04321       6.261893      57.23596       7.174658      39.63831       12.82872  529.4153 35.09508 394.5586 86.13885 134.8568       93.01379 
1 1 1 17  16 4  o 151.2326 60.91680 3.422054       5.498487      3.243969       6.183478      4.094898       12.01920  154.9803 63.78210 192.1734 84.21765 -37.19301      105.6445 
1 1 1 17  16 5  o 183.9846 65.64464 7.329291       5.922151      7.329291       5.922151      0.000000       0.000000  183.9846 65.64464 ?        ?        0.000000       65.64464 
1 1 1 17  16 6  o 410.9297 40.44174 35.16414       6.370333      35.16414       6.370333      0.000000       0.000000  410.9297 40.44174 ?        ?        0.000000       40.44174 
1 1 1 17  16 7  o 387.0009 36.47329 30.85715       5.417037      34.82935       6.909628      24.52185       8.726159  405.7977 44.57933 319.2765 72.08354 86.52124       84.75467 
1 1 1 17  16 8  o 138.4564 56.01915 2.665861       4.672309      1.144403       5.826668      5.406394       7.820019  138.5268 59.68586 176.9776 72.15148 -38.45082      93.63887 
1 1 1 17  16 9  o 107.2317 50.33766 -4.128028      5.320222      9.880882       12.30822      -7.346853      5.899859  213.8613 89.17178 102.8162 49.56307 111.0451       102.0201 
1 1 1 17  16 10 o 217.5063 62.33957 11.11541       5.537153      29.14621       12.97363      7.099391       6.122828  317.9118 96.56927 180.7823 66.43501 137.1295       117.2145 
1 1 1 17  16 11 o 643.0455 24.18085 82.38809       6.038670      85.91515       14.66017      81.66737       6.626984  612.3491 62.52406 638.4293 26.72853 -26.08014      67.99760 
1 1 1 17  16 12 o 172.1953 57.11650 6.596248       4.455660      21.89123       13.24561      4.644687       4.731388  270.8235 97.98746 154.3070 58.07335 116.5166       113.9037 
1 1 1 17  17 0  o 263.1540 73.47285 17.47323       7.796000      26.17769       9.700020      1.592358       13.10205  318.8512 78.79057 182.9206 83.39686 135.9306       114.7301 
1 1 1 17  17 1  o 356.3742 47.38694 27.49373       6.395732      28.79262       7.286115      23.13227       13.35136  359.7069 53.81100 276.9375 98.59094 82.76944       112.3201 
1 1 1 17  17 2  o 200.2550 64.38286 9.420742       5.682824      4.998466       6.423593      25.34561       12.18970  166.0308 66.20042 296.9810 94.16962 -130.9502      115.1104 
1 1 1 17  17 3  o 139.2588 59.12172 1.777537       5.565137      2.701557       6.360327      -1.240236      11.49429  151.1373 63.63020 167.7493 77.08889 -16.61195      99.95749 
1 1 1 17  17 4  o 325.9675 52.38309 23.48771       6.406636      23.48771       6.406636      0.000000       0.000000  325.9675 52.38309 ?        ?        0.000000       52.38309 
1 1 1 17  17 5  o 144.9243 60.96791 2.336478       5.832028      2.336478       5.832028      0.000000       0.000000  144.9243 60.96791 ?        ?        0.000000       60.96791 
1 1 1 17  17 6  o 392.6007 40.84228 32.43216       6.135994      32.43216       6.135994      0.000000       0.000000  392.6007 40.84228 ?        ?        0.000000       40.84228 
1 1 1 17  17 7  o 280.0810 48.81956 17.21614       5.117090      21.49838       6.377202      9.474624       8.574476  309.0479 55.15783 201.8993 77.65545 107.1486       95.25101 
1 1 1 17  17 8  o 150.4907 57.41601 4.285522       4.663857      5.871134       5.682061      1.011488       8.164867  168.5076 63.59232 154.5016 68.48780 14.00600       93.45888 
1 1 1 17  17 9  o 174.0307 54.15704 6.827777       4.050580      9.159739       5.385741      3.790956       6.146025  197.1830 62.60206 155.5740 63.75621 41.60896       89.35252 
1 1 1 17  17 10 o 198.0112 62.28015 9.255357       5.340808      15.40274       13.95677      8.200733       5.780808  234.6340 96.10714 187.9264 65.03088 46.70760       116.0414 
1 1 1 17  17 11 o 172.1509 59.75426 6.602132       4.882553      -20.88854      12.77708      11.30293       5.283535  131.9834 65.47739 218.8544 60.25576 -86.87097      88.98340 
1 1 1 17  18 0  o 160.1222 68.57154 3.497576       7.604490      7.049385       9.547496      -2.665554      12.57666  185.9534 78.10630 164.4159 77.24976 21.53743       109.8550 
1 1 1 17  18 1  o 206.7823 63.83307 10.41049       5.640114      9.925627       6.315892      12.31950       12.53220  200.8607 68.01625 216.2624 90.05984 -15.40172      112.8583 
1 1 1 17  18 2  f 162.1023 62.27887 5.354320       5.511179      7.694448       6.259320      -2.717103      11.62472  182.7488 67.16935 160.5024 75.04466 22.24641       100.7146 
1 1 1 17  18 3  o 373.4783 39.41965 29.46750       5.631118      30.01602       6.403283      27.59578       11.82851  372.4014 45.20200 306.7253 91.99432 65.67615       102.4996 
1 1 1 17  18 4  o 161.0238 64.08372 4.878471       6.009015      4.878471       6.009015      0.000000       0.000000  161.0238 64.08372 ?        ?        0.000000       64.08372 
1 1 1 17  18 5  o 272.2824 56.82736 17.14991       5.814840      17.14991       5.814840      0.000000       0.000000  272.2824 56.82736 ?        ?        0.000000       56.82736 
1 1 1 17  18 6  f 126.3238 54.22574 1.097659       4.775697      2.167995       5.421749      -2.607741      10.08781  138.9215 58.63145 152.0836 70.70526 -13.16212      91.85249 
1 1 1 17  18 7  o 135.2003 56.60675 2.151248       4.989062      9.295382       6.231711      -10.60186      8.326081  196.0182 67.53717 116.9289 56.95185 79.08923       88.34468 
1 1 1 17  18 8  o 149.1763 56.90895 4.323630       4.581563      1.965507       5.539856      9.426968       8.149714  138.4785 58.89432 197.7236 75.78830 -59.24504      95.98128 
1 1 1 17  18 9  o 106.1856 47.24654 -0.5503811     3.920967      1.069338       5.212559      -2.661254      5.950620  130.2038 56.27536 118.7605 54.89526 11.44328       78.61556 
1 1 1 17  19 0  o 281.9177 69.36311 20.60311       7.542213      22.29399       9.438122      17.61534       12.54592  277.5205 81.92775 231.5040 92.45067 46.01651       123.5285 
1 1 1 17  19 1  o 151.3676 60.64000 4.347268       5.416379      3.235430       6.075983      8.650231       11.95307  147.6234 62.17338 193.9549 84.51740 -46.33154      104.9224 
1 1 1 17  19 2  o 119.1532 53.56693 -0.5725607     5.181780      -0.3404799     5.798607      -1.492620      11.54548  126.1770 56.70063 159.7605 74.72657 -33.58355      93.80310 
1 1 1 17  19 3  o 359.4400 40.20578 27.68505       5.516188      30.10717       6.203712      18.53840       12.05549  371.8249 43.80240 241.4783 92.26781 130.3466       102.1372 
1 1 1 17  19 4  o 254.6914 60.86443 15.72359       5.938037      15.72359       5.938037      0.000000       0.000000  254.6914 60.86443 ?        ?        0.000000       60.86443 
1 1 1 17  19 5  o 106.4222 49.42466 -2.668258      4.908425      -3.983283      5.434122      3.158886       11.43906  106.9784 50.42259 174.7128 78.96805 -67.73441      93.69307 
1 1 1 17  19 6  o 480.4926 28.80252 47.07764       5.349796      46.09824       6.135353      50.18449       10.92748  471.3095 33.74336 457.8802 63.13148 13.42938       71.58350 
1 1 1 17  19 7  o 523.9051 28.39128 55.84377       5.754947      62.16565       7.338036      45.74230       9.275752  546.7444 34.73980 447.9141 54.44397 98.83026       64.58328 
1 1 1 17  19 8  o 206.3222 55.12316 9.993625       4.500803      6.035890       5.444698      18.53398       7.998129  166.1831 62.34531 264.8699 74.58472 -98.68687      97.21017 
1 1 1 17  20 0  o 132.4025 60.05166 0.4198301E-01  6.681970      -10.95958      8.305839      20.22445       11.24977  112.0866 55.06966 242.1673 89.85863 -130.0807      105.3909 
1 1 1 17  20 1  o 279.9240 47.44290 17.82627       4.973301      26.03128       5.525553      -17.17545      11.41250  344.0484 42.24245 123.0876 61.20182 220.9608       74.36456 
1 1 1 17  20 2  o 164.2836 60.01719 6.330970       4.986494      7.804303       5.581810      0.5080876      11.09670  177.4992 63.68793 159.8867 74.27431 17.61249       97.84083 
1 1 1 17  20 3  f 204.9211 63.16844 10.68555       5.525513      10.68555       5.525513      0.000000       0.000000  204.9211 63.16844 ?        ?        0.000000       63.16844 
1 1 1 17  20 4  o 143.0369 59.87201 3.133825       5.579153      3.133825       5.579153      0.000000       0.000000  143.0369 59.87201 ?        ?        0.000000       59.87201 
1 1 1 17  20 5  o 162.6268 60.03578 5.998923       5.008882      11.53230       5.629337      -15.03362      10.97509  213.7743 63.31618 125.4491 61.95329 88.32518       88.58414 
1 1 1 17  21 0  o 107.9810 52.26414 -6.625194      6.725907      -9.383036      8.355776      -1.549813      11.33539  114.4486 56.02428 150.2352 71.40436 -35.78658      90.75959 
1 1 1 17  21 1  o 157.0965 57.66374 5.845037       4.610881      3.657802       5.032773      17.27437       11.50456  140.6154 57.66771 220.8666 88.41430 -80.25119      105.5588 
1 1 1 17  21 2  o 225.2309 55.45945 12.41857       4.818757      12.18045       5.355374      13.43130       11.04444  218.0909 60.89716 205.2822 84.93707 12.80867       104.5121 
1 1 1 18  0  0  o 324.5244 77.39245 24.22725       8.463664      24.22725       8.463664      24.22725       8.463664  324.5244 77.39245 324.5244 77.39245 0.000000       0.000000 
1 1 1 18  0  1  o 619.7726 62.11496 78.66106       14.60611      78.66106       14.60611      78.66106       14.60611  619.7726 62.11496 619.7726 62.11496 0.000000       0.000000 
1 1 1 18  0  2  o 275.1397 114.6666 22.03011       12.24081      22.03011       12.24081      22.03011       12.24081  275.1397 114.6666 275.1397 114.6666 0.000000       0.000000 
1 1 1 18  0  3  o 369.2841 61.19099 29.16581       8.051066      29.16581       8.051066      29.16581       8.051066  369.2841 61.19099 369.2841 61.19099 0.000000       0.000000 
1 1 1 18  0  4  o 238.6278 102.8503 16.69645       9.793170      16.69645       9.793170      16.69645       9.793170  238.6278 102.8503 238.6278 102.8503 0.000000       0.000000 
1 1 1 18  0  5  o 487.0327 52.47986 48.59624       9.634503      48.59624       9.634503      48.59624       9.634503  487.0327 52.47986 487.0327 52.47986 0.000000       0.000000 
1 1 1 18  0  6  o 565.7955 48.16595 64.69892       10.40700      64.69892       10.40700      64.69892       10.40700  565.7955 48.16595 565.7955 48.16595 0.000000       0.000000 
1 1 1 18  0  7  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 18  0  8  o 206.9999 99.38164 13.35136       9.222263      13.35136       9.222263      13.35136       9.222263  206.9999 99.38164 206.9999 99.38164 0.000000       0.000000 
1 1 1 18  0  9  o 611.6514 41.06813 74.99951       9.654280      74.99951       9.654280      74.99951       9.654280  611.6514 41.06813 611.6514 41.06813 0.000000       0.000000 
1 1 1 18  0  10 o 99.58588 67.80612 -3.658524      8.038334      -3.658524      8.038334      -3.658524      8.038334  99.58588 67.80612 99.58588 67.80612 0.000000       0.000000 
1 1 1 18  0  11 o 74.71614 53.97850 -14.24543      8.098310      -14.24543      8.098310      -14.24543      8.098310  74.71614 53.97850 74.71614 53.97850 0.000000       0.000000 
1 1 1 18  0  12 o 123.1797 77.93482 2.360709       8.004429      2.360709       8.004429      2.360709       8.004429  123.1797 77.93482 123.1797 77.93482 0.000000       0.000000 
1 1 1 18  0  13 o 181.1168 90.72111 10.77648       7.809293      10.77648       7.809293      10.77648       7.809293  181.1168 90.72111 181.1168 90.72111 0.000000       0.000000 
1 1 1 18  0  14 o 108.9180 71.34704 0.3282363      7.508613      0.3282363      7.508613      0.3282363      7.508613  108.9180 71.34704 108.9180 71.34704 0.000000       0.000000 
1 1 1 18  0  15 o 185.9209 93.29209 11.94796       8.266758      11.94796       8.266758      11.94796       8.266758  185.9209 93.29209 185.9209 93.29209 0.000000       0.000000 
1 1 1 18  0  16 o 334.7865 73.51225 27.12723       8.365549      27.12723       8.365549      27.12723       8.365549  334.7865 73.51225 334.7865 73.51225 0.000000       0.000000 
1 1 1 18  0  17 o 116.9194 75.91580 2.090024       8.235929      2.090024       8.235929      2.090024       8.235929  116.9194 75.91580 116.9194 75.91580 0.000000       0.000000 
1 1 1 18  0  18 o 141.8646 84.44509 7.100501       8.157841      7.100501       8.157841      7.100501       8.157841  141.8646 84.44509 141.8646 84.44509 0.000000       0.000000 
1 1 1 18  1  0  o 251.7502 68.42593 13.99498       6.865066      19.46452       13.58582      12.11950       7.955462  287.8950 99.68989 235.3572 76.22980 52.53784       125.4952 
1 1 1 18  1  1  o 501.4809 31.75571 50.02885       6.152566      52.32915       8.422190      47.39651       9.009563  507.9141 43.10493 480.2456 48.99338 27.66846       65.25631 
1 1 1 18  1  2  o 143.2973 59.97670 1.389301       5.598109      -2.353501      7.818183      5.327334       8.019497  146.4836 65.83096 187.9879 74.27869 -41.50427      99.25240 
1 1 1 18  1  3  o 721.5768 28.12876 102.6667       7.882447      102.4097       9.456496      103.2517       14.26825  718.2004 33.90444 708.9570 52.19000 9.243408       62.23590 
1 1 1 18  1  4  o 235.9040 63.97710 12.05728       6.009227      13.68081       6.873373      6.790966       12.37922  249.9651 68.68682 220.6640 90.46362 29.30103       113.5850 
1 1 1 18  1  5  o 769.5743 37.30755 118.1031       11.15001      118.1031       11.15001      0.000000       0.000000  769.5743 37.30755 ?        ?        0.000000       37.30755 
1 1 1 18  1  6  o 456.6768 43.77683 42.35800       7.668785      63.01646       9.956369      12.22510       12.02465  556.2722 46.51464 246.3715 92.60799 309.9007       103.6332 
1 1 1 18  1  7  o 324.2751 54.39980 22.11634       6.608141      26.75336       9.373336      17.53435       9.317559  348.5400 71.64325 278.0426 81.21046 70.49738       108.2954 
1 1 1 18  1  8  o 220.5678 81.75749 9.573061       9.307910      0.000000       0.000000      9.573061       9.307910  ?        ?        220.5678 81.75749 0.000000       81.75749 
1 1 1 18  1  9  o 434.0141 43.46934 38.42171       7.228308      46.82117       12.14637      33.81599       8.994333  463.5047 69.63067 398.5074 59.97586 64.99725       91.89959 
1 1 1 18  1  10 o 320.6925 50.22498 21.53239       6.049803      20.57688       8.367741      22.57886       8.756949  302.6944 72.19544 317.1381 72.65982 -14.44370      102.4287 
1 1 1 18  1  11 f 242.9313 61.28965 12.94510       5.781980      10.18740       8.363061      15.47029       8.002744  219.6702 78.04774 260.7179 75.00874 -41.04770      108.2486 
1 1 1 18  1  12 o 381.6651 41.36385 29.80970       6.032883      28.06057       8.594326      31.50883       8.470591  357.9714 64.17858 383.0852 58.81621 -25.11377      87.05307 
1 1 1 18  1  13 o 570.7153 27.91575 64.57328       6.187239      62.17314       8.778258      66.94285       8.722165  552.0245 41.24494 574.1268 39.35663 -22.10229      57.00956 
1 1 1 18  1  14 o 429.3757 37.36911 37.48598       6.169160      30.33028       12.58969      39.74712       7.077056  348.5211 91.75647 439.7058 41.95305 -91.18475      100.8926 
1 1 1 18  1  15 o 246.0327 63.57336 13.69866       6.117830      13.18586       8.668183      14.20762       8.635744  237.0698 79.68476 244.7416 79.43647 -7.671783      112.5158 
1 1 1 18  1  16 o 199.0199 65.39917 8.816691       5.846644      2.121728       8.214333      15.69088       8.323557  165.0842 70.99752 255.1055 77.31902 -90.02135      104.9708 
1 1 1 18  1  17 o 148.8348 61.74590 2.539175       5.859075      1.070896       8.322569      3.981917       8.249876  160.0433 70.10995 173.8888 72.79734 -13.84549      101.0686 
1 1 1 18  1  18 o 200.0458 64.97397 9.081010       5.777113      9.266516       8.129315      8.891737       8.211449  204.7639 76.30569 202.4184 76.43338 2.345596       108.0029 
1 1 1 18  2  0  o 732.7437 24.47503 105.5936       6.964714      117.0254       9.940933      94.57252       9.760726  767.2303 33.36364 687.1435 36.70975 80.08685       49.60583 
1 1 1 18  2  1  o 281.4774 53.20818 16.73197       5.603235      17.42338       7.761086      15.97922       8.097989  280.0538 71.20210 267.1447 74.98694 12.90903       103.4059 
1 1 1 18  2  2  o 227.7239 61.93860 11.21475       5.622745      12.14597       7.797899      10.20623       8.115108  236.1421 75.36562 221.6789 77.03069 14.46320       107.7669 
1 1 1 18  2  3  o 153.9811 59.70710 3.510638       5.100879      6.000905       6.857980      0.4270994      7.631290  185.4719 69.89432 157.5888 68.10139 27.88312       97.58594 
1 1 1 18  2  4  o 369.3462 49.55900 28.17206       6.929283      28.17206       6.929283      0.000000       0.000000  369.3462 49.55900 ?        ?        0.000000       49.55900 
1 1 1 18  2  5  o 635.7973 30.56797 79.93258       7.547676      89.68755       10.73218      70.38622       10.61681  667.2108 41.62644 587.8939 46.89157 79.31696       62.70231 
1 1 1 18  2  6  o 277.8467 62.40075 16.69509       6.568582      11.92712       9.318826      21.40326       9.260206  237.1432 82.53819 308.4859 77.41864 -71.34270      113.1645 
1 1 1 18  2  7  o 377.5240 45.00983 29.17509       6.468936      22.61523       9.051020      36.02523       9.249112  318.1495 74.55675 412.7575 59.41203 -94.60803      95.33362 
1 1 1 18  2  8  o 245.6456 65.76913 13.24365       6.399041      24.73367       8.806472      0.3909117      9.314069  334.9424 69.95905 170.9470 74.54573 163.9954       102.2318 
1 1 1 18  2  9  o 320.3505 52.23960 21.57232       6.275087      11.64322       8.816152      31.76782       8.933642  232.3895 80.31525 384.8330 61.87271 -152.4435      101.3843 
1 1 1 18  2  10 o 229.2397 77.18446 11.46698       8.132887      0.000000       0.000000      11.46698       8.132887  ?        ?        229.2397 77.18446 0.000000       77.18446 
1 1 1 18  2  11 o 163.8555 62.96143 4.409093       5.633142      7.828715       8.370749      1.578615       7.615618  203.3609 77.07933 161.5599 68.88937 41.80098       103.3778 
1 1 1 18  2  12 o 268.9730 56.50615 15.66172       5.714780      14.42708       8.183928      16.83667       7.983633  250.8158 76.80396 271.0744 73.83685 -20.25858      106.5398 
1 1 1 18  2  13 o 403.2895 37.52077 33.03882       5.809063      24.38454       8.175892      41.86179       8.255193  331.0646 65.90776 448.2746 48.17519 -117.2100      81.63750 
1 1 1 18  2  14 o 313.1480 50.94754 20.88116       5.982840      10.12112       12.33946      24.18807       6.840697  227.0035 91.32014 335.5729 54.34973 -108.5694      106.2698 
1 1 1 18  2  15 o 285.3119 53.25343 17.63383       5.683568      14.83065       11.38748      18.56377       6.558918  248.1898 90.69277 288.8829 60.40638 -40.69305      108.9684 
1 1 1 18  2  16 o 422.0686 39.13047 36.64944       6.341012      36.60511       8.957557      36.69397       8.977567  408.7314 58.06418 409.1825 58.12982 -0.4511414     82.16158 
1 1 1 18  2  17 o 148.2662 62.20533 2.223043       6.044572      9.405060       8.515754      -5.069884      8.581255  207.1559 77.92050 138.3152 64.60647 68.84073       101.2206 
1 1 1 18  2  18 o 135.7141 60.66629 -0.8730412     6.545794      3.491986       8.352437      -7.821754      10.53833  171.2673 72.55423 145.7095 69.13523 25.55785       100.2187 
1 1 1 18  3  0  o 183.4219 65.62381 6.487422       5.922257      2.224957       8.195395      11.14593       8.567676  170.7217 72.07066 228.6517 79.16671 -57.92999      107.0586 
1 1 1 18  3  1  o 133.7440 58.41711 -0.4195392     5.740439      0.1141274      7.874312      -1.024855      8.386265  157.7481 68.67225 157.1343 69.54436 0.6137848      97.73584 
1 1 1 18  3  2  o 237.7175 65.48632 12.33102       6.238572      12.47188       7.644300      12.05009       10.79525  238.5040 74.42789 241.1473 88.27503 -2.643311      115.4642 
1 1 1 18  3  3  o 291.9475 56.53027 18.10397       6.177758      20.17529       6.857584      9.183496       14.23121  307.2411 59.62357 238.8626 97.35192 68.37854       114.1594 
1 1 1 18  3  4  o 247.9050 62.53583 13.32904       6.020086      14.39352       6.778234      9.353127       13.09983  256.2585 67.25980 235.2312 94.28133 21.02724       115.8139 
1 1 1 18  3  5  o 229.0256 60.20609 11.31331       5.425567      9.798383       6.636689      14.36589       9.420811  214.9385 69.62635 254.4959 82.98661 -39.55737      108.3264 
1 1 1 18  3  6  o 137.2909 60.66472 -1.056140      6.356462      6.809133       8.968676      -8.994515      9.010259  202.2399 78.96138 135.0459 64.03238 67.19402       101.6614 
1 1 1 18  3  7  o 406.8286 42.14103 33.64951       6.561461      44.05970       9.501021      24.15735       9.072424  459.7515 54.25869 329.6033 72.81818 130.1482       90.81020 
1 1 1 18  3  8  o 151.5803 62.57984 2.178572       5.976428      12.68512       8.659258      -7.378778      8.258844  240.0762 79.62396 132.0737 62.22358 108.0025       101.0532 
1 1 1 18  3  9  f 180.6973 66.69755 6.037201       6.181735      -0.8935704     8.671820      13.19794       8.814512  159.5158 70.65247 243.4058 80.31573 -83.88998      106.9691 
1 1 1 18  3  10 o 298.5584 54.52302 18.98641       6.088797      10.63106       8.819153      26.59652       8.416661  224.2059 80.09553 349.1776 64.44173 -124.9717      102.8009 
1 1 1 18  3  11 o 324.6669 59.44350 22.78220       7.218775      13.12822       15.27778      25.55702       8.190776  253.5424 101.7479 341.6624 64.08466 -88.12000      120.2476 
1 1 1 18  3  12 o 133.3046 59.73742 -1.644118      6.389025      -4.813838      11.11178      -0.7867642E-01 7.808930  163.3772 75.34148 154.3287 67.75157 9.048492       101.3243 
1 1 1 18  3  13 o 279.2398 57.48183 17.00115       6.025804      31.89736       12.81079      12.76907       6.828341  359.2375 91.55726 237.2191 69.58855 122.0184       115.0013 
1 1 1 18  3  14 o 309.4322 51.36469 20.45179       5.956013      7.194104       12.28667      24.52411       6.809591  212.8256 88.94676 338.0870 53.65608 -125.2614      103.8773 
1 1 1 18  3  15 o 420.7571 37.23727 36.15017       6.021834      29.30249       11.91758      38.49793       6.978199  341.0121 89.03069 431.3678 42.19538 -90.35568      98.52367 
1 1 1 18  3  16 o 547.4193 28.89930 60.01818       6.122005      65.09199       9.633060      56.58052       7.929193  558.5282 44.78781 524.8309 39.18546 33.69727       59.51007 
1 1 1 18  3  17 o 138.8363 61.66663 -0.4678284     6.651589      -0.9416974     8.454409      0.3020240      10.77601  152.0964 68.39544 172.8990 77.52402 -20.80258      103.3823 
1 1 1 18  3  18 o 325.7247 57.24423 23.56668       6.976918      23.97482       8.871613      22.90505       11.29541  315.9450 73.66151 293.8490 90.27213 22.09595       116.5121 
1 1 1 18  4  0  o 399.8424 56.80330 33.76347       8.572449      33.76347       8.572449      0.000000       0.000000  399.8424 56.80330 ?        ?        0.000000       56.80330 
1 1 1 18  4  1  o 361.4761 49.48031 27.11005       6.763731      31.00757       8.781752      21.42634       10.60480  380.8092 61.47460 303.4146 86.03899 77.39465       105.7442 
1 1 1 18  4  2  o 471.2939 32.41054 44.27101       5.896007      41.05763       7.891613      48.33089       8.870369  447.9800 46.01439 485.5034 47.66029 -37.52338      66.24822 
1 1 1 18  4  3  o 167.5795 64.41265 4.483953       5.896965      4.062162       6.529866      6.348863       13.73045  169.2264 66.97503 224.1018 93.87402 -54.87538      115.3169 
1 1 1 18  4  4  o 125.6447 56.79656 -2.428366      5.919422      -1.259013      6.647203      -6.908440      13.01094  139.3771 61.78894 174.3586 80.79765 -34.98148      101.7160 
1 1 1 18  4  5  o 308.9196 50.59826 19.93019       5.860065      19.15142       6.700138      22.46475       12.08730  298.7919 59.82801 308.4464 93.10473 -9.654541      110.6701 
1 1 1 18  4  6  o 684.2115 40.20197 94.29650       10.63539      0.000000       0.000000      94.29650       10.63539  ?        ?        684.2115 40.20197 0.000000       40.20197 
1 1 1 18  4  7  o 238.3712 67.43159 12.50386       6.522013      12.33173       8.542784      12.74439       10.09813  237.3276 79.10458 242.7556 85.81468 -5.428024      116.7120 
1 1 1 18  4  8  o 438.5468 39.11864 38.90159       6.592406      75.56119       9.727179      7.758583       8.965475  610.9931 41.23549 206.7070 79.42949 404.2861       89.49531 
1 1 1 18  4  9  o 221.6147 67.12244 10.76087       6.274519      22.41844       9.007183      -0.2294564     8.745616  314.4724 74.83585 162.7135 71.55982 151.7589       103.5433 
1 1 1 18  4  10 o 383.3217 43.25177 30.15423       6.326078      30.97136       9.077306      29.38259       8.821049  377.0325 64.30069 367.0893 64.21443 9.943207       90.87394 
1 1 1 18  4  11 o 348.5502 45.73714 25.19431       6.041582      33.36664       8.767256      17.80418       8.337135  394.1876 59.09174 278.1943 75.31975 115.9933       95.73347 
1 1 1 18  4  12 o 141.0774 59.25204 1.482005       5.493704      -5.652021      7.862323      8.288018       7.679447  132.3374 61.82322 202.3459 74.39574 -70.00858      96.73074 
1 1 1 18  4  13 o 177.3420 71.67124 4.659791       7.638704      0.000000       0.000000      4.659791       7.638704  ?        ?        177.3420 71.67124 0.000000       71.67124 
1 1 1 18  4  14 o 509.1229 35.70248 52.52050       7.014440      58.91322       13.45710      50.13568       8.219335  511.6449 69.52657 492.5269 43.41540 19.11798       81.96854 
1 1 1 18  4  15 f 266.7928 61.56560 16.04295       6.249181      15.42674       11.83129      16.28138       7.359549  250.2216 92.28962 263.7371 70.49868 -13.51553      116.1354 
1 1 1 18  4  16 o 451.2263 37.50584 41.74059       6.512802      37.41323       12.06234      43.52120       7.737577  390.8534 82.07978 456.2142 44.22802 -65.36087      93.23737 
1 1 1 18  4  17 o 228.1505 66.90728 12.17386       6.313159      11.78652       9.121818      12.52997       8.746324  223.1271 81.22600 228.0921 79.93016 -4.965012      113.9583 
1 1 1 18  5  0  o 562.1169 41.38940 64.04965       8.971766      64.04965       8.971766      0.000000       0.000000  562.1169 41.38940 ?        ?        0.000000       41.38940 
1 1 1 18  5  1  o 148.4303 61.53971 1.937393       5.814808      2.505170       7.937076      1.279604       8.543084  170.0131 71.30276 168.5512 72.44402 1.461884       101.6475 
1 1 1 18  5  2  o 620.4175 29.62966 76.15823       7.139022      81.31931       7.980712      55.48911       15.97100  639.2448 32.25148 491.9986 86.75797 147.2462       92.55864 
1 1 1 18  5  3  o 827.6585 24.16839 134.6742       7.768317      150.7873       8.922703      84.20827       15.79088  874.7980 26.26399 627.7227 65.75122 247.0754       70.80268 
1 1 1 18  5  4  o 97.35324 48.49613 -17.48805      7.303792      -23.87053      8.968621      -4.920090      12.58529  103.4166 51.84851 176.5490 80.95971 -73.13247      96.13918 
1 1 1 18  5  5  o 449.9652 36.24734 40.66793       6.280360      43.34768       7.064328      30.56475       13.71678  463.1489 39.65802 355.4821 96.76411 107.6668       104.5756 
1 1 1 18  5  6  o 122.5880 56.62842 -4.122822      6.317439      -9.385501      8.407795      2.700665       9.573746  127.5682 60.87254 183.0599 77.62100 -55.49170      98.64323 
1 1 1 18  5  7  o 315.8252 54.47392 21.13263       6.439983      22.53722       8.659417      19.39435       9.633243  317.4324 71.91057 289.5367 81.96805 27.89578       109.0408 
1 1 1 18  5  8  o 235.4955 68.15647 12.28908       6.589745      23.20242       8.871912      -1.141399      9.842015  321.1693 72.80986 167.7454 74.72971 153.4239       104.3351 
1 1 1 18  5  9  o 137.4962 59.74421 0.1357804E-01  5.937842      5.285543       8.237145      -5.689522      8.567339  186.8415 74.80608 139.8336 65.05977 47.00795       99.13992 
1 1 1 18  5  10 o 244.7030 63.43902 13.26670       6.078805      5.857785       8.311967      21.78566       8.912916  190.1496 75.46608 308.2825 75.13214 -118.1329      106.4893 
1 1 1 18  5  11 o 263.1677 70.16080 15.73459       7.301402      18.04205       14.05383      14.88152       8.545134  273.0790 100.6060 253.4937 78.62342 19.58534       127.6840 
1 1 1 18  5  12 o 352.6596 52.18938 26.39757       6.931851      43.99456       12.89482      19.24562       8.220692  435.8221 79.09969 288.7881 73.20240 147.0340       107.7746 
1 1 1 18  5  13 o 141.1814 61.11774 0.5115169      6.168008      15.51506       12.16948      -4.675126      7.155141  254.5224 93.64139 127.9235 59.49773 126.5989       110.9445 
1 1 1 18  5  14 o 645.9332 35.48650 84.47849       8.867694      0.000000       0.000000      84.47849       8.867694  ?        ?        645.9332 35.48650 0.000000       35.48650 
1 1 1 18  5  15 o 147.3556 63.23262 1.327654       6.490041      0.000000       0.000000      1.327654       6.490041  ?        ?        147.3556 63.23262 0.000000       63.23262 
1 1 1 18  5  16 o 316.4144 48.53244 21.45312       5.773370      17.18103       12.15058      22.69888       6.561365  256.7603 93.70387 321.9410 54.41913 -65.18069      108.3598 
1 1 1 18  5  17 o 333.9114 46.03278 23.70546       5.810639      24.52308       12.76427      23.49173       6.526055  297.5909 96.57507 327.9238 53.05701 -30.33286      110.1898 
1 1 1 18  6  0  o 179.2029 65.67068 6.031316       5.976792      11.27203       7.877298      -1.078846      9.175331  227.1013 75.96444 162.5426 72.30048 64.55870       104.8711 
1 1 1 18  6  1  o 196.8027 65.62510 8.093904       5.879213      20.40404       7.940853      -6.840175      8.746311  302.9675 69.03023 138.2109 64.77183 164.7567       94.66025 
1 1 1 18  6  2  o 387.7396 44.15311 30.81219       6.530019      34.15979       7.192882      15.11966       15.57337  407.4634 46.27629 266.1434 104.0115 141.3201       113.8415 
1 1 1 18  6  3  o 296.8592 57.64916 18.88397       6.406586      17.32136       7.064163      26.12445       15.20612  280.3917 65.97430 323.1689 105.4347 -42.77725      124.3748 
1 1 1 18  6  4  o 373.6547 44.85537 28.67782       6.378896      27.08789       7.129441      35.05885       14.28274  359.4207 52.63682 380.2347 96.54688 -20.81403      109.9633 
1 1 1 18  6  5  o 455.1051 35.53095 41.59694       6.230031      45.06284       7.020811      28.75894       13.51226  472.4025 38.60641 343.0258 97.06700 129.3767       104.4627 
1 1 1 18  6  6  o 364.3637 39.80634 27.00281       5.541046      27.26625       6.583663      26.36298       10.26032  362.5792 47.93091 339.0356 79.33421 23.54358       92.68920 
1 1 1 18  6  7  o 732.0135 27.44327 105.9140       7.801587      104.0484       10.97377      107.8204       11.09343  717.8229 39.51723 730.9612 39.22223 -13.13837      55.67759 
1 1 1 18  6  8  o 304.0428 68.91449 20.66179       7.949245      38.33947       14.23289      12.64755       9.583220  397.6944 93.69447 238.9625 83.67098 158.7319       125.6164 
1 1 1 18  6  9  o 210.5178 74.77774 9.294199       7.676513      21.94746       13.66918      3.465125       9.277719  296.4929 100.0631 182.8937 76.91705 113.5992       126.2096 
1 1 1 18  6  10 o 344.9914 58.42529 25.68896       7.548352      20.57757       13.71869      27.90833       9.039759  287.1871 100.1346 353.7748 68.26954 -66.58774      121.1927 
1 1 1 18  6  11 o 196.8117 72.79639 7.728544       7.371532      25.45222       13.88849      0.7773343      8.697782  313.7664 100.6267 164.9601 71.98331 148.8063       123.7228 
1 1 1 18  6  12 o 163.4589 65.44011 3.914061       6.303189      8.302072       12.45586      2.403586       7.307971  219.0019 90.37384 161.7287 68.15378 57.27312       113.1917 
1 1 1 18  6  13 o 184.6295 65.94269 7.025405       5.977517      5.946587       12.89874      7.320452       6.745571  209.1510 89.43016 189.7959 69.73408 19.35516       113.4046 
1 1 1 18  6  14 o 178.0287 64.44363 6.451896       5.730144      -8.416396      11.65735      11.18891       6.579938  154.0408 72.97934 220.6110 69.08629 -66.57021      100.4933 
1 1 1 18  6  15 o 190.0140 63.89002 7.951646       5.572435      19.81995       11.68205      4.455714       6.340247  274.3853 92.50481 165.1410 65.79349 109.2444       113.5162 
1 1 1 18  6  16 o 311.9890 56.78387 21.61192       6.626594      0.000000       0.000000      21.61192       6.626594  ?        ?        311.9890 56.78387 0.000000       56.78387 
1 1 1 18  6  17 o 889.8447 21.96649 156.6235       7.591067      169.8130       16.41571      153.0359       8.561443  896.1998 47.33363 877.1134 25.13409 19.08643       53.59287 
1 1 1 18  7  0  o 461.4456 41.18244 43.38512       7.302514      62.29472       11.58117      30.90461       9.408659  543.6719 55.63512 374.5101 67.15707 169.1617       87.20859 
1 1 1 18  7  1  o 197.7481 73.92452 7.458683       7.641711      18.19544       8.743716      -27.26396      15.72411  281.1088 77.56365 150.7435 74.39071 130.3652       107.4714 
1 1 1 18  7  2  o 395.4831 53.04614 32.85559       7.941879      28.29663       9.121094      47.14668       16.14903  358.1357 68.06828 440.2809 97.05979 -82.14529      118.5491 
1 1 1 18  7  3  o 615.9311 72.17370 83.46998       16.93661      0.000000       0.000000      83.46998       16.93661  ?        ?        615.9311 72.17370 0.000000       72.17370 
1 1 1 18  7  4  o 293.3223 66.42319 19.05177       7.390670      24.22722       8.447944      2.170285       15.25747  330.8280 68.02568 213.0927 94.08199 117.7353       116.0987 
1 1 1 18  7  5  f 174.0264 69.22285 4.479625       7.008118      2.635331       8.023211      10.41611       14.39454  170.4740 71.60222 240.1269 97.89285 -69.65295      121.2843 
1 1 1 18  7  6  o 226.4304 71.58501 11.35175       7.047985      15.85586       8.259557      -0.7120472     13.51744  263.1012 76.35051 193.5647 86.80594 69.53648       115.6057 
1 1 1 18  7  7  o 205.1262 76.99730 8.201717       8.306783      -0.4436340     14.32733      12.57944       10.19526  198.6331 89.20345 238.9597 86.03815 -40.32661      123.9347 
1 1 1 18  7  8  o 194.0392 75.82395 6.573122       8.275510      34.97603       15.13372      -5.542751      9.884200  369.7476 102.0520 151.4771 70.27513 218.2705       123.9081 
1 1 1 18  7  9  o 171.9674 71.04725 3.529142       7.711068      10.18313       13.15527      0.4632451E-01  9.517527  232.2172 93.98305 168.3988 74.33012 63.81831       119.8240 
1 1 1 18  7  10 o 183.6824 66.91015 6.655438       6.191226      5.812791       8.854329      7.461563       8.660324  191.4592 77.23833 200.2591 77.75742 -8.799911      109.5992 
1 1 1 18  7  11 o 717.9034 27.05923 102.2035       7.544134      104.5134       14.93897      101.4127       8.740528  701.5783 55.27755 712.4341 31.59112 -10.85577      63.66794 
1 1 1 18  7  12 o 192.6524 70.26217 7.634346       6.830047      -16.12537      12.11944      18.69258       8.268079  141.3855 68.83041 281.9807 74.41655 -140.5952      101.3679 
1 1 1 18  7  13 o 129.6867 57.68027 -0.8784034     5.838373      -0.2172204E-01 12.22991      -1.131264      6.644374  182.6625 82.18967 136.6737 61.10645 45.98883       102.4165 
1 1 1 18  7  14 o 579.9882 28.43902 67.16396       6.405629      65.91629       13.25651      67.54401       7.316484  542.8113 64.12429 578.2540 32.71449 -35.44275      71.98724 
1 1 1 18  7  15 o 460.4438 33.17374 43.03849       5.892229      46.06308       12.51882      42.17778       6.678188  439.4497 76.11120 452.5215 38.36184 -13.07181      85.23230 
1 1 1 18  7  16 o 128.9605 56.38465 0.1595268      5.359963      6.820655       11.02521      -1.902060      6.133576  199.3481 83.84339 126.5097 57.43882 72.83842       101.6314 
1 1 1 18  8  0  f 452.4683 41.79704 41.89458       7.261484      30.97060       11.76793      48.61153       9.227748  360.3791 85.39210 482.5569 49.96398 -122.1779      98.93538 
1 1 1 18  8  1  o 331.6722 62.31804 24.06394       7.732236      26.13636       8.902677      17.70010       15.60058  341.5786 69.47758 273.1923 104.8243 68.38629       125.7587 
1 1 1 18  8  2  o 251.4894 74.73756 14.45253       7.833626      14.26268       8.890985      15.11133       16.56241  249.1149 80.57711 263.5963 105.8840 -14.48143      133.0567 
1 1 1 18  8  3  o 172.4391 70.49414 3.777748       7.490643      -0.1554421     8.420956      18.68647       16.39491  159.4513 70.16988 279.2470 107.3858 -119.7958      128.2791 
1 1 1 18  8  4  o 172.1879 68.99065 4.282485       7.011941      7.157251       7.870048      -6.785716      15.44240  196.0325 74.63381 187.1259 87.15778 8.906601       114.7462 
1 1 1 18  8  5  o 125.6174 58.68779 -5.361641      7.086927      -3.698563      7.938183      -11.89221      15.73042  140.4094 64.35439 176.9688 84.11192 -36.55940      105.9071 
1 1 1 18  8  6  o 100.7206 49.41092 -11.94019      6.607644      -16.18814      7.459139      3.544255       14.24121  100.8387 50.02681 210.4958 91.97424 -109.6571      104.6993 
1 1 1 18  8  7  o 119.0479 56.11325 -6.067440      6.730965      -2.652740      8.777304      -10.94235      10.48740  151.7031 68.81346 141.1525 67.52835 10.55067       96.41251 
1 1 1 18  8  8  o 344.0270 52.33539 25.13192       6.771785      15.98849       8.676291      39.38335       10.83201  261.2244 78.88818 420.4819 68.70701 -159.2575      104.6136 
1 1 1 18  8  9  o 713.6295 27.12360 100.9502       7.517061      104.1294       10.45402      97.54655       10.81671  717.1461 37.66787 691.9032 40.43113 25.24286       55.25888 
1 1 1 18  8  10 o 724.7466 26.20125 104.0531       7.374562      102.4449       10.40215      105.6781       10.45647  710.6631 37.82664 722.1527 37.41276 -11.48956      53.20310 
1 1 1 18  8  11 o 129.7116 58.83826 -2.246641      6.417132      5.083945       12.76008      -4.728310      7.424309  205.2605 88.38272 130.1788 60.56662 75.08176       107.1439 
1 1 1 18  8  12 o 609.9579 29.65143 74.31151       7.023822      65.19669       14.05149      77.34757       8.109672  537.0015 68.97236 618.8610 33.87140 -81.85956      76.84047 
1 1 1 18  8  13 o 168.9834 64.87733 5.240102       5.978081      3.707969       12.47417      5.696894       6.811187  195.7079 85.78096 176.6935 68.86034 19.01439       110.0005 
1 1 1 18  8  14 o 187.0198 68.15685 7.429132       6.425142      -14.61888      13.06569      14.46148       7.379007  148.5492 72.12163 245.5793 72.42537 -97.03009      102.2104 
1 1 1 18  8  15 o 119.1019 55.13642 -3.379924      6.036569      0.000000       0.000000      -3.379924      6.036569  ?        ?        119.1019 55.13642 0.000000       55.13642 
1 1 1 18  8  16 o 223.4356 65.81066 11.74828       6.096132      0.000000       0.000000      11.74828       6.096132  ?        ?        223.4356 65.81066 0.000000       65.81066 
1 1 1 18  9  0  o 270.1360 65.07706 16.42672       6.746199      18.86407       7.365338      3.730517       16.81010  288.8507 66.96333 219.8085 97.81313 69.04222       118.5390 
1 1 1 18  9  1  o 117.9569 55.37724 -5.379550      6.441245      -6.020111      7.131036      -2.540782      15.01195  123.2714 57.99818 193.7978 88.70432 -70.52644      105.9823 
1 1 1 18  9  2  o 192.6205 68.01266 7.677934       6.341261      8.272164       6.901131      4.454987       16.07197  199.2047 70.88557 220.1584 96.91158 -20.95364      120.0692 
1 1 1 18  9  3  o 435.1619 40.65376 38.72937       6.790776      40.80478       7.436793      28.31654       16.65781  445.1152 43.58054 322.9110 110.4544 122.2042       118.7410 
1 1 1 18  9  4  o 326.2483 51.49701 22.59023       6.308198      25.48244       6.816851      5.351002       16.64285  346.4341 52.29634 225.4657 98.94708 120.9684       111.9171 
1 1 1 18  9  5  o 266.0422 59.83900 15.59343       6.032654      14.52529       6.500098      22.22888       16.20095  254.1313 65.46094 292.2887 107.9579 -38.15736      126.2539 
1 1 1 18  9  6  o 385.5733 42.19244 30.61242       6.214752      38.75004       6.776383      -12.46472      15.59095  435.1384 40.56751 173.4025 82.78492 261.7358       92.19038 
1 1 1 18  9  7  o 239.1503 57.92889 12.60026       5.323253      14.90090       6.281132      6.735240       10.02879  257.9958 63.19115 201.7033 81.90972 56.29256       103.4520 
1 1 1 18  9  8  f 219.9339 83.01254 10.24973       9.683356      0.000000       0.000000      10.24973       9.683356  ?        ?        219.9339 83.01254 0.000000       83.01254 
1 1 1 18  9  9  o 125.2224 57.39298 -3.052613      6.313424      -1.274372      8.451988      -5.297285      9.495983  153.0592 68.64078 147.3222 68.52768 5.736969       96.99278 
1 1 1 18  9  10 o 353.7767 47.11602 26.34644       6.312349      37.74510       8.796718      14.24654       9.063269  418.5377 55.48798 244.4919 81.47809 174.0458       98.57786 
1 1 1 18  9  11 o 136.0997 60.63328 -0.8889953     6.479619      10.44745       13.17823      -4.503550      7.441254  227.2033 93.26329 130.5912 60.71758 96.61206       111.2864 
1 1 1 18  9  12 o 437.2391 42.95325 39.80595       7.199469      0.000000       0.000000      39.80595       7.199469  ?        ?        437.2391 42.95325 0.000000       42.95325 
1 1 1 18  9  13 o 540.4543 35.25656 59.53663       7.359383      0.000000       0.000000      59.53663       7.359383  ?        ?        540.4543 35.25656 0.000000       35.25656 
1 1 1 18  9  14 o 152.1300 63.74069 2.626517       6.332764      0.000000       0.000000      2.626517       6.332764  ?        ?        152.1300 63.74069 0.000000       63.74069 
1 1 1 18  9  15 o 258.1084 67.32556 15.83480       6.819058      0.000000       0.000000      15.83480       6.819058  ?        ?        258.1084 67.32556 0.000000       67.32556 
1 1 1 18  9  16 o 142.2298 58.81375 2.466443       5.290977      -5.954224      12.19623      4.418615       5.872344  160.2115 75.52117 160.1447 63.47148 0.6683350E-01  98.65128 
1 1 1 18  10 0  o 436.8326 41.88405 39.38630       7.018340      48.22560       7.780353      0.7761574      16.26077  483.7372 41.82691 206.2543 93.59811 277.4829       102.5188 
1 1 1 18  10 1  o 175.2035 68.50723 5.287816       6.758761      3.563335       7.339078      14.91669       17.34203  167.9232 69.33923 256.7925 106.3562 -88.86923      126.9629 
1 1 1 18  10 2  o 375.7776 46.66497 29.57109       6.663441      27.70036       7.170804      41.40515       18.03555  359.9590 52.87199 382.3495 113.3513 -22.39047      125.0758 
1 1 1 18  10 3  o 230.4747 67.55708 12.07888       6.437723      14.61571       7.002561      -1.770310      16.36150  252.1542 69.34621 201.1820 92.27562 50.97223       115.4283 
1 1 1 18  10 4  o 528.2717 33.28883 56.18108       6.794493      54.96259       7.428674      62.41735       16.80597  520.3333 37.00342 507.8878 88.41769 12.44547       95.84853 
1 1 1 18  10 5  o 148.2739 61.53211 2.253042       5.821134      -0.6368949     6.249810      21.17790       15.99333  135.8053 60.07366 283.5349 106.7585 -147.7296      122.4999 
1 1 1 18  10 6  o 128.9920 60.48771 -5.739331      7.647126      -11.69271      8.907541      10.94565       14.91211  124.2871 60.15394 236.6153 98.36275 -112.3283      115.2984 
1 1 1 18  10 7  o 392.0139 53.97986 32.94609       7.999961      35.61930       9.600879      26.87445       14.46931  400.7159 63.83627 315.4441 102.8454 85.27188       121.0464 
1 1 1 18  10 8  o 171.2691 69.58358 4.294721       7.241651      0.5816306      8.768385      12.26099       12.84338  162.8550 71.63677 236.2145 93.78905 -73.35942      118.0179 
1 1 1 18  10 9  o 337.2878 59.20396 25.08637       7.472075      23.82686       9.306120      27.37160       12.53523  316.1655 76.59901 324.0484 94.06516 -7.882935      121.3081 
1 1 1 18  10 10 f 144.7293 67.47481 -5.160113      9.290271      0.000000       0.000000      -5.160113      9.290271  ?        ?        144.7293 67.47481 0.000000       67.47481 
1 1 1 18  10 11 o 140.4258 65.20045 -4.350395      8.533402      0.000000       0.000000      -4.350395      8.533402  ?        ?        140.4258 65.20045 0.000000       65.20045 
1 1 1 18  10 12 o 359.1267 64.40331 29.43528       8.652228      0.000000       0.000000      29.43528       8.652228  ?        ?        359.1267 64.40331 0.000000       64.40331 
1 1 1 18  10 13 o 168.8935 70.71924 3.873527       7.787634      0.000000       0.000000      3.873527       7.787634  ?        ?        168.8935 70.71924 0.000000       70.71924 
1 1 1 18  10 14 o 283.3710 62.69762 18.59794       6.717043      5.806641       12.33462      23.99042       8.008718  198.2110 86.11691 319.7147 66.66132 -121.5037      108.9030 
1 1 1 18  10 15 o 357.8668 51.56917 28.00675       6.960125      9.558596       12.85633      35.65547       8.278178  214.0725 90.31387 401.9230 54.43581 -187.8505      105.4507 
1 1 1 18  11 0  f 166.7699 67.27301 4.287941       6.716380      4.660777       7.548058      2.870257       14.71856  174.1427 70.92825 202.9651 90.83199 -28.82240      115.2444 
1 1 1 18  11 1  o 505.5204 46.02905 53.49141       8.937469      25.74116       10.23407      142.6645       18.34559  324.1773 81.40499 810.0812 58.71278 -485.9039      100.3691 
1 1 1 18  11 2  o 213.0123 68.41995 10.31364       6.418993      9.880924       6.911478      13.02943       17.31485  209.5493 71.15003 246.5183 104.4500 -36.96906      126.3809 
1 1 1 18  11 3  o 261.0150 63.45646 15.47050       6.369870      18.20211       6.894874      -0.4449226     16.64279  283.2121 64.17331 203.3927 93.20705 79.81934       113.1626 
1 1 1 18  11 4  o 457.8697 44.41112 43.64942       7.797685      38.99240       8.995665      57.72453       15.63888  424.4407 55.93701 487.0802 85.81046 -62.63943      102.4323 
1 1 1 18  11 5  o 286.0411 72.53146 19.24760       8.068694      17.76597       9.648421      22.69402       14.71539  268.2647 83.60104 288.5111 103.4201 -20.24637      132.9844 
1 1 1 18  11 6  o 247.2994 76.39375 14.59104       8.076558      29.05326       9.829022      -15.47319      14.17157  351.7920 74.27530 155.8790 75.54829 195.9130       105.9451 
1 1 1 18  11 7  o 205.4548 77.76683 8.907593       8.513408      7.938072       11.09143      10.29791       13.28207  208.6727 85.59776 226.2898 93.34538 -17.61716      126.6505 
1 1 1 18  11 8  o 181.5908 74.92030 4.957643       8.558056      5.559388       11.89934      4.312881       12.31732  200.6325 85.84457 197.5030 85.93320 3.129517       121.4652 
1 1 1 18  11 9  o 203.4912 74.76462 9.076061       7.753863      9.689454       10.97008      8.463663       10.96117  215.4861 86.30930 209.2788 85.38269 6.207275       121.4063 
1 1 1 18  11 10 o 347.5975 70.31688 28.30834       9.166112      0.000000       0.000000      28.30834       9.166112  ?        ?        347.5975 70.31688 0.000000       70.31688 
1 1 1 18  11 11 f 168.7221 70.09243 4.022523       7.564976      13.16498       14.81827      0.7998272      8.797835  235.8294 98.04581 160.9804 71.23930 74.84901       121.1941 
1 1 1 18  11 12 o 370.5204 52.84405 30.04673       7.388456      22.12027       14.42424      32.86618       8.602719  274.8836 101.7992 381.8655 59.98673 -106.9819      118.1587 
1 1 1 18  11 13 o 287.2553 63.31997 19.21962       6.873555      32.37095       13.18356      14.31015       8.054991  339.3513 95.82732 238.9752 76.63261 100.3761       122.7006 
1 1 1 18  11 14 o 144.5259 62.23307 1.542506       6.326866      18.97989       13.25998      -3.597530      7.199215  257.4391 97.14757 129.0055 59.89427 128.4337       114.1270 
1 1 1 18  12 0  o 127.7475 59.76249 -4.813438      7.389640      -2.799877      8.501164      -11.03854      14.94752  144.8378 66.46255 166.5599 79.92952 -21.72209      103.9519 
1 1 1 18  12 1  o 315.9620 60.90044 22.52279       7.201849      18.37996       8.085030      38.43817       15.84680  275.6659 73.97846 365.4150 105.6736 -89.74908      128.9950 
1 1 1 18  12 2  o 362.1569 52.34110 28.39061       7.147941      26.22426       8.108797      35.94099       15.13831  339.6997 63.80878 356.7999 103.3138 -17.10019      121.4302 
1 1 1 18  12 3  o 419.1602 43.30021 36.71415       6.946951      36.60679       7.758267      37.14840       15.60373  414.4364 49.16218 361.6557 104.9391 52.78070       115.8841 
1 1 1 18  12 4  o 378.6820 66.02261 32.67611       9.356441      37.50476       11.68604      24.05290       15.61668  394.0596 79.11089 289.3676 106.1360 104.6920       132.3759 
1 1 1 18  12 5  o 265.3323 79.77252 17.41220       8.886432      15.05552       11.66204      20.67520       13.72249  245.3297 91.39957 274.9680 99.69759 -29.63829      135.2534 
1 1 1 18  12 6  o 323.7279 69.05611 24.42351       8.417038      24.51037       11.48663      24.32278       12.36929  305.6449 90.42564 300.2870 94.82281 5.357880       131.0273 
1 1 1 18  12 7  o 200.2900 66.21813 9.081889       5.990638      14.28540       7.005123      -5.082402      11.55753  245.4021 70.04657 160.6296 75.01211 84.77252       102.6320 
1 1 1 18  12 8  o 315.0157 58.63260 22.20787       6.909007      31.04131       11.33084      16.97985       8.716980  350.4974 84.27892 261.1378 79.12027 89.35959       115.5982 
1 1 1 18  12 9  o 165.1035 63.28091 5.127895       5.681546      16.79743       8.879368      -2.962013      7.393110  258.1819 80.15764 134.3181 61.76239 123.8638       101.1921 
1 1 1 18  12 10 o 173.8416 65.94603 6.056285       6.130492      16.54917       13.29881      3.224820       6.908295  248.1114 96.35126 159.2737 66.64188 88.83768       117.1525 
1 1 1 18  12 11 o 196.7604 66.87731 8.934847       6.106367      12.97193       14.34084      8.040792       6.748738  230.6548 96.22055 190.3140 69.77673 40.34079       118.8578 
1 1 1 18  12 12 o 163.4435 64.21175 4.917804       5.961073      -0.2723298     14.07381      6.052484       6.580503  183.8044 84.77173 174.5035 67.77386 9.300980       108.5336 
1 1 1 18  12 13 o 122.8167 55.08547 -0.9183350     5.445273      4.472476       13.09253      -2.045868      5.987717  193.5247 86.20445 123.0994 56.22205 70.42538       102.9181 
1 1 1 18  13 0  o 247.1973 71.07970 14.91850       7.188100      21.99268       8.231189      -7.807298      14.75312  301.1627 71.45387 169.8190 80.92317 131.3437       107.9547 
1 1 1 18  13 1  o 161.9978 66.69904 3.855924       6.765623      -0.7261207     7.602767      21.29270       14.83116  144.6609 64.97194 269.4611 102.4874 -124.8002      121.3467 
1 1 1 18  13 2  o 120.5837 56.51598 -4.651326      6.661319      -4.726068      7.598739      -4.403224      13.84440  129.5040 60.58993 174.1665 81.58045 -44.66246      101.6194 
1 1 1 18  13 3  o 192.0892 76.52416 7.296299       8.576452      2.097636       11.04818      15.17954       13.60496  179.3094 79.56744 242.4751 96.44923 -63.16568      125.0337 
1 1 1 18  13 4  o 406.6210 57.84855 36.74472       8.877469      37.53975       11.63049      35.63497       13.74109  390.4600 79.40381 360.2472 96.34563 30.21277       124.8497 
1 1 1 18  13 5  o 217.6856 75.37988 11.30267       7.767759      10.30851       9.551746      13.24411       13.34796  212.7247 81.92244 233.5558 94.61843 -20.83115      125.1556 
1 1 1 18  13 6  o 95.52824 46.23594 -7.328109      5.263206      -9.796049      5.865508      2.871336       11.92413  95.79485 46.90281 186.4325 82.69810 -90.63770      95.07285 
1 1 1 18  13 7  o 257.9961 56.56920 15.01991       5.511732      18.69782       6.531593      5.923075       10.27220  285.8133 60.71849 191.0254 80.66709 94.78789       100.9649 
1 1 1 18  13 8  o 274.0675 44.79652 16.10085       4.603172      24.17529       5.899446      3.533830       7.359890  335.7841 46.48703 163.5600 68.63215 172.2241       82.89400 
1 1 1 18  13 9  o 226.1472 65.97169 12.19976       6.152214      16.89971       15.35448      11.30091       6.714787  246.3901 100.8500 216.5556 70.02280 29.83455       122.7759 
1 1 1 18  13 10 o 610.3092 31.57182 75.69817       7.457420      103.6400       16.19690      68.18131       8.400836  672.7588 62.71614 573.5157 37.93226 99.24310       73.29510 
1 1 1 18  13 11 o 199.2003 64.54226 9.350548       5.702623      18.70476       14.73528      7.702747       6.184536  251.1297 100.2232 185.0118 66.95330 66.11794       120.5298 
1 1 1 18  13 12 o 143.3093 60.01847 2.448581       5.610755      -2.441149      14.24570      3.346354       6.104141  176.9435 82.84081 152.6434 63.15005 24.30017       104.1659 
1 1 1 18  13 13 o 191.7012 63.45692 8.583048       5.500826      26.71868       13.45965      4.946493       6.027158  295.4360 99.29523 162.9313 64.38915 132.5047       118.3449 
1 1 1 18  14 0  o 349.1001 57.22229 27.65787       7.489014      34.78745       8.632536      5.967779       15.05696  390.7299 58.70464 202.9749 91.27504 187.7550       108.5236 
1 1 1 18  14 1  o 177.2627 66.98077 6.662981       6.308755      11.40716       7.101042      -11.10933      13.74401  215.6213 72.12448 155.7249 75.21252 59.89635       104.2059 
1 1 1 18  14 2  o 134.0065 61.83618 -2.902866      7.502705      -1.279081      9.171834      -6.186998      13.04374  153.0559 69.77920 162.9156 77.18771 -9.859665      104.0532 
1 1 1 18  14 3  o 171.8113 71.24298 4.740585       7.794550      8.740985       9.263745      -4.957153      14.42348  199.9620 79.57197 173.3593 81.84354 26.60265       114.1493 
1 1 1 18  14 4  o 225.9948 90.09076 12.84267       11.89417      0.000000       0.000000      12.84267       11.89417  ?        ?        225.9948 90.09076 0.000000       90.09076 
1 1 1 18  14 5  o 160.7616 62.21487 4.875539       5.529987      7.541802       6.311121      -3.939695      11.47551  184.6778 67.51190 159.8345 74.67594 24.84331       100.6695 
1 1 1 18  14 6  o 84.65912 41.80914 -9.825408      4.998366      -9.596972      5.689592      -10.59792      10.46289  93.73097 45.95537 135.8995 65.63390 -42.16856      80.12305 
1 1 1 18  14 7  o 411.2098 34.00399 34.74442       5.381546      40.36794       6.319217      19.90020       10.26687  441.0626 37.24045 269.9107 86.51295 171.1519       94.18780 
1 1 1 18  14 8  o 350.1427 37.34236 25.56581       4.999454      30.35833       5.911344      13.52627       9.369347  379.4236 40.75621 227.9454 82.42123 151.4782       91.94743 
1 1 1 18  14 9  o 178.5970 63.38949 7.162344       5.515341      25.34548       13.67345      3.629075       6.027427  285.6767 99.94899 153.7418 63.08706 131.9349       118.1938 
1 1 1 18  14 10 o 231.2109 61.59437 12.71502       5.630035      18.01402       13.27225      11.55228       6.217115  246.5877 96.11683 217.4342 67.00178 29.15350       117.1652 
1 1 1 18  14 11 o 212.7892 72.30988 11.29568       7.138707      20.99689       13.61901      7.620403       8.382578  260.1986 98.39018 188.3194 75.44028 71.87924       123.9833 
1 1 1 18  14 12 o 304.4749 61.90526 21.81473       7.070561      18.32180       14.28205      22.94875       8.137789  245.8335 98.47450 304.8167 70.19442 -58.98315      120.9317 
1 1 1 18  15 0  o 257.2904 64.43220 16.13763       6.423882      16.32937       7.244920      15.43258       13.89263  253.2462 70.87162 229.8908 95.20187 23.35536       118.6852 
1 1 1 18  15 1  o 243.5551 65.51922 14.53576       6.332659      12.71802       7.178737      20.91239       13.44556  223.2948 72.42229 257.8630 97.70046 -34.56819      121.6157 
1 1 1 18  15 2  o 201.6612 73.61615 9.951068       7.500178      11.33656       9.098230      7.012809       13.24951  211.3429 80.29802 198.6784 87.69771 12.66451       118.9061 
1 1 1 18  15 3  o 193.4350 73.02669 8.757253       7.494834      2.609590       9.486867      18.96563       12.22492  167.9341 74.16330 252.6088 93.68431 -84.67473      119.4862 
1 1 1 18  15 4  o 370.3904 41.02689 29.09719       5.802294      29.39053       6.600836      28.10010       12.16982  367.3054 47.37925 309.6457 93.41195 57.65973       104.7406 
1 1 1 18  15 5  o 154.8427 61.03276 4.400339       5.402009      2.111307       6.195423      11.65973       11.03304  144.9943 61.98791 214.6917 86.35658 -69.69748      106.3013 
1 1 1 18  15 6  o 516.2333 27.95410 53.90143       5.583393      57.12392       6.614911      45.91758       10.41200  527.8832 32.42389 443.5853 62.14646 84.29794       70.09630 
1 1 1 18  15 7  o 142.5484 56.61857 3.434188       4.682007      1.471289       5.381575      9.546129       9.496202  134.3443 57.61277 200.8306 80.35072 -66.48625      98.87097 
1 1 1 18  15 8  o 147.2941 58.86520 3.717354       5.090411      3.717354       5.090411      0.000000       0.000000  147.2941 58.86520 ?        ?        0.000000       58.86520 
1 1 1 18  15 9  o 338.0439 60.14805 26.70604       7.606881      17.35858       13.18439      31.37033       9.313352  239.8793 95.09492 356.9737 69.68106 -117.0944      117.8919 
1 1 1 18  15 10 o 264.9754 72.42802 17.98795       7.666157      30.61964       14.88749      13.42986       8.942978  301.5228 104.3593 223.8447 80.58263 77.67807       131.8500 
1 1 1 18  16 0  o 226.1690 65.53668 12.95113       6.089578      12.45356       6.790378      14.99530       13.76344  218.0833 70.40531 221.1609 93.38265 -3.077637      116.9497 
1 1 1 18  16 1  o 676.1919 35.05332 95.27332       9.173483      97.55726       11.55673      91.38304       15.08283  670.3240 44.64924 616.0388 63.97755 54.28516       78.01718 
1 1 1 18  16 2  o 334.1033 62.82080 26.87723       7.851818      25.19119       9.802157      29.89618       13.11643  301.2382 81.71619 303.7300 97.82990 -2.491821      127.4685 
1 1 1 18  16 3  o 333.1228 61.74871 26.50585       7.694245      37.24932       9.578177      6.959857       12.91932  392.0048 65.20699 193.0917 85.84533 198.9132       107.8025 
1 1 1 18  16 4  o 138.2422 59.01398 2.018898       5.600256      -0.2500875E-01 6.331669      9.364096       12.00299  133.1648 59.58626 200.4392 86.00169 -67.27438      104.6270 
1 1 1 18  16 5  o 90.79153 44.30436 -7.706901      5.106305      -7.176792      5.747988      -9.691431      11.12146  99.87753 48.33553 138.7611 67.17274 -38.88354      82.75567 
1 1 1 18  16 6  o 315.4030 44.49697 21.70796       5.298927      20.55807       6.037432      25.56459       11.05673  299.4761 53.89309 293.7883 89.12965 5.687836       104.1564 
1 1 1 18  16 7  o 487.7018 32.59739 49.09529       6.138421      49.09529       6.138421      0.000000       0.000000  487.7018 32.59739 ?        ?        0.000000       32.59739 
1 1 1 18  16 8  o 141.9239 59.64627 2.641338       5.572920      7.138001       6.116526      -19.33617      13.52225  176.5101 66.10726 136.2246 67.54369 40.28549       94.51095 
1 1 1 18  16 9  o 191.4283 72.26315 8.919124       7.338545      -15.79257      13.17070      20.04525       8.837501  139.8182 68.82242 270.7482 79.09383 -130.9300      104.8445 
1 1 1 18  17 0  o 144.1477 60.93445 3.191308       5.871099      -0.2738548     6.508883      18.31885       13.59969  130.5285 59.22749 226.7528 94.07135 -96.22432      111.1635 
1 1 1 18  17 1  o 340.0736 60.11949 28.07219       7.649485      31.83337       9.377607      20.59266       13.22412  348.1061 71.75237 240.2257 95.23625 107.8803       119.2407 
1 1 1 18  17 2  f 112.9713 54.48706 -7.067712      7.152533      -11.18309      8.807482      0.9032634      12.25752  116.8679 57.27436 166.9773 77.73251 -50.10941      96.55411 
1 1 1 18  17 3  o 356.4159 43.28178 27.82927       5.867949      34.67433       6.680590      4.716198       12.27595  397.4285 44.02356 179.0659 81.28502 218.3626       92.44094 
1 1 1 18  17 4  o 169.3565 62.19243 6.699465       5.364439      11.64245       6.062962      -11.12064      11.51185  212.5993 66.27428 135.9700 66.38834 76.62929       93.80668 
1 1 1 18  17 5  o 150.2962 59.23861 4.458615       5.088907      6.466827       5.772926      -2.541218      10.77792  168.4084 63.96786 151.8708 71.40586 16.53760       95.86805 
1 1 1 18  17 6  o 170.7665 64.09631 6.740201       5.756206      6.740201       5.756206      0.000000       0.000000  170.7665 64.09631 ?        ?        0.000000       64.09631 
1 1 1 18  17 7  o 226.6929 61.24553 12.67466       5.519423      12.67466       5.519423      0.000000       0.000000  226.6929 61.24553 ?        ?        0.000000       61.24553 
1 1 1 18  17 8  o 140.1901 58.41837 2.834316       5.277950      -1.481524      5.728549      27.07564       13.57657  120.1288 54.91452 279.7638 99.43796 -159.6349      113.5936 
1 1 1 18  18 0  o 140.2582 59.52271 3.146938       5.637367      2.259933       6.272946      6.870736       12.85291  138.9095 60.85940 178.7590 81.91523 -39.84941      102.0489 
1 1 1 18  18 1  o 102.0658 50.50056 -11.97157      7.414474      -15.99129      9.451323      -5.538908      11.95612  110.8234 55.19979 145.5546 70.26412 -34.73125      89.35359 
1 1 1 18  18 2  o 246.0797 73.37605 17.13552       7.541408      3.939671       9.295700      42.54365       12.89882  162.1831 72.41123 366.8537 90.98205 -204.6706      116.2803 
1 1 1 18  18 3  o 101.6510 48.48875 -4.621370      5.325253      -0.4397514     6.073533      -18.52417      11.07440  125.7763 57.12551 118.6248 59.19157 7.151428       82.26157 
1 1 1 18  18 4  o 133.2449 56.89017 2.168648       5.205987      -1.220025      5.886789      14.32981       11.15196  121.0142 55.44794 212.7792 86.38618 -91.76495      102.6501 
1 1 1 18  18 5  o 109.8547 50.86722 -2.164772      5.142261      -0.1671357E-01 5.796447      -10.10233      11.14249  126.1174 56.68043 134.2836 65.50962 -8.166183      86.62668 
1 1 1 18  18 6  o 289.2580 56.03088 19.90306       6.066842      19.90306       6.066842      0.000000       0.000000  289.2580 56.03088 ?        ?        0.000000       56.03088 
1 1 1 18  19 0  o 82.14844 40.93412 -10.66356      5.219845      -11.41805      5.813354      -7.524213      11.85823  86.86826 43.27192 137.3542 67.13172 -50.48597      79.86943 
1 1 1 18  19 1  o 132.5381 60.94107 -0.1468994     7.196645      -4.425175      8.925536      7.802559       12.16658  129.7182 62.12103 177.7545 80.77919 -48.03635      101.9034 
1 1 1 18  19 2  o 104.0711 49.36861 -3.779388      5.368227      -0.8300835     6.133412      -13.43667      11.09864  122.8302 56.39678 124.7242 61.72487 -1.893982      83.60954 
1 1 1 18  19 3  o 114.9657 52.58504 -1.008797      5.262963      0.4693618      5.998229      -5.953641      10.97081  128.2152 57.63756 139.1738 67.21353 -10.95856      88.54234 
1 1 1 19  0  0  o 449.2404 105.9268 48.13164       16.05118      48.13164       16.05118      48.13164       16.05118  449.2404 105.9268 449.2404 105.9268 0.000000       0.000000 
1 1 1 19  0  1  o 154.6038 89.15780 6.631535       8.624655      6.631535       8.624655      6.631535       8.624655  154.6038 89.15780 154.6038 89.15780 0.000000       0.000000 
1 1 1 19  0  2  o 430.5701 56.08871 38.79447       8.938847      38.79447       8.938847      38.79447       8.938847  430.5701 56.08871 430.5701 56.08871 0.000000       0.000000 
1 1 1 19  0  3  o 641.0153 38.69102 81.86513       9.551414      81.86513       9.551414      81.86513       9.551414  641.0153 38.69102 641.0153 38.69102 0.000000       0.000000 
1 1 1 19  0  4  o 691.6939 42.55092 95.75924       11.33102      95.75924       11.33102      95.75924       11.33102  691.6939 42.55092 691.6939 42.55092 0.000000       0.000000 
1 1 1 19  0  5  x ?        ?        ?              ?             ?              ?             ?              ?         ?        ?        ?        ?        ?              ?        
1 1 1 19  0  6  o 74.79633 54.60686 -21.50359      9.582424      -21.50359      9.582424      -21.50359      9.582424  74.79633 54.60686 74.79633 54.60686 0.000000       0.000000 
1 1 1 19  0  7  o 126.2038 81.45061 1.293572       9.289033      1.293572       9.289033      1.293572       9.289033  126.2038 81.45061 126.2038 81.45061 0.000000       0.000000 
1 1 1 19  0  8  o 170.8147 95.08080 9.347556       9.351871      9.347556       9.351871      9.347556       9.351871  170.8147 95.08080 170.8147 95.08080 0.000000       0.000000 
1 1 1 19  0  9  o 188.8471 95.88626 11.77390       8.793169      11.77390       8.793169      11.77390       8.793169  188.8471 95.88626 188.8471 95.88626 0.000000       0.000000 
1 1 1 19  0  10 o 130.4596 81.43425 3.541005       8.425145      3.541005       8.425145      3.541005       8.425145  130.4596 81.43425 130.4596 81.43425 0.000000       0.000000 
1 1 1 19  0  11 o 249.4996 90.80607 17.78285       8.096229      17.78285       8.096229      17.78285       8.096229  249.4996 90.80607 249.4996 90.80607 0.000000       0.000000 
1 1 1 19  0  12 o 129.1386 79.54766 4.188488       7.778861      4.188488       7.778861      4.188488       7.778861  129.1386 79.54766 129.1386 79.54766 0.000000       0.000000 
1 1 1 19  0  13 o 91.87855 62.90580 -3.060776      7.130989      -3.060776      7.130989      -3.060776      7.130989  91.87855 62.90580 91.87855 62.90580 0.000000       0.000000 
1 1 1 19  0  14 o 122.1214 75.90900 3.784038       7.243690      3.784038       7.243690      3.784038       7.243690  122.1214 75.90900 122.1214 75.90900 0.000000       0.000000 
1 1 1 19  0  15 o 83.14528 58.49538 -6.171569      7.365940      -6.171569      7.365940      -6.171569      7.365940  83.14528 58.49538 83.14528 58.49538 0.000000       0.000000 
1 1 1 19  0  16 o 81.57873 58.22172 -9.283808      8.254092      -9.283808      8.254092      -9.283808      8.254092  81.57873 58.22172 81.57873 58.22172 0.000000       0.000000 
1 1 1 19  1  0  o 269.2209 61.25169 16.19272       6.259791      13.90781       8.673127      18.67715       9.043870  242.7395 79.64845 278.7166 79.60130 -35.97710      112.6066 
1 1 1 19  1  1  o 283.3896 67.28327 18.28185       7.294346      13.39550       8.423272      32.93412       14.58616  239.5390 78.48769 352.8393 101.1942 -113.3003      128.0648 
1 1 1 19  1  2  o 114.5209 53.67498 -4.889073      6.008694      -8.701415      8.206285      -0.4829282     8.822265  125.6111 59.99405 159.6207 70.95319 -34.00954      92.91739 
1 1 1 19  1  3  o 292.8539 55.45428 18.60253       6.075950      20.47196       8.218409      16.34901       9.023258  297.8351 71.87596 261.9165 80.72018 35.91858       108.0828 
1 1 1 19  1  4  o 285.3038 65.68858 18.36177       7.127701      18.36177       7.127701      0.000000       0.000000  285.3038 65.68858 ?        ?        0.000000       65.68858 
1 1 1 19  1  5  o 210.5935 71.77433 9.770876       7.033557      20.34577       9.667734      -2.120470      10.25185  290.3954 82.08095 164.2425 74.44910 126.1529       110.8149 
1 1 1 19  1  6  o 220.6309 82.53574 10.48557       9.528930      0.000000       0.000000      10.48557       9.528930  ?        ?        220.6309 82.53574 0.000000       82.53574 
1 1 1 19  1  7  o 226.8178 81.62236 11.61720       9.174434      0.000000       0.000000      11.61720       9.174434  ?        ?        226.8178 81.62236 0.000000       81.62236 
1 1 1 19  1  8  o 358.7729 49.11126 27.24098       6.663073      23.51849       9.361406      31.06309       9.485842  314.7386 77.17900 370.1310 68.51558 -55.39233      103.2036 
1 1 1 19  1  9  o 139.8565 60.58592 0.5617068      6.069510      5.099173       8.660409      -3.818250      8.508766  184.0980 75.59138 143.1954 65.99763 40.90265       100.3481 
1 1 1 19  1  10 o 164.8229 64.26154 4.651742       5.933747      -4.172176      8.511670      12.99468       8.276443  141.6298 65.53221 234.3514 77.84972 -92.72160      101.7598 
1 1 1 19  1  11 o 263.3377 57.28821 15.44326       5.692105      20.36275       8.236857      10.94648       7.875032  292.9404 72.73670 217.7853 75.87110 75.15508       105.1050 
1 1 1 19  1  12 o 259.2954 57.28674 15.05969       5.614904      16.69141       8.359922      13.71865       7.578771  260.8728 77.13258 238.8715 74.03712 22.00131       106.9155 
1 1 1 19  1  13 o 202.1207 74.03906 9.189114       7.595983      9.189114       7.595983      0.000000       0.000000  202.1207 74.03906 ?        ?        0.000000       74.03906 
1 1 1 19  1  14 o 154.5720 60.39874 4.178367       5.250763      1.835635       7.432621      6.512395       7.418800  155.2593 67.15172 182.1593 71.61182 -26.90001      98.17131 
1 1 1 19  1  15 o 253.4984 52.68301 14.32449       5.017182      18.49518       7.693513      11.23834       6.618050  275.1748 71.38374 216.3950 69.46918 58.77982       99.60725 
1 1 1 19  1  16 o 142.2450 58.39314 2.689312       5.166481      -3.686909      8.590966      6.301911       6.466516  140.6911 65.35560 175.9499 67.49374 -35.25885      93.95083 
1 1 1 19  2  0  o 359.0012 46.87442 27.08769       6.379214      12.05273       8.774280      43.94570       9.291024  228.8598 80.06574 453.3742 53.82016 -224.5145      96.47348 
1 1 1 19  2  1  o 484.3657 34.79969 47.44713       6.502381      43.28133       8.701652      52.71466       9.784879  452.8665 50.32828 499.5500 51.15857 -46.68359      71.76443 
1 1 1 19  2  2  o 548.8766 34.72188 60.82531       7.363122      60.48600       9.066474      61.48263       12.61929  541.5438 43.47639 530.1684 62.49099 11.37543       76.12701 
1 1 1 19  2  3  o 131.7109 59.26199 -1.726736      6.357726      2.123472       7.095229      -17.41252      14.32114  158.2586 66.94768 154.8540 75.25735 3.404633       100.7257 
1 1 1 19  2  4  o 151.1207 62.67263 2.395601       6.033285      -1.271447      6.861467      14.89489       12.66781  138.9261 62.10632 251.3927 94.93245 -112.4666      113.4432 
1 1 1 19  2  5  o 247.7730 69.34180 14.10081       6.935424      8.651946       9.492908      20.33880       10.15709  209.3572 81.37608 288.2605 84.96057 -78.90334      117.6451 
1 1 1 19  2  6  o 231.0568 70.94933 12.24457       6.978278      23.56028       9.661175      -0.9884798E-01 10.09036  314.2433 79.19468 170.2090 75.75880 144.0343       109.5956 
1 1 1 19  2  7  o 411.8647 43.78503 35.20034       6.895990      35.28264       10.06183      35.12744       9.469872  395.6602 67.92954 398.2683 63.34823 -2.608093      92.88391 
1 1 1 19  2  8  o 121.1240 59.03296 -13.26502      8.986640      0.000000       0.000000      -13.26502      8.986640  ?        ?        121.1240 59.03296 0.000000       59.03296 
1 1 1 19  2  9  o 109.6977 52.18932 -6.341636      6.084728      -17.23977      8.515141      5.029550       8.697983  108.3937 53.71828 183.7240 75.63342 -75.33035      92.76890 
1 1 1 19  2  10 o 177.4756 64.69552 6.373060       5.789659      1.112561       8.159077      11.70833       8.216856  159.8835 69.74464 224.4017 77.53840 -64.51813      104.2905 
1 1 1 19  2  11 o 139.6331 64.29833 -3.414342      8.051770      -3.414342      8.051770      0.000000       0.000000  139.6331 64.29833 ?        ?        0.000000       64.29833 
1 1 1 19  2  12 o 139.7092 59.13925 1.594795       5.542427      7.210778       8.182207      -3.166852      7.534182  191.4875 75.22935 135.3217 62.27012 56.16574       97.65769 
1 1 1 19  2  13 o 347.8401 42.82477 25.47347       5.662812      26.52562       8.313899      24.56290       7.734325  338.5938 65.59554 327.4851 63.10235 11.10864       91.02022 
1 1 1 19  2  14 o 118.9207 53.81852 -1.572907      5.332522      0.8256633      7.521261      -3.997243      7.561551  150.8311 66.34737 131.3749 61.12337 19.45616       90.21108 
1 1 1 19  2  15 o 297.2187 58.29909 20.07646       6.488822      6.644742       11.64437      26.12588       7.814610  197.8172 84.78728 337.0107 61.99280 -139.1934      105.0333 
1 1 1 19  2  16 o 397.9068 42.18967 33.39980       6.420063      27.01274       11.83340      36.06401       7.642646  311.8072 91.64803 407.9825 49.23134 -96.17532      104.0341 
1 1 1 19  3  0  o 240.0675 70.88328 13.39565       7.064447      8.879504       8.805102      21.55484       11.83515  207.1515 78.92496 289.3527 92.90059 -82.20120      121.9002 
1 1 1 19  3  1  o 274.2508 63.78434 16.97586       6.665148      19.70488       8.175301      11.56634       11.51011  290.4437 72.66050 230.3751 89.58916 60.06863       115.3506 
1 1 1 19  3  2  o 170.2365 64.38607 5.327262       5.832897      2.028508       8.042258      8.988381       8.472470  164.6581 70.51592 207.5867 77.79264 -42.92865      104.9961 
1 1 1 19  3  3  o 333.6234 52.45216 23.83101       6.571632      30.98932       7.378927      -3.618415      14.44955  382.1134 50.99764 185.9792 85.81715 196.1341       99.82657 
1 1 1 19  3  4  o 727.3937 26.55243 104.9456       7.500700      111.7628       8.571744      82.66531       15.49624  748.8214 29.47562 610.5781 66.42332 138.2433       72.66959 
1 1 1 19  3  5  o 145.5981 60.18844 2.246152       5.538801      0.6610310      6.770900      5.452428       9.629763  147.3488 63.91119 191.9741 79.36107 -44.62531      101.8961 
1 1 1 19  3  6  o 224.2365 70.31702 11.48676       6.813869      5.957312       9.504803      17.33306       9.773339  193.7361 79.32813 266.4162 84.30433 -72.68010      115.7591 
1 1 1 19  3  7  o 160.1127 65.61029 3.301381       6.507953      1.358053       9.279486      5.182445       9.129616  169.9950 74.26127 187.3984 77.35514 -17.40332      107.2313 
1 1 1 19  3  8  o 132.5515 59.21458 -1.141747      6.225583      -6.000914      8.727778      3.891657       8.882877  137.8480 64.63412 179.0024 75.27059 -41.15439      99.21307 
1 1 1 19  3  9  o 202.2643 68.32573 9.087384       6.373345      5.689374       8.986762      12.52579       9.040016  188.4939 77.15357 231.0251 81.24406 -42.53122      112.0414 
1 1 1 19  3  10 o 340.7735 69.15445 26.82177       8.839201      0.000000       0.000000      26.82177       8.839201  ?        ?        340.7735 69.15445 0.000000       69.15445 
1 1 1 19  3  11 o 210.7741 65.31368 10.17954       5.898422      0.8355959E-01  8.596413      19.16140       8.108232  157.6590 70.06213 282.8875 73.23273 -125.2285      101.3496 
1 1 1 19  3  12 o 170.0011 67.87655 4.936535       6.761483      3.059490       13.63956      5.548096       7.785431  196.2420 87.65858 179.2500 72.38647 16.99203       113.6830 
1 1 1 19  3  13 o 278.8047 60.97376 17.81026       6.418074      25.94734       12.42566      14.84945       7.495329  305.4734 94.82016 246.5543 73.06836 58.91902       119.7073 
1 1 1 19  3  14 o 192.1836 67.67171 8.374334       6.273671      -3.273033      11.89912      12.85861       7.383244  165.2410 76.81189 228.9847 73.36121 -63.74376      106.2164 
1 1 1 19  3  15 o 380.5129 44.43434 30.81591       6.442568      50.63114       12.56741      23.75206       7.503548  458.3621 73.05299 320.2628 62.57364 138.0992       96.18835 
1 1 1 19  4  0  o 205.6425 67.30755 9.487150       6.195112      7.880855       8.519444      11.28966       9.024801  199.2697 77.19234 222.6629 80.83317 -23.39325      111.7706 
1 1 1 19  4  1  o 300.1429 56.69879 19.75291       6.366703      17.62597       8.502123      22.46825       9.606427  271.2045 77.08495 304.4110 80.15498 -33.20651      111.2066 
1 1 1 19  4  2  o 316.9667 47.29533 21.23879       5.643672      24.19864       7.226419      16.61073       9.036249  332.2745 58.11784 262.0176 80.78274 70.25690       99.51650 
1 1 1 19  4  3  o 427.2383 40.05999 37.50109       6.569133      34.91261       7.355578      47.70121       14.60151  407.7818 47.32743 440.7682 88.37839 -32.98636      100.2528 
1 1 1 19  4  4  o 183.9341 66.82159 6.870177       6.168860      10.11189       6.878033      -6.462734      13.94889  212.2959 70.98306 175.0655 81.96528 37.23045       108.4292 
1 1 1 19  4  5  o 186.5577 66.47481 7.237476       6.070975      5.825305       6.901607      12.06772       12.76413  179.4077 69.48325 235.3398 93.48109 -55.93213      116.4759 
1 1 1 19  4  6  o 164.0090 66.79046 3.730910       6.691768      8.160757       9.439749      -0.7439722     9.487611  204.9784 80.71631 162.6380 72.84538 42.34033       108.7271 
1 1 1 19  4  7  o 215.4007 70.34512 10.54617       6.768289      -9.497065      9.241609      33.73383       9.940130  132.3246 63.32760 384.7326 69.06623 -252.4080      93.70448 
1 1 1 19  4  8  f 160.5319 68.39570 2.199718       7.495855      -10.45582      14.57677      6.749390       8.739989  168.4906 80.33096 193.2443 77.16658 -24.75375      111.3901 
1 1 1 19  4  9  o 334.7711 62.57480 25.15744       7.836215      24.66288       14.98193      25.34370       9.194140  296.6151 104.5614 327.3916 74.04683 -30.77652      128.1250 
1 1 1 19  4  10 o 373.2544 54.10153 30.24943       7.613678      35.40722       14.42919      28.25928       8.962995  360.3085 99.72944 349.9878 68.39565 10.32074       120.9294 
1 1 1 19  4  11 o 325.9659 71.76756 25.15951       8.839143      0.000000       0.000000      25.15951       8.839143  ?        ?        325.9659 71.76756 0.000000       71.76756 
1 1 1 19  4  12 o 103.1544 50.39595 -10.47580      6.662265      -7.925179      12.79508      -11.42454      7.803566  160.1463 76.04140 112.5875 54.90271 47.55878       93.79020 
1 1 1 19  4  13 o 184.6539 82.22954 2.634386       11.90382      2.634386       11.90382      0.000000       0.000000  184.6539 82.22954 ?        ?        0.000000       82.22954 
1 1 1 19  4  14 o 263.7833 59.82822 16.03259       5.987940      -4.699624      12.35266      22.40066       6.846073  163.5434 76.74968 314.4226 58.20983 -150.8792      96.32703 
1 1 1 19  4  15 o 186.0759 65.29103 7.822312       5.836843      -6.567694      12.24932      12.04943       6.639018  157.6274 74.71636 222.7771 69.33560 -65.14969      101.9312 
1 1 1 19  5  0  o 411.3446 47.00939 35.69255       7.374763      40.60933       11.67729      32.43036       9.511685  415.5691 75.12031 376.9102 67.45866 38.65884       100.9640 
1 1 1 19  5  1  o 332.7632 58.15089 24.39666       7.241285      22.14688       11.51339      25.86905       9.314148  292.4005 91.35706 330.9964 74.28320 -38.59595      117.7459 
1 1 1 19  5  2  o 355.6218 59.55315 27.89936       7.933907      27.28690       9.116055      29.81212       16.11003  343.4871 70.69587 322.5997 108.6314 20.88742       129.6098 
1 1 1 19  5  3  o 159.7838 67.92872 2.216806       7.364590      -9.259042      8.534578      35.67679       14.57312  126.4409 60.60266 365.4135 99.85185 -238.9726      116.8036 
1 1 1 19  5  4  o 138.7110 62.95388 -2.229953      7.358743      0.2716004      8.702200      -8.507966      13.78591  160.6590 70.98621 168.3630 79.64671 -7.704041      106.6895 
1 1 1 19  5  5  o 149.6809 65.14927 0.7156941      7.084712      -4.915695      8.258779      16.40642       13.78572  136.9858 63.78236 256.6385 98.52293 -119.6527      117.3668 
1 1 1 19  5  6  o 143.4434 65.94097 -3.452421      8.419735      -27.75421      15.64939      6.448083       9.988652  145.7161 72.31976 197.2114 81.10252 -51.49533      108.6635 
1 1 1 19  5  7  o 272.3446 74.34100 17.66996       8.082914      5.892665       14.93300      22.55039       9.612868  214.7323 93.99401 303.9089 80.25823 -89.17662      123.5972 
1 1 1 19  5  8  o 290.3684 71.97220 19.89439       8.075211      24.48674       14.73646      17.92365       9.653629  295.9099 103.7484 268.1082 83.63530 27.80167       133.2614 
1 1 1 19  5  9  o 327.6374 65.02618 24.46850       7.981924      42.88306       15.32370      17.61180       9.350617  399.6677 99.19353 265.8626 82.21033 133.8051       128.8328 
1 1 1 19  5  10 o 154.1664 66.85192 1.349414       7.404714      1.191084       13.92037      1.411892       8.744492  192.5284 87.05817 164.2120 71.90242 28.31639       112.9118 
1 1 1 19  5  11 o 130.1421 58.30229 -1.033934      6.080754      -4.746841      8.449431      2.954956       8.757830  137.5559 64.20360 170.6114 73.33973 -33.05544      97.47215 
1 1 1 19  5  12 o 202.7653 65.56435 9.521543       5.886918      3.484908       8.497928      15.09157       8.162894  170.6707 72.77235 246.0739 76.93088 -75.40326      105.8970 
1 1 1 19  5  13 o 252.6002 68.33171 15.36532       6.865361      0.000000       0.000000      15.36532       6.865361  ?        ?        252.6002 68.33171 0.000000       68.33171 
1 1 1 19  5  14 o 326.5872 47.95184 23.12226       5.900692      1.622130       12.33498      29.50232       6.719396  181.4055 81.99679 369.4489 47.96424 -188.0434      94.99495 
1 1 1 19  5  15 o 370.4226 42.86451 29.11220       6.052363      10.01399       12.63499      34.79936       6.894874  213.1486 89.70748 403.8575 44.71144 -190.7089      100.2325 
1 1 1 19  6  0  o 169.6609 68.68665 4.537971       7.028964      13.13646       11.09436      -1.227895      9.084966  233.8644 88.71432 155.9684 70.44640 77.89600       113.2825 
1 1 1 19  6  1  o 312.6248 60.40185 21.89372       7.067915      28.53552       11.72539      18.10305       8.858124  333.1443 88.95561 271.3115 79.16537 61.83282       119.0809 
1 1 1 19  6  2  o 140.1358 63.75269 -2.290155      7.604388      -1.010237      8.684930      -6.495157      15.74194  154.3569 69.37531 182.7649 86.04488 -28.40797      110.5290 
1 1 1 19  6  3  o 354.2460 59.35925 27.76198       7.877318      27.71872       9.167019      27.88411       15.40182  345.4232 70.71653 312.5779 106.2121 32.84537       127.6003 
1 1 1 19  6  4  o 199.7430 73.11174 8.569143       7.404858      15.06677       8.765283      -7.626561      13.83849  248.9644 79.95094 169.8781 80.18983 79.08632       113.2367 
1 1 1 19  6  5  o 110.4792 53.28899 -8.760465      6.844398      -8.750694      8.023431      -8.786577      13.11622  122.5926 58.75864 162.5750 77.13501 -39.98242      96.96590 
1 1 1 19  6  6  o 153.7590 64.05074 2.644484       6.341667      3.319893       8.151069      1.608655       10.09428  170.4184 71.90541 174.8588 76.89095 -4.440430      105.2740 
1 1 1 19  6  7  o 121.2361 56.50187 -4.315673      6.505156      -1.380981      8.860144      -7.747679      9.581502  154.1193 69.59409 139.1421 65.99097 14.97717       95.90696 
1 1 1 19  6  8  o 219.4966 68.15760 11.17814       6.419508      2.602980       8.599759      21.96986       9.647404  169.1414 72.69042 297.2128 81.25415 -128.0714      109.0236 
1 1 1 19  6  9  o 284.9568 59.37752 18.27326       6.357791      16.50151       8.612480      20.39503       9.424891  258.4064 78.72328 285.3305 81.18139 -26.92410      113.0830 
1 1 1 19  6  10 o 291.1685 56.74126 18.91549       6.185494      5.296165       8.688691      32.91059       8.807742  182.0872 75.33765 382.2712 61.40765 -200.1841      97.19393 
1 1 1 19  6  11 o 274.9995 58.25793 17.11687       6.028299      18.53128       8.494869      15.68201       8.556064  272.6947 76.89329 249.7882 78.86236 22.90651       110.1447 
1 1 1 19  6  12 o 182.4489 64.79720 7.330083       5.763886      17.13065       8.106980      -2.688089      8.196489  261.7535 75.55058 141.4259 65.03104 120.3276       99.68413 
1 1 1 19  6  13 o 307.3835 54.23091 21.08768       6.237110      30.69296       12.52152      17.91802       7.192960  331.1479 93.34803 272.6096 68.13132 58.53827       115.5670 
1 1 1 19  6  14 o 188.3805 68.77269 8.010658       6.545878      0.000000       0.000000      8.010658       6.545878  ?        ?        188.3805 68.77269 0.000000       68.77269 
1 1 1 19  6  15 o 235.4670 63.04860 13.16532       5.880340      25.18110       14.69072      10.87283       6.416820  282.8322 103.0621 212.0656 68.43909 70.76662       123.7162 
1 1 1 19  7  0  o 397.6085 41.54626 33.00142       6.320536      32.47836       8.314426      33.71751       9.728361  382.6560 57.74635 381.0544 68.24553 1.601654       89.39851 
1 1 1 19  7  1  o 165.2321 67.19330 4.165240       6.760625      2.059994       7.444699      14.06724       16.14571  157.8522 67.72995 242.9291 101.7802 -85.07693      122.2561 
1 1 1 19  7  2  o 172.3421 67.57581 5.343875       6.590204      6.566210       7.233594      -0.6249056     15.98461  183.8117 71.14993 196.6792 90.57742 -12.86755      115.1806 
1 1 1 19  7  3  o 155.2346 64.61274 2.844303       6.445953      3.157843       7.131948      1.445637       15.06324  162.0216 67.74498 198.7332 90.14680 -36.71156      112.7645 
1 1 1 19  7  4  o 345.2235 49.00517 25.49427       6.385645      22.61004       6.993052      39.96685       15.66480  318.6533 58.67120 377.9530 103.6262 -59.29971      119.0828 
1 1 1 19  7  5  o 183.8810 66.31631 7.135879       6.059867      6.251896       6.720883      10.97827       14.01216  179.6300 68.83137 228.4909 95.19720 -48.86086      117.4745 
1 1 1 19  7  6  o 434.3872 37.41177 38.73465       6.249653      39.89511       7.057130      34.51637       13.45496  437.8566 42.01793 359.9761 94.89805 77.88049       103.7841 
1 1 1 19  7  7  o 149.0327 64.45194 1.228231       6.845567      7.373225       9.132545      -6.652251      10.34207  196.2855 78.70338 147.5993 69.56621 48.68625       105.0413 
1 1 1 19  7  8  o 177.6532 67.80645 6.198503       6.506243      7.812039       8.616539      4.058254       9.923744  196.4986 77.19953 182.6720 78.28366 13.82654       109.9459 
1 1 1 19  7  9  o 354.8218 47.99852 26.96537       6.444265      24.96925       8.839353      29.22993       9.414996  323.0467 72.26582 351.0619 71.48624 -28.01517      101.6496 
1 1 1 19  7  10 o 231.8372 65.56609 12.67295       6.166977      11.75192       8.634183      13.63218       8.811361  220.4894 79.19978 233.7076 80.32059 -13.21820      112.8007 
1 1 1 19  7  11 o 348.9040 47.25905 26.18412       6.238729      36.05574       9.086328      17.37971       8.581124  398.7118 60.58847 261.4173 78.34392 137.2944       99.03905 
1 1 1 19  7  12 o 190.7939 62.31945 8.373311       5.311919      7.983162       8.010361      8.679537       7.096721  192.1932 74.73882 194.9709 71.54263 -2.777710      103.4613 
1 1 1 19  7  13 o 447.1062 43.72297 42.47597       7.494699      0.000000       0.000000      42.47597       7.494699  ?        ?        447.1062 43.72297 0.000000       43.72297 
1 1 1 19  7  14 o 439.1403 42.40120 40.83872       7.141253      0.000000       0.000000      40.83872       7.141253  ?        ?        439.1403 42.40120 0.000000       42.40120 
1 1 1 19  8  0  o 364.1534 44.36805 28.11143       6.144843      30.07347       8.271297      25.69473       9.179771  364.4737 60.56127 324.5554 74.41806 39.91837       95.94642 
1 1 1 19  8  1  o 238.9588 68.34595 13.60700       6.662153      12.34046       7.346290      19.47266       15.80943  226.1153 73.25484 261.6206 103.9999 -35.50529      127.2095 
1 1 1 19  8  2  o 233.6284 69.35857 13.01060       6.749172      18.36595       7.486101      -10.24337      15.59949  277.6242 69.57286 171.0850 81.98245 106.5392       107.5244 
1 1 1 19  8  3  o 404.8501 43.07006 34.38532       6.667710      31.99075       7.341384      45.66564       15.93400  385.3644 50.25027 405.0609 101.4983 -19.69653      113.2563 
1 1 1 19  8  4  o 298.4560 56.67728 19.83963       6.329037      22.07020       7.003059      9.896590       14.78561  313.0025 59.79218 223.7811 95.71853 89.22144       112.8589 
1 1 1 19  8  5  o 230.5342 66.37200 12.46603       6.263919      14.21661       6.954789      4.944783       14.41577  244.1566 69.83028 205.2456 90.99149 38.91104       114.6984 
1 1 1 19  8  6  o 237.5998 64.17586 13.14082       6.061132      16.77955       6.745683      -2.107131      13.80881  268.2328 65.35699 181.1309 83.68958 87.10190       106.1861 
1 1 1 19  8  7  o 187.7849 69.21204 7.558309       6.652366      15.98507       8.789282      -3.743088      10.17862  252.2218 79.96191 154.1071 71.43120 98.11467       107.2209 
1 1 1 19  8  8  o 178.9127 68.93967 6.354595       6.767148      9.575948       9.066002      2.301649       10.16909  207.0381 79.78979 175.1744 77.09914 31.86375       110.9535 
1 1 1 19  8  9  o 298.7401 58.04518 20.15784       6.491573      16.37777       8.761484      24.75865       9.665956  253.6615 79.76679 313.4010 79.34158 -59.73953      112.5070 
1 1 1 19  8  10 o 315.4709 53.85641 22.09752       6.361337      19.48648       9.202381      24.48708       8.803452  274.3386 80.87254 316.3768 73.11720 -42.03821      109.0252 
1 1 1 19  8  11 o 331.9020 53.67431 24.49793       6.682217      21.72540       11.32711      25.97787       8.275670  278.0694 91.01196 331.0659 66.67257 -52.99652      112.8202 
1 1 1 19  8  12 o 221.7106 75.57060 12.35178       7.797276      0.000000       0.000000      12.35178       7.797276  ?        ?        221.7106 75.57060 0.000000       75.57060 
1 1 1 19  8  13 f 194.2881 71.40493 8.804816       7.073414      0.000000       0.000000      8.804816       7.073414  ?        ?        194.2881 71.40493 0.000000       71.40493 
1 1 1 19  8  14 o 102.7093 50.14753 -9.764285      6.567467      0.000000       0.000000      -9.764285      6.567467  ?        ?        102.7093 50.14753 0.000000       50.14753 
1 1 1 19  9  0  o 332.0660 56.28472 24.76982       6.999185      30.12890       7.713041      -0.2276461     16.65821  367.1544 55.85503 194.1485 90.46051 173.0058       106.3150 
1 1 1 19  9  1  o 166.6642 66.07323 5.018390       6.365227      4.146704       6.987809      9.266648       15.42647  164.4968 67.76341 218.4234 95.57401 -53.92665      117.1592 
1 1 1 19  9  2  o 167.1954 66.50700 4.969291       6.469115      6.796018       7.222422      -2.442772      14.54841  182.9862 71.02094 181.6156 84.59327 1.370636       110.4536 
1 1 1 19  9  3  o 434.9135 41.02419 39.52757       6.847146      46.52862       7.607806      9.675486       15.70960  471.3149 42.00453 222.0830 96.83003 249.2319       105.5483 
1 1 1 19  9  4  o 278.3110 59.34448 17.64892       6.218304      17.93118       6.833549      16.28974       14.99541  276.7925 64.72774 246.5050 100.1384 30.28751       119.2366 
1 1 1 19  9  5  o 239.0613 64.66451 13.44526       6.148505      14.95713       6.864713      7.312901       13.82548  249.7810 68.64655 209.1706 91.02607 40.61043       114.0092 
1 1 1 19  9  6  o 341.3951 47.70747 25.07067       6.152355      34.40151       6.962996      -8.148992      13.13812  402.3970 45.34732 160.6711 76.50923 241.7259       88.93842 
1 1 1 19  9  7  o 165.2866 67.07712 4.471928       6.720783      4.471928       6.720783      0.000000       0.000000  165.2866 67.07712 ?        ?        0.000000       67.07712 
1 1 1 19  9  8  o 191.4333 71.75015 8.083450       7.207940      16.16583       11.28425      2.512797       9.368198  245.2367 90.17940 170.1218 74.45803 75.11490       116.9458 
1 1 1 19  9  9  o 162.9972 67.61409 3.948994       7.024581      6.506620       10.96098      2.166389       9.150785  194.0513 82.69272 166.7433 73.26846 27.30804       110.4824 
1 1 1 19  9  10 o 128.6739 59.26012 -2.661981      6.842636      1.706188       10.65756      -5.725476      8.925176  172.4511 77.22589 136.2283 64.33438 36.22282       100.5124 
1 1 1 19  9  11 o 235.7816 67.19884 13.57638       6.452138      10.32971       10.60335      15.48539       8.130689  209.0489 84.45694 244.7353 76.82251 -35.68639      114.1695 
1 1 1 19  9  12 o 158.8496 64.61911 4.248165       6.255153      -30.24942      13.37184      13.91163       7.077230  123.2948 62.01794 235.2981 71.29128 -112.0033      94.49164 
1 1 1 19  9  13 o 242.6457 66.75174 14.43346       6.487222      3.453071       13.10951      17.99423       7.465337  187.1566 84.57001 268.3165 70.66454 -81.15991      110.2069 
1 1 1 19  10 0  o 121.2065 57.24075 -5.208072      7.065728      0.2541746      7.945222      -25.86395      15.45049  149.4334 66.81546 141.2735 70.40047 8.159912       97.05943 
1 1 1 19  10 1  o 376.2886 51.23154 31.13195       7.292018      31.32416       8.232845      30.43225       15.70829  370.5906 59.19628 305.5490 107.1155 65.04166       122.3843 
1 1 1 19  10 2  o 516.2920 38.62585 55.46403       7.688529      56.47075       8.810090      52.24796       15.74666  515.5160 44.44005 433.4485 96.06953 82.06744       105.8502 
1 1 1 19  10 3  o 226.4654 69.94341 12.52038       6.770639      16.85540       7.854774      -0.1275263E-01 13.35573  259.2342 74.23363 180.9208 83.12522 78.31337       111.4470 
1 1 1 19  10 4  o 199.5728 68.04219 9.338577       6.321131      9.589560       7.249690      8.542753       12.90942  202.0328 72.57241 208.5416 89.32610 -6.508865      115.0909 
1 1 1 19  10 5  o 292.8869 56.93124 19.43241       6.242325      18.80407       7.111780      21.54115       13.02848  280.9554 66.25636 271.1518 97.29977 9.803650       117.7164 
1 1 1 19  10 6  o 234.3263 65.43833 13.13960       6.183484      9.504242       7.067814      25.00111       12.76679  201.0376 71.71532 292.2042 96.67065 -91.16667      120.3674 
1 1 1 19  10 7  o 113.3764 53.19183 -4.236209      5.926282      -4.021858      6.833207      -4.886767      11.90432  123.5493 57.69004 159.3475 74.96082 -35.79819      94.58999 
1 1 1 19  10 8  o 248.1538 69.24709 15.13650       6.926992      11.82955       10.59433      17.60595       9.155021  217.8194 85.59383 257.5941 81.60263 -39.77466      118.2594 
1 1 1 19  10 9  o 110.7216 53.22036 -7.320083      6.687309      4.295319       10.23649      -15.96799      8.832618  179.5491 78.22749 110.9350 54.92985 68.61411       95.58675 
1 1 1 19  10 10 o 255.2252 63.99689 15.66043       6.331607      13.65683       8.599082      18.03298       9.357392  228.2905 79.29633 257.6325 82.59384 -29.34206      114.4974 
1 1 1 19  10 11 o 228.4914 67.72769 12.92751       6.439245      16.16885       13.97115      12.05326       7.255862  235.5971 96.28930 218.1839 72.90686 17.41321       120.7768 
1 1 1 19  10 12 o 98.74975 47.99672 -8.092676      5.829461      -13.04637      12.84656      -6.808148      6.541754  144.5663 70.48521 110.2500 52.89933 34.31632       88.12778 
1 1 1 19  11 0  o 99.03812 48.96758 -12.71438      6.926250      -5.030797      7.970924      -36.39951      13.99473  128.9626 60.87096 119.7771 60.63097 9.185463       85.91500 
1 1 1 19  11 1  o 365.0116 54.88796 30.08542       7.539739      30.14871       8.594635      29.87402       15.70735  356.3604 64.47617 296.0695 106.7692 60.29083       124.7271 
1 1 1 19  11 2  o 432.5006 43.41961 39.92844       7.194458      41.60664       8.191436      34.26564       15.04714  436.1311 49.22444 326.2639 104.7510 109.8672       115.7403 
1 1 1 19  11 3  o 482.6924 39.58298 48.88303       7.354761      52.32955       8.415833      37.74201       15.13105  495.0098 44.24426 347.2612 104.0236 147.7486       113.0418 
1 1 1 19  11 4  o 250.0631 65.10805 15.09273       6.384865      21.24798       7.399362      -2.851136      12.63366  297.7045 65.75513 167.4306 78.26803 130.2739       102.2234 
1 1 1 19  11 5  o 153.5231 62.00344 3.907782       5.712771      2.852370       6.608693      7.027991       11.36308  152.6554 64.59633 195.0278 83.67879 -42.37239      105.7111 
1 1 1 19  11 6  o 124.4615 58.20567 -4.016318      6.999524      -1.131437      9.172197      -8.038984      10.83095  152.1744 69.53360 143.2322 68.55020 8.942139       97.64246 
1 1 1 19  11 7  o 220.8240 62.13129 11.66148       5.552558      10.75632       6.466791      14.20114       10.83211  209.3918 68.77886 228.6416 87.43770 -19.24976      111.2469 
1 1 1 19  11 8  o 109.1771 51.94241 -5.476971      6.027710      -2.287251      8.741033      -8.369064      8.323243  144.4137 66.67561 122.6960 59.07597 21.71771       89.08202 
1 1 1 19  11 9  o 226.6259 64.68702 12.55145       5.974159      6.732257       8.586509      18.01159       8.317389  182.7770 75.18408 261.3560 76.84015 -78.57895      107.5037 
1 1 1 19  11 10 o 208.4539 66.42089 10.70417       6.058643      22.50146       8.764524      -0.9233592E-01 8.384533  293.5441 76.21082 149.3313 67.54156 144.2129       101.8330 
1 1 1 19  11 11 o 322.1273 53.87177 23.55627       6.501338      38.54423       14.85620      20.00603       7.230448  346.6432 102.9017 285.5171 66.45434 61.12607       122.4946 
1 1 1 19  11 12 o 235.3236 64.69113 13.59464       6.095431      5.681543       13.08312      15.78848       6.888760  191.7553 85.73889 250.6667 68.71585 -58.91138      109.8773 
1 1 1 19  12 0  o 243.2879 66.89861 14.90323       6.517493      18.37145       7.440943      3.473975       13.50776  267.4421 70.60407 183.7340 84.11449 83.70805       109.8189 
1 1 1 19  12 1  o 405.4457 42.69489 35.34256       6.621549      28.69309       7.514003      58.45295       14.00817  352.5054 56.81961 473.5579 78.94897 -121.0525      97.26978 
1 1 1 19  12 2  o 255.2003 63.72762 15.86317       6.296878      13.13064       7.043487      26.74132       14.05344  225.9874 71.57468 283.3031 101.1187 -57.31567      123.8867 
1 1 1 19  12 3  o 117.2113 54.40039 -2.930520      5.931874      -6.807245      6.563945      14.34051       13.85452  110.1295 52.88062 225.0248 94.28079 -114.8953      108.0982 
1 1 1 19  12 4  o 125.2208 56.64206 -1.043775      5.898435      -1.954446      6.555730      2.826664       13.51514  127.3480 58.41018 184.3707 84.30734 -57.02271      102.5645 
1 1 1 19  12 5  o 138.1172 58.58844 2.048731       5.457974      7.656740       6.331332      -14.17650      10.76927  182.2319 67.45280 128.3504 62.98854 53.88150       92.28996 
1 1 1 19  12 6  o 133.8916 56.99817 1.736777       5.197944      9.981484       6.279938      -16.20031      9.262830  201.2047 67.82390 113.0825 56.03929 88.12222       87.98001 
1 1 1 19  12 7  o 219.0220 59.64802 11.48241       5.210641      11.42750       6.175135      11.61816       9.709720  214.0977 66.90801 210.7364 82.19203 3.361328       105.9821 
1 1 1 19  12 8  o 167.7053 66.06258 5.795734       6.325491      0.1242559      8.737597      12.04134       9.169193  151.6817 68.74551 212.9349 80.68045 -61.25317      105.9966 
1 1 1 19  12 9  o 105.2543 50.60870 -6.560148      6.058743      -4.449833      8.207186      -9.087632      8.981831  131.7551 62.05983 125.1457 60.52950 6.609390       86.69050 
1 1 1 19  12 10 o 218.9421 66.18579 11.99954       6.104915      11.45062       8.130873      12.70887       9.242955  209.2445 76.60867 216.4099 81.22273 -7.165359      111.6513 
1 1 1 19  12 11 o 377.4523 51.25237 31.96060       7.318548      55.19030       15.38193      25.16323       8.320695  436.7297 93.51259 316.9071 69.51968 119.8226       116.5229 
1 1 1 19  13 0  o 164.3989 66.90803 5.510010       6.710130      5.994369       7.542624      3.671993       14.69310  170.1803 70.28457 183.5624 85.33729 -13.38210      110.5548 
1 1 1 19  13 1  o 223.1613 66.42818 12.73671       6.184784      5.646892       7.076188      35.67887       12.72914  167.2499 68.46093 340.0345 93.48856 -172.7845      115.8750 
1 1 1 19  13 2  o 221.6331 65.71885 12.44080       6.062100      9.452689       7.000648      21.39758       12.12037  193.5499 71.05134 256.5769 93.59486 -63.02702      117.5087 
1 1 1 19  13 3  o 180.8689 64.97538 7.831546       5.811420      -0.4218439     6.630475      35.18407       12.07055  133.1934 60.16891 347.1489 89.08790 -213.9554      107.5033 
1 1 1 19  13 4  o 102.0313 49.17514 -6.568552      5.801187      -4.709918      6.597132      -12.90699      12.18286  116.2384 55.02087 138.1836 67.64411 -21.94526      87.19531 
1 1 1 19  13 5  o 171.8784 63.83675 6.759884       5.680226      3.519605       6.475856      17.56947       11.82798  152.4860 64.20215 237.3882 91.22945 -84.90216      111.5559 
1 1 1 19  13 6  o 327.8776 57.89320 25.25967       7.102159      21.37818       9.027596      31.56376       11.50493  277.6242 79.60721 328.6889 88.26540 -51.06467      118.8616 
1 1 1 19  13 7  o 164.8166 71.45135 3.967027       8.454196      0.000000       0.000000      3.967027       8.454196  ?        ?        164.8166 71.45135 0.000000       71.45135 
1 1 1 19  13 8  o 315.6884 51.22020 22.61425       6.064337      18.33109       8.780791      26.52037       8.385402  255.4459 79.77778 324.5679 68.66895 -69.12195      105.2612 
1 1 1 19  13 9  o 117.5108 53.82755 -1.697769      5.542392      1.914892       7.865630      -5.260338      7.810908  152.2508 67.36862 125.1625 59.42511 27.08834       89.83249 
1 1 1 19  13 10 o 238.8013 67.20019 14.50576       6.494968      19.38778       14.29634      13.23607       7.290806  240.2814 97.71191 223.3378 73.01353 16.94365       121.9778 
1 1 1 19  14 0  o 127.9369 58.22177 -0.5116156     6.348686      -1.394285      7.073678      3.144364       14.39621  129.9157 59.98133 176.7063 82.90401 -46.79054      102.3271 
1 1 1 19  14 1  o 437.8005 39.14392 41.25175       6.585113      41.30943       7.403263      41.03322       14.41073  431.7506 44.80565 342.8465 101.2415 88.90408       110.7130 
1 1 1 19  14 2  o 100.0638 48.52480 -7.118320      5.868423      -3.666739      6.655961      -19.16960      12.43707  118.8462 55.95162 127.0930 63.30641 -8.246735      84.48837 
1 1 1 19  14 3  o 109.1438 51.11803 -3.144459      5.433140      -1.394679      6.307034      -8.178909      10.69817  124.7277 57.23899 136.3709 65.98331 -11.64326      87.35043 
1 1 1 19  14 4  f 124.5232 55.50543 0.1601954      5.437779      -3.463927      6.389504      9.680468       10.35596  117.4892 55.15662 193.8412 81.37894 -76.35205      98.30963 
1 1 1 19  14 5  o 145.9411 63.07481 2.592855       6.547774      5.482286       8.621660      -1.344872      10.06485  170.3643 72.98718 150.8188 70.28620 19.54556       101.3276 
1 1 1 19  14 6  o 204.1129 70.48077 11.02438       6.788569      17.16262       9.067230      3.194915       10.24045  241.3062 81.49638 166.9516 75.15610 74.35457       110.8607 
1 1 1 19  14 7  o 257.4191 64.57830 16.72890       6.444952      16.94100       8.415504      16.42804       10.02282  243.8565 78.34250 232.1794 85.04824 11.67708       115.6320 
1 1 1 19  14 8  f 186.5674 58.19158 8.440062       4.673553      10.28912       5.719600      4.725173       8.107065  201.4740 64.57155 165.3037 70.79613 36.17026       95.82055 
1 1 1 19  15 0  o 268.7403 62.15863 18.60057       6.358129      19.71415       7.151406      14.39992       13.88955  269.4015 68.26902 202.5822 89.58707 66.81926       112.6344 
1 1 1 19  15 1  o 106.1476 50.58551 -4.464104      5.766935      -6.671798      6.408176      4.940370       13.22612  105.4831 51.04534 174.8679 81.18526 -69.38477      95.89929 
1 1 1 19  15 2  o 295.6643 54.91214 20.98451       6.073033      17.78582       6.844553      32.82187       13.16699  257.9104 67.53728 298.8569 98.14063 -40.94650      119.1338 
1 1 1 19  15 3  o 196.0194 64.31228 10.06433       5.654743      11.88131       6.376182      3.370478       12.23838  209.1139 68.27634 169.9942 78.62939 39.11966       104.1357 
1 1 1 19  15 4  o 223.5049 72.94936 14.09492       7.279096      3.952523       9.158433      31.49110       11.99439  162.4161 72.23954 307.6332 92.72081 -145.2171      117.5402 
1 1 1 19  15 5  o 192.0005 69.26125 9.808988       6.610602      16.63271       9.037171      1.955585       9.695067  233.2732 81.27621 157.5172 71.78555 75.75601       108.4389 
1 1 1 19  15 6  o 144.0987 61.25354 3.088920       5.987065      9.099178       7.984697      -4.629966      9.048761  186.7373 74.01173 133.6067 63.58677 53.13066       97.57568 
1 1 1 19  15 7  o 81.17484 40.11165 -8.667903      4.623847      -12.00352      5.350455      1.172208       9.189730  82.09208 40.99110 153.3237 69.88036 -71.23167      81.01564 
1 1 1 19  16 0  o 135.4707 59.18258 2.469846       5.894361      2.291089       6.572855      3.204056       13.32089  138.2652 61.36209 164.4939 77.95516 -26.22878      99.20844 
1 1 1 19  16 1  o 255.4494 62.34990 17.17796       6.131171      21.88619       6.932537      0.2717219      13.13672  288.2782 63.62678 158.8054 75.86436 129.4728       99.01398 
1 1 1 19  16 2  o 271.7827 56.88342 18.36508       5.811230      25.44563       6.519790      -9.001955      12.81781  325.0937 53.50302 140.4267 68.87535 184.6670       87.21460 
1 1 1 19  16 3  o 245.4271 71.88110 17.21157       7.290846      8.468036       9.117649      32.71695       12.14173  178.8615 75.79002 304.4326 93.60445 -125.5711      120.4405 
1 1 1 19  16 4  o 268.4308 68.78990 19.58786       7.203890      15.70186       9.018919      26.43687       11.97338  222.1735 80.78368 268.7409 93.55712 -46.56740      123.6080 
1 1 1 19  16 5  o 134.7397 61.45774 0.4621499E-01  7.125327      -0.8718788     9.463598      1.247880       10.82691  145.1878 67.82672 157.7775 73.31821 -12.58974      99.88005 
1 1 1 19  17 0  o 128.7865 56.98458 1.847712       5.627378      0.4327635      6.324391      7.226440       12.33071  126.3932 57.74765 169.0818 78.46001 -42.68858      97.42055 
1 1 1 19  17 1  o 182.2261 66.06783 9.448013       6.026087      7.219731       6.838243      17.19288       12.74872  165.1685 67.41891 204.5864 88.21709 -39.41794      111.0296 
1 1 1 19  17 2  o 140.7949 63.51627 2.000589       7.359601      24.14838       9.270756      -35.74286      12.10238  272.9333 81.34889 102.5195 52.32409 170.4138       96.72359 
1 1 1 19  17 3  o 191.6461 72.30683 10.87227       7.344935      6.483660       9.351694      17.93835       11.86632  167.5654 73.83537 216.1617 88.58823 -48.59628      115.3236 
1 1 1 20  0  0  f 353.6817 77.35155 28.98324       9.304029      28.98324       9.304029      28.98324       9.304029  353.6817 77.35155 353.6817 77.35155 0.000000       0.000000 
1 1 1 20  0  1  o 138.2591 85.06255 4.220291       8.870855      4.220291       8.870855      4.220291       8.870855  138.2591 85.06255 138.2591 85.06255 0.000000       0.000000 
1 1 1 20  0  2  o 440.2461 58.05371 41.19634       9.445610      41.19634       9.445610      41.19634       9.445610  440.2461 58.05371 440.2461 58.05371 0.000000       0.000000 
1 1 1 20  0  3  o 764.7114 47.42593 118.6115       13.96036      118.6115       13.96036      118.6115       13.96036  764.7114 47.42593 764.7114 47.42593 0.000000       0.000000 
1 1 1 20  0  4  o 238.1909 122.8495 20.39827       14.56369      20.39827       14.56369      20.39827       14.56369  238.1909 122.8495 238.1909 122.8495 0.000000       0.000000 
1 1 1 20  0  5  o 392.5808 80.93798 36.04221       10.89658      36.04221       10.89658      36.04221       10.89658  392.5808 80.93798 392.5808 80.93798 0.000000       0.000000 
1 1 1 20  0  6  o 308.7479 93.30434 25.14378       9.758495      25.14378       9.758495      25.14378       9.758495  308.7479 93.30434 308.7479 93.30434 0.000000       0.000000 
1 1 1 20  0  7  o 136.3772 85.18105 4.182922       9.232584      4.182922       9.232584      4.182922       9.232584  136.3772 85.18105 136.3772 85.18105 0.000000       0.000000 
1 1 1 20  0  8  o 217.9207 102.6980 16.14471       9.801450      16.14471       9.801450      16.14471       9.801450  217.9207 102.6980 217.9207 102.6980 0.000000       0.000000 
1 1 1 20  0  9  o 246.3374 98.27809 18.79753       9.102088      18.79753       9.102088      18.79753       9.102088  246.3374 98.27809 246.3374 98.27809 0.000000       0.000000 
1 1 1 20  0  10 o 171.5086 90.68218 10.41320       8.083613      10.41320       8.083613      10.41320       8.083613  171.5086 90.68218 171.5086 90.68218 0.000000       0.000000 
1 1 1 20  0  11 o 554.5762 42.31569 63.74502       8.991599      63.74502       8.991599      63.74502       8.991599  554.5762 42.31569 554.5762 42.31569 0.000000       0.000000 
1 1 1 20  0  12 o 186.9923 90.60330 12.37633       7.682972      12.37633       7.682972      12.37633       7.682972  186.9923 90.60330 186.9923 90.60330 0.000000       0.000000 
1 1 1 20  0  13 o 154.0760 85.21094 8.754242       7.456708      8.754242       7.456708      8.754242       7.456708  154.0760 85.21094 154.0760 85.21094 0.000000       0.000000 
1 1 1 20  1  0  o 279.5211 71.60390 19.51823       7.807473      26.37738       9.030333      -0.7879914     15.53757  325.0560 73.28543 185.3019 86.67810 139.7541       113.5070 
1 1 1 20  1  1  o 219.4789 68.61665 11.77965       6.493838      20.96716       9.014881      1.870320       9.362317  283.8152 78.92529 165.5265 73.35835 118.2887       107.7527 
1 1 1 20  1  2  o 390.6494 47.88830 33.04652       7.113009      41.95766       9.332810      20.69643       10.98705  431.8692 57.04168 271.7002 89.66975 160.1690       106.2752 
1 1 1 20  1  3  o 169.3692 72.32339 3.717449       8.415702      3.717449       8.415702      0.000000       0.000000  169.3692 72.32339 ?        ?        0.000000       72.32339 
1 1 1 20  1  4  o 362.2294 50.97901 28.76251       6.972967      23.47992       8.062469      44.44223       13.89036  312.9393 68.26188 406.7852 90.28362 -93.84589      113.1849 
1 1 1 20  1  5  o 194.5373 80.75877 7.332973       10.03224      0.000000       0.000000      7.332973       10.03224  ?        ?        194.5373 80.75877 0.000000       80.75877 
1 1 1 20  1  6  o 110.0710 52.76807 -6.975890      6.478351      -17.65293      9.028971      4.353262       9.300611  110.1332 54.70607 177.0890 75.83570 -66.95583      93.50833 
1 1 1 20  1  7  f 195.5038 79.17098 8.038924       9.341313      0.000000       0.000000      8.038924       9.341313  ?        ?        195.5038 79.17098 0.000000       79.17098 
1 1 1 20  1  8  o 335.3200 54.19416 25.15568       6.816598      14.65375       9.679029      35.49044       9.601686  235.0273 83.91494 387.6853 66.14704 -152.6580      106.8511 
1 1 1 20  1  9  o 381.1478 45.20361 31.23950       6.560644      41.68007       9.286818      20.83782       9.269509  429.2035 57.13486 280.3314 80.74939 148.8721       98.91843 
1 1 1 20  1  10 o 128.3368 57.18769 -0.2850976     5.767605      -11.00532      8.210486      10.15837       8.103810  115.3881 56.27885 203.7928 76.13812 -88.40466      94.68011 
1 1 1 20  1  11 o 153.7443 61.68202 4.147156       5.613068      2.927385       7.873398      5.407848       8.004377  159.8922 69.13490 173.4795 72.08659 -13.58728      99.88049 
1 1 1 20  1  12 o 174.2980 62.93016 6.863522       5.459032      15.51098       7.837152      -1.286500      7.608402  243.0776 75.28001 139.0048 63.44336 104.0728       98.44866 
1 1 1 20  1  13 o 187.6839 68.71050 8.329204       6.540601      -16.42046      12.07164      18.61408       7.781820  133.0800 65.57963 269.0644 72.73471 -135.9844      97.93378 
1 1 1 20  2  0  o 245.8867 76.78773 15.75809       8.135061      26.23568       11.77958      6.204423       11.24823  300.7626 92.15174 190.6611 82.53617 110.1015       123.7100 
1 1 1 20  2  1  f 172.9684 74.30257 4.093342       8.978420      1.536041       11.00480      9.184247       15.52704  172.7780 77.83238 213.7139 94.60477 -40.93591      122.5069 
1 1 1 20  2  2  o 208.9372 67.34679 10.50727       6.215071      12.38828       8.605207      8.456101       8.986031  221.0584 79.10243 196.3565 78.29675 24.70189       111.2995 
1 1 1 20  2  3  o 156.6912 61.77159 4.389638       5.534442      -7.832476      7.371720      20.17746       8.378317  116.4903 55.96283 282.9022 75.03138 -166.4119      93.60313 
1 1 1 20  2  4  o 152.6956 63.70796 3.078081       6.288019      6.922199       7.157305      -9.926310      13.16425  182.1138 70.69510 154.9906 74.54213 27.12314       102.7343 
1 1 1 20  2  5  o 150.1481 65.24693 1.592626       7.083155      -2.047290      9.886190      5.431919       10.15334  155.1096 71.35905 185.6850 79.36893 -30.57545      106.7312 
1 1 1 20  2  6  o 245.0015 78.38145 15.48260       8.430593      31.72760       17.15374      10.30904       9.680400  305.8145 111.3777 208.9943 81.91366 96.82011       138.2564 
1 1 1 20  2  7  o 330.9203 61.94653 25.42294       7.668410      9.585125       13.43468      33.07653       9.339253  212.1758 91.01048 373.6859 66.80635 -161.5101      112.8982 
1 1 1 20  2  8  o 120.7230 56.06090 -3.303768      6.312595      -2.669119      9.286539      -3.848919      8.606871  148.1783 68.52275 139.2038 64.91443 8.974503       94.38882 
1 1 1 20  2  9  o 387.9217 54.36838 33.72645       7.965677      22.04953       14.98002      38.32993       9.405696  262.7997 102.2032 406.7133 61.46641 -143.9135      119.2628 
1 1 1 20  2  10 o 292.9478 68.89101 21.14208       7.705969      61.18012       15.70819      8.452760       8.843188  475.8002 88.26043 193.8448 77.54485 281.9553       117.4866 
1 1 1 20  2  11 o 209.0163 72.09827 10.97212       7.102831      35.03444       14.10935      2.804181       8.220433  334.5553 100.5028 161.0655 70.14029 173.4898       122.5581 
1 1 1 20  2  12 o 225.3922 70.74281 12.93702       6.894907      20.72207       13.23167      10.03514       8.078382  255.8249 96.92217 201.1434 75.84533 54.68149       123.0708 
1 1 1 20  2  13 o 202.7220 69.71445 10.21612       6.638461      1.945211       11.96589      13.89365       7.978960  175.3856 79.85976 229.0479 76.45386 -53.66237      110.5567 
1 1 1 20  3  0  o 310.8716 63.18905 22.91620       7.368702      21.69264       11.54607      23.75703       9.571350  271.3079 91.96243 298.7687 80.62397 -27.46082      122.3001 
1 1 1 20  3  1  o 107.9762 52.32914 -8.646607      6.797044      -22.01877      10.17604      2.125318       9.133237  111.8250 55.94122 164.5907 72.72324 -52.76567      91.75015 
1 1 1 20  3  2  o 334.3654 57.63287 25.47445       7.213539      26.29510       10.90388      24.83575       9.619403  309.6222 87.05010 309.0257 79.65111 0.5965271      117.9916 
1 1 1 20  3  3  o 151.0655 66.78080 0.9315262      7.711095      7.476106       9.209410      -14.41809      14.10391  191.4693 78.20660 151.2190 73.75636 40.25031       107.5001 
1 1 1 20  3  4  o 108.5712 52.89153 -10.09633      7.191283      -10.12897      8.432852      -10.00931      13.76884  120.1593 58.24646 157.8795 76.00770 -37.72018      95.75918 
1 1 1 20  3  5  o 101.4039 49.38207 -9.067453      6.252539      -6.865153      8.210777      -12.10733      9.646595  126.8951 60.44164 125.8606 61.30214 1.034492       86.08800 
1 1 1 20  3  6  o 397.5756 56.21527 35.51833       8.437624      31.11060       16.95555      36.96912       9.727620  302.1377 110.6267 396.6892 65.42458 -94.55151      128.5248 
1 1 1 20  3  7  o 329.2793 67.99445 26.08361       8.406936      5.776618       17.19209      32.46549       9.637845  208.0686 95.12149 365.9162 70.37757 -157.8476      118.3262 
1 1 1 20  3  8  o 253.4220 81.41756 17.18969       9.089067      0.000000       0.000000      17.18969       9.089067  ?        ?        253.4220 81.41756 0.000000       81.41756 
1 1 1 20  3  9  o 145.7944 64.73474 0.6117431      7.323775      5.097275       14.53253      -0.9152841     8.479255  196.7836 88.96983 147.8282 67.27847 48.95538       111.5438 
1 1 1 20  3  10 o 130.3044 60.22515 -2.662099      7.159566      11.02868       13.83908      -7.665503      8.366155  213.8502 92.06266 124.7692 59.85440 89.08097       109.8093 
1 1 1 20  3  11 o 151.9713 65.94454 2.247338       7.214788      12.97956       13.51010      -2.034477      8.533505  219.9068 92.66803 143.1063 66.00445 76.80046       113.7715 
1 1 1 20  3  12 o 280.9612 56.30584 18.27628       5.929652      16.27013       8.720807      20.00128       8.086644  244.1403 79.85540 278.0311 73.70156 -33.89073      108.6683 
1 1 1 20  3  13 o 176.8996 62.86880 7.212715       5.426796      12.11720       7.855453      2.735138       7.505781  215.5578 75.73825 155.8423 67.44256 59.71555       101.4139 
1 1 1 20  4  0  o 409.0988 48.46008 36.69480       7.549456      38.57703       12.08787      35.49110       9.666569  378.9326 84.31494 383.1983 67.41786 -4.265717      107.9545 
1 1 1 20  4  1  o 308.6505 65.17760 22.84302       7.567486      21.64466       11.60701      23.72902       9.980333  270.9147 92.20293 295.5134 83.35188 -24.59872      124.2937 
1 1 1 20  4  2  o 156.1500 63.45322 4.038209       6.023341      5.483186       8.661851      2.685210       8.381639  177.8587 74.53474 162.7041 70.83988 15.15463       102.8286 
1 1 1 20  4  3  o 127.0578 59.53704 -4.331253      7.385495      -2.630694      8.784903      -8.430327      13.63905  144.3924 66.72784 159.5726 76.51662 -15.18019      101.5254 
1 1 1 20  4  4  o 225.3808 74.90204 12.85967       7.661253      13.87225       9.093193      10.38239       14.22292  230.0902 81.42256 215.4955 93.04893 14.59471       123.6436 
1 1 1 20  4  5  o 169.9275 69.73219 5.005861       7.364525      4.089207       8.701326      7.320716       13.82754  171.6795 73.43102 203.7731 89.78650 -32.09357      115.9902 
1 1 1 20  4  6  o 163.6591 70.56796 3.075515       8.157542      -9.148528      15.83668      7.490345       9.517302  169.2401 81.48676 191.8297 79.05991 -22.58955      113.5366 
1 1 1 20  4  7  o 550.6744 42.04034 64.14655       8.922678      47.47026       16.98024      70.50773       10.48728  385.7626 108.6912 570.8102 47.74746 -185.0476      118.7164 
1 1 1 20  4  8  o 192.4800 68.68010 8.753500       6.482602      10.19325       9.124205      7.285909       9.211991  204.9680 79.74945 188.7906 77.79139 16.17738       111.4068 
1 1 1 20  4  9  o 233.6528 74.87109 14.16661       7.690005      11.45523       15.33607      15.07733       8.888158  217.4341 95.21339 236.4861 80.68360 -19.05202      124.8016 
1 1 1 20  4  10 o 134.7491 60.26084 -0.1264833     6.466006      0.5812800      10.07036      -0.6229532     8.434267  162.1092 73.60078 147.6451 67.15825 14.46419       99.63586 
1 1 1 20  4  11 o 184.3165 66.18987 8.004007       6.030183      15.59310       8.380618      -0.1433091     8.683370  240.3635 78.26597 150.6891 68.38840 89.67438       103.9352 
1 1 1 20  4  12 o 142.4152 60.19239 2.467742       5.727491      0.9462965      8.220516      3.903055       7.984435  151.8356 67.92105 164.1015 70.26936 -12.26593      97.72948 
1 1 1 20  5  0  o 366.1994 48.05385 29.50605       6.669013      37.86831       9.247749      20.44486       9.626465  401.7782 61.20170 270.5080 83.37572 131.2702       103.4271 
1 1 1 20  5  1  o 95.19331 46.86482 -10.65045      6.115946      -0.7810456     8.157582      -23.31847      9.242091  145.3755 66.09566 102.0349 51.35413 43.34068       83.70115 
1 1 1 20  5  2  o 135.1248 60.23723 -0.4085135E-01 6.406194      3.192840       7.101500      -14.17082      14.84470  156.9293 66.70953 153.8708 75.18454 3.058472       100.5131 
1 1 1 20  5  3  f 166.2017 65.79063 5.337543       6.302084      3.167677       7.061840      13.82532       13.96685  156.8575 66.59646 226.4355 94.75121 -69.57799      115.8140 
1 1 1 20  5  4  o 176.7885 67.14186 6.749326       6.359490      3.436856       7.074061      20.70530       14.52021  158.6054 66.95745 256.7993 100.4128 -98.19395      120.6898 
1 1 1 20  5  5  o 137.3437 60.09986 0.8392107      6.100808      1.209763       6.867312      -0.5482895     13.28857  145.3914 63.68887 176.2312 81.66181 -30.83983      103.5612 
1 1 1 20  5  6  o 235.0838 70.67108 13.88096       6.974617      22.84342       9.450890      3.162035       10.33557  293.1636 80.53638 174.5339 77.22697 118.6297       111.5801 
1 1 1 20  5  7  o 217.5234 68.58352 11.72295       6.472721      19.46825       9.056787      3.636640       9.254019  269.2935 80.43664 170.9753 74.43816 98.31815       109.5951 
1 1 1 20  5  8  o 321.7979 54.72609 23.51813       6.594339      23.58958       9.058382      23.43757       9.618402  300.6288 77.18974 294.7761 81.35735 5.852722       112.1484 
1 1 1 20  5  9  o 172.9229 67.13491 6.363782       6.455144      17.43551       8.806122      -6.494653      9.490106  253.1449 80.01548 136.3512 64.95512 116.7938       103.0614 
1 1 1 20  5  10 o 379.7391 42.36770 30.94556       6.141591      31.39590       8.739994      30.50628       8.632053  361.4393 64.63828 355.9798 64.82813 5.459473       91.54667 
1 1 1 20  5  11 o 268.4297 77.29057 19.34578       8.493926      0.000000       0.000000      19.34578       8.493926  ?        ?        268.4297 77.29057 0.000000       77.29057 
1 1 1 20  5  12 f 110.5957 52.14674 -4.237261      5.821863      3.033911       8.273741      -11.36819      8.193561  160.9712 70.22567 113.3074 55.46823 47.66383       89.48949 
1 1 1 20  6  0  o 389.6825 44.56040 32.98212       6.622296      31.34515       9.269569      34.68853       9.464143  354.4437 69.82564 376.3394 67.22162 -21.89575      96.92453 
1 1 1 20  6  1  o 285.4265 56.57451 18.89901       6.049472      28.92448       8.452994      8.373343       8.661300  345.9125 65.31820 190.8930 76.60889 155.0196       100.6747 
1 1 1 20  6  2  o 358.3411 48.77412 28.32826       6.611220      28.48680       7.419315      27.71710       14.56724  352.9847 55.99187 287.3052 102.9077 65.67953       117.1541 
1 1 1 20  6  3  o 111.8887 53.20052 -5.483561      6.304872      -7.455366      7.002126      2.964271       14.49341  112.8235 54.28787 188.8189 86.69463 -75.99540      102.2895 
1 1 1 20  6  4  o 240.8282 66.19102 14.27563       6.382108      20.47124       7.203574      -8.336476      13.76184  290.7710 65.37993 158.7282 76.30843 132.0427       100.4864 
1 1 1 20  6  5  o 342.5815 48.70968 25.84573       6.297969      20.63671       7.064567      46.01546       13.90137  293.3850 63.82000 406.4846 90.39883 -113.0995      110.6569 
1 1 1 20  6  6  o 194.7761 63.70165 9.087690       5.549502      6.829058       6.624045      14.40526       10.16382  177.1198 68.21865 228.6374 85.29795 -51.51758      109.2224 
1 1 1 20  6  7  o 95.27110 47.18826 -12.56030      6.536801      -5.305095      8.708204      -21.92539      9.893724  133.8653 63.31924 109.0405 54.63748 24.82487       83.63361 
1 1 1 20  6  8  o 139.1393 60.67109 1.289765       6.168679      2.110390       8.487614      0.3709734      8.980934  158.6936 70.11232 154.5264 69.89584 4.167297       99.00084 
1 1 1 20  6  9  o 125.4944 57.21238 -1.440406      6.165267      0.2809027      8.703535      -3.174006      8.734554  152.0251 68.78226 139.9774 65.31506 12.04767       94.85281 
1 1 1 20  6  10 o 122.6118 56.19403 -1.804491      6.051490      -5.586084      8.294545      2.499066       8.848487  128.8705 61.20065 161.4537 71.44664 -32.58315      94.07519 
1 1 1 20  6  11 o 134.9030 59.67623 0.6164774      6.167827      -2.589332      9.919359      2.637231       7.875379  149.1235 69.58987 156.5016 68.38846 -7.378174      97.56911 
1 1 1 20  6  12 o 140.9307 64.76465 -1.452046      8.112944      0.000000       0.000000      -1.452046      8.112944  ?        ?        140.9307 64.76465 0.000000       64.76465 
1 1 1 20  7  0  o 229.2231 65.83458 13.26394       6.169631      29.46927       8.859833      -1.992307      8.596478  342.6090 68.97514 141.7797 65.69183 200.8293       95.25223 
1 1 1 20  7  1  o 244.8115 68.20085 15.23789       6.725114      11.30502       7.560516      30.14227       14.71817  208.3152 74.18761 293.4408 103.6159 -85.12566      127.4365 
1 1 1 20  7  2  o 292.2094 60.28019 20.28276       6.613578      29.46660       7.429370      -14.78110      14.51676  358.7288 55.08955 148.9857 73.11861 209.7430       91.54884 
1 1 1 20  7  3  o 223.8099 67.24943 12.57282       6.316715      6.915452       7.087219      34.42978       13.93040  177.8823 69.97318 328.1998 100.1499 -150.3175      122.1730 
1 1 1 20  7  4  o 171.5258 66.35662 6.317574       6.289011      2.963189       7.141872      17.89987       13.27098  154.6971 66.35612 240.2334 95.35246 -85.53625      116.1689 
1 1 1 20  7  5  o 189.8241 66.51895 8.678414       6.057508      12.37291       6.871910      -4.195956      12.82811  219.9554 70.80760 161.8448 76.64179 58.11063       104.3440 
1 1 1 20  7  6  o 171.7942 64.55605 6.540902       5.842334      3.025037       6.625445      18.83204       12.38783  151.7318 64.46593 246.5428 93.69072 -94.81100      113.7269 
1 1 1 20  7  7  o 150.3187 64.09814 2.853083       6.593509      1.565229       8.953282      4.379204       9.746380  158.3948 70.86738 173.8750 76.02735 -15.48021      103.9343 
1 1 1 20  7  8  o 334.1518 58.21552 26.11614       7.280019      35.65179       10.85559      18.32257       9.814022  367.2540 78.49328 251.5519 84.78691 115.7021       115.5423 
1 1 1 20  7  9  o 268.7677 66.50687 18.06135       6.904038      21.96701       11.27595      15.71908       8.732205  266.9263 90.87833 237.3010 79.97742 29.62529       121.0589 
1 1 1 20  7  10 o 251.4417 69.68951 16.29857       7.040838      6.054002       11.29178      22.81536       9.006001  184.5035 81.22353 289.5875 78.23192 -105.0840      112.7719 
1 1 1 20  7  11 o 225.3340 69.72011 13.15410       6.724024      26.96207       11.36531      5.718299       8.340270  298.5534 90.31783 173.3133 72.90987 125.2401       116.0739 
1 1 1 20  8  0  o 208.1786 72.03828 11.51872       7.093743      13.60625       8.187128      5.231446       14.20844  220.7271 77.33372 186.8896 85.81964 33.83746       115.5228 
1 1 1 20  8  1  o 180.8373 70.02420 7.729695       7.008497      1.660226       8.250533      23.46008       13.28239  152.9326 68.25458 261.4876 97.51840 -108.5551      119.0316 
1 1 1 20  8  2  o 149.9678 72.84756 -10.03115      13.37560      0.000000       0.000000      -10.03115      13.37560  ?        ?        149.9678 72.84756 0.000000       72.84756 
1 1 1 20  8  3  o 127.0873 58.41789 -1.841015      6.606546      -5.107324      7.745234      6.882580       12.65767  125.3002 59.39867 191.1397 84.97483 -65.83958      103.6770 
1 1 1 20  8  4  o 341.7420 53.01826 26.61329       6.808444      31.84827       7.993387      12.77772       12.99488  369.6429 57.55599 214.3520 90.63529 155.2908       107.3660 
1 1 1 20  8  5  o 443.4702 39.42105 41.79695       6.718440      45.17447       7.993021      33.66653       12.40131  454.3448 45.93070 334.6555 92.38696 119.6893       103.1745 
1 1 1 20  8  6  o 358.3955 46.71348 28.33906       6.347218      27.71972       7.500889      29.90085       11.91132  343.6099 58.29421 313.7304 91.87417 29.87946       108.8075 
1 1 1 20  8  7  o 212.9652 72.38963 11.91574       7.154482      5.118769       11.23398      16.55363       9.279742  180.4458 80.14492 239.8989 82.42892 -59.45308      114.9684 
1 1 1 20  8  8  o 221.7565 72.32844 13.03353       7.156170      -2.015162      10.65333      25.40704       9.660118  153.9783 71.94364 302.3265 80.74963 -148.3483      108.1498 
1 1 1 20  8  9  o 193.8965 70.50491 9.519110       6.869930      -15.26963      10.30014      29.38309       9.220385  121.2037 59.88693 336.8817 72.61546 -215.6780      94.12465 
1 1 1 20  8  10 o 399.5841 42.25869 34.54619       6.458207      36.41857       9.190719      32.71989       9.076914  387.7116 63.21856 363.0481 66.84221 24.66348       92.00254 
1 1 1 20  8  11 o 123.7400 56.12055 -0.9236035     5.835033      0.8016873      8.437124      -2.505349      8.078518  150.6383 67.97738 135.9562 63.22932 14.68208       92.83787 
1 1 1 20  9  0  o 200.1330 71.63768 10.75917       7.058263      16.08097       8.100389      -6.023999      14.38512  237.1656 76.93200 158.6883 76.71667 78.47731       108.6461 
1 1 1 20  9  1  o 416.6093 45.04310 38.31718       7.171606      39.35245       8.537852      35.83636       13.21660  410.9179 54.87236 330.1436 96.80486 80.77426       111.2751 
1 1 1 20  9  2  o 490.6132 39.03280 51.40107       7.375486      56.80511       9.191087      41.62764       12.36036  505.3466 47.38611 381.3514 85.56408 123.9952       97.80927 
1 1 1 20  9  3  o 212.2575 69.90299 11.84987       6.678294      26.12220       8.111368      -18.18316      11.76647  322.2797 66.99438 125.6843 62.43419 196.5954       91.57661 
1 1 1 20  9  4  o 173.7598 65.64111 7.050125       6.057982      9.617356       7.293519      1.338821       10.87858  193.6781 72.25656 164.3605 75.33354 29.31758       104.3846 
1 1 1 20  9  5  o 159.0733 63.95992 5.043530       6.049727      8.594983       7.280993      -2.875510      10.87236  186.4691 71.59706 151.7705 71.46979 34.69856       101.1636 
1 1 1 20  9  6  o 113.7246 52.98092 -2.862415      5.710976      -2.820541      6.730284      -2.970112      10.79341  123.5045 57.52969 150.9989 71.13789 -27.49442      91.48916 
1 1 1 20  9  7  o 108.5955 50.14737 -2.152669      4.947805      -0.1577725     5.989794      -6.437766      8.778735  128.2515 57.63082 128.5892 61.58769 -0.3377533     84.34663 
1 1 1 20  9  8  o 178.7237 67.28304 7.694429       6.351993      2.908257       9.001541      12.44153       8.964721  161.0932 71.63617 210.5306 79.77428 -49.43736      107.2179 
1 1 1 20  9  9  o 132.4924 59.18912 0.3415996      6.220487      -5.945228      8.651587      7.069911       8.950206  128.8659 61.56295 179.9301 75.60246 -51.06415      97.49733 
1 1 1 20  9  10 o 144.9243 61.90178 2.737366       6.168104      2.957777       8.391985      2.478390       9.096590  158.5038 69.88806 159.9381 71.50406 -1.434357      99.98586 
1 1 1 20  10 0  o 324.2502 56.53910 25.30546       6.860750      22.57993       7.771335      34.93415       14.60676  290.6944 69.73347 298.3851 103.3652 -7.690674      124.6881 
1 1 1 20  10 1  o 354.3500 50.59648 28.92682       6.765037      29.43163       7.701163      27.22082       14.15735  348.0760 59.08358 264.2957 100.2255 83.78033       116.3444 
1 1 1 20  10 2  o 123.3575 56.63630 -1.338770      6.184661      4.165005       7.370872      -14.43101      11.36830  157.3473 67.45000 127.6311 63.03507 29.71624       92.31967 
1 1 1 20  10 3  o 191.3292 66.09129 9.426743       5.969598      20.79024       7.380105      -12.07906      10.15276  282.7378 68.03682 124.3608 61.05656 158.3770       91.41615 
1 1 1 20  10 4  o 290.4543 52.74948 19.67346       5.730942      22.46329       6.854468      13.19341       10.44659  303.2047 60.33393 210.0955 84.19840 93.10916       103.5836 
1 1 1 20  10 5  o 356.4722 43.72745 28.00462       5.926580      33.48372       7.264323      17.09847       10.24887  383.4796 49.96493 233.2358 85.91607 150.2437       99.38845 
1 1 1 20  10 6  o 341.9011 43.50294 25.74524       5.645442      37.68668       6.742067      -2.271052      10.32690  415.4575 42.38015 148.7653 69.92972 266.6921       81.76945 
1 1 1 20  10 7  o 225.5520 58.66553 12.50791       5.187306      8.095081       6.446491      20.61359       8.736950  180.4620 67.81209 268.2692 78.72072 -87.80719      103.9011 
1 1 1 20  10 8  o 133.4828 58.96980 1.028449       6.003190      3.307424       8.758693      -0.9906664     8.244229  160.3175 71.00661 140.6449 64.87157 19.67261       96.17827 
1 1 1 20  10 9  o 143.7035 61.13512 2.879310       5.972755      0.2915516      8.253901      5.723883       8.653783  145.6588 66.32487 171.1461 73.21722 -25.48730      98.79144 
1 1 1 20  11 0  o 175.5236 67.04926 8.054123       6.365042      14.04416       7.486708      -7.565256      12.08949  217.9600 74.05148 140.8490 68.60773 77.11098       100.9487 
1 1 1 20  11 1  o 368.4976 46.00933 30.77333       6.440812      33.18072       7.463230      23.74815       12.74919  374.8158 52.73006 248.4784 94.89894 126.3374       108.5646 
1 1 1 20  11 2  o 204.3737 67.04433 11.30500       6.145461      13.19419       7.093254      5.618737       12.30610  215.5256 72.08496 175.8229 80.41678 39.70265       107.9958 
1 1 1 20  11 3  o 363.3122 44.92834 29.58318       6.203999      27.21639       7.280439      35.85912       11.85545  334.1396 58.22117 337.1267 89.17703 -2.987183      106.5000 
1 1 1 20  11 4  o 128.4117 56.36898 1.195509       5.404448      9.667644       6.684702      -14.79283      9.183059  189.9287 69.47376 111.4321 55.32051 78.49658       88.80857 
1 1 1 20  11 5  o 275.6749 51.14937 17.74928       5.274405      21.58334       6.511058      10.43096       8.995549  297.1578 58.50293 193.3009 77.89732 103.8569       97.41963 
1 1 1 20  11 6  o 171.1035 61.04477 7.175480       5.121194      10.21544       6.258383      1.014481       8.909517  195.9005 67.67099 150.1562 68.58002 45.74431       96.34616 
1 1 1 20  11 7  o 184.9503 61.24719 8.620914       5.124201      10.84933       6.117004      3.378003       9.382678  202.2414 66.91528 161.5220 72.38668 40.71944       98.57731 
1 1 1 20  11 8  o 150.9101 62.02716 4.300414       5.838556      3.396209       8.654588      5.055641       7.909550  158.9825 70.49112 163.7477 70.02369 -4.765213      99.35952 
1 1 1 20  12 0  f 117.5319 54.50647 -1.424910      5.938002      -5.888849      7.017519      9.829283       11.14248  111.4657 53.81376 181.9936 80.37328 -70.52790      96.72530 
1 1 1 20  12 1  o 217.2960 67.43397 13.25414       6.284980      17.13653       7.523860      4.289743       11.43277  240.1727 73.65770 165.0928 76.23387 75.07996       106.0050 
1 1 1 20  12 2  o 353.9132 46.14672 28.66210       6.191658      37.08926       7.264328      6.279339       11.83890  401.1225 47.55903 173.2232 79.09164 227.8993       92.28947 
1 1 1 20  12 3  o 242.1978 61.93677 15.25274       5.848657      11.85891       6.790725      25.00248       11.50981  203.8309 70.48578 262.0145 91.69917 -58.18359      115.6589 
1 1 1 20  12 4  f 184.6781 64.15833 9.017736       5.629381      13.08997       6.584125      -2.049191      10.85413  216.1228 69.28134 147.6355 70.08228 68.48735       98.54659 
1 1 1 20  12 5  o 143.0588 58.11881 3.975730       5.051550      1.175409       6.044549      10.46115       9.198758  132.1250 58.73082 190.5418 78.03271 -58.41676      97.66480 
1 1 1 20  12 6  o 104.8787 48.73542 -2.192204      4.783351      -4.198617      5.899099      1.659459       8.173341  108.5049 51.55322 147.3919 66.67304 -38.88702      84.27946 
1 1 1 20  12 7  o 110.8406 50.63960 -1.149724      4.862613      -3.978344      5.893670      4.880991       8.605636  109.4535 51.86570 163.4978 71.46612 -54.04427      88.30321 
1 1 1 20  13 0  o 418.7006 41.39594 39.60014       6.642987      45.78599       7.612999      19.85992       13.59978  445.4883 44.60322 209.7606 90.77941 235.7277       101.1452 
1 1 1 20  13 1  o 337.8741 47.68653 26.84069       6.083226      30.90576       7.227687      16.96591       11.26494  354.2169 54.27084 209.2152 86.09403 145.0016       101.7718 
1 1 1 20  13 2  o 327.4001 47.67381 25.09124       5.883628      23.09934       6.978173      29.98929       10.94257  296.3182 62.60089 292.7202 88.63763 3.597992       108.5150 
1 1 1 20  13 3  o 91.91597 45.05559 -7.729208      5.459443      -6.563082      6.439023      -10.71124      10.29681  104.7248 50.79521 123.3788 60.75400 -18.65395      79.19093 
1 1 1 20  13 4  o 161.6325 62.03106 6.478989       5.463733      11.46933       6.367429      -7.454469      10.63968  200.9356 68.29196 132.2627 64.41158 68.67285       93.87569 
1 1 1 20  13 5  o 150.5070 59.69645 5.040163       5.198196      11.10538       5.981524      -13.67432      10.50697  200.7271 66.15837 120.4525 59.69029 80.27458       89.10590 
1 1 1 20  13 6  o 121.7510 53.81961 0.8107512      5.007819      -0.7399269     5.921596      4.704628       9.383589  121.6425 55.69013 162.9782 72.76048 -41.33577      91.62685 
1 1 1 20  14 0  o 166.9832 66.12695 8.042786       6.369091      8.320772       7.360130      7.214001       12.70851  167.7799 69.37211 165.8791 77.84629 1.900803       104.2714 
1 1 1 20  14 1  o 227.1573 65.32300 14.77664       6.070693      23.37471       6.947787      -12.97388      12.48193  293.9744 62.76594 127.5805 63.52817 166.3939       89.30505 
1 1 1 20  14 2  o 165.9021 63.52934 7.452555       5.723014      7.104130       6.739028      8.353855       10.83871  163.3469 66.83054 171.9033 77.35881 -8.556427      102.2287 
1 1 1 20  14 3  o 141.0910 59.15313 3.924487       5.459667      6.526005       6.487014      -2.393727      10.10948  160.6006 65.62212 138.7876 66.37094 21.81299       93.33469 
1 1 1 20  14 4  o 113.8583 52.58829 -1.229751      5.445272      0.6684684      6.553089      -5.464187      9.787474  130.5126 59.30029 130.6879 63.20425 -0.1752777     86.66776 
1 1 1 20  15 0  o 185.6098 67.45550 10.83753       6.287303      15.28568       7.187006      -3.666933      12.97805  214.1346 72.55512 140.5258 69.00066 73.60887       100.1266 
1 1 1 20  15 1  o 116.2886 54.18588 -1.025731      5.978316      -1.248710      6.794488      -0.2612720     12.58061  121.0434 56.84203 147.5812 71.44272 -26.53774      91.29665 
1 1 1 21  0  0  o 431.4707 79.33037 43.15207       11.96743      43.15207       11.96743      43.15207       11.96743  431.4707 79.33037 431.4707 79.33037 0.000000       0.000000 
1 1 1 21  0  1  o 393.2201 90.50352 38.08722       12.03172      38.08722       12.03172      38.08722       12.03172  393.2201 90.50352 393.2201 90.50352 0.000000       0.000000 
1 1 1 21  0  2  o 229.2486 109.0278 18.23563       11.07282      18.23563       11.07282      18.23563       11.07282  229.2486 109.0278 229.2486 109.0278 0.000000       0.000000 
1 1 1 21  0  3  o 186.0955 103.1826 12.53378       10.96531      12.53378       10.96531      12.53378       10.96531  186.0955 103.1826 186.0955 103.1826 0.000000       0.000000 
1 1 1 21  0  4  o 170.4913 97.85133 10.24562       10.31121      10.24562       10.31121      10.24562       10.31121  170.4913 97.85133 170.4913 97.85133 0.000000       0.000000 
1 1 1 21  0  5  o 91.81944 65.15686 -10.14683      9.810960      -10.14683      9.810960      -10.14683      9.810960  91.81944 65.15686 91.81944 65.15686 0.000000       0.000000 
1 1 1 21  0  6  o 138.6883 86.43895 5.253618       9.456436      5.253618       9.456436      5.253618       9.456436  138.6883 86.43895 138.6883 86.43895 0.000000       0.000000 
1 1 1 21  0  7  o 212.9947 100.7641 16.15947       9.445138      16.15947       9.445138      16.15947       9.445138  212.9947 100.7641 212.9947 100.7641 0.000000       0.000000 
1 1 1 21  0  8  o 246.3975 101.8444 20.21035       9.674697      20.21035       9.674697      20.21035       9.674697  246.3975 101.8444 246.3975 101.8444 0.000000       0.000000 
1 1 1 21  0  9  o 113.9707 80.28258 -8.166842      14.01070      -8.166842      14.01070      -8.166842      14.01070  113.9707 80.28258 113.9707 80.28258 0.000000       0.000000 
1 1 1 21  0  10 o 134.9624 90.66272 2.445847       13.45110      2.445847       13.45110      2.445847       13.45110  134.9624 90.66272 134.9624 90.66272 0.000000       0.000000 
1 1 1 21  1  0  o 201.3432 74.46335 11.70062       7.712526      21.43760       11.06952      2.514673       10.75174  247.9714 89.59924 161.5337 74.35257 86.43768       116.4316 
1 1 1 21  1  1  o 146.5750 64.40154 2.599675       7.068797      6.312943       10.96394      -0.4189653E-01 9.247400  176.3296 78.69038 147.6561 68.31538 28.67345       104.2073 
1 1 1 21  1  2  o 255.6114 69.48022 17.58681       7.077958      9.772545       11.35657      22.55009       9.050815  191.3601 82.88568 276.9779 79.79340 -85.61780      115.0523 
1 1 1 21  1  3  o 139.5751 61.90536 1.461588       6.679775      4.572227       10.65156      -0.5547138     8.575633  170.7273 76.77211 143.1792 66.08325 27.54803       101.2964 
1 1 1 21  1  4  o 95.48254 47.26988 -11.56171      6.529994      -17.56828      8.836545      -4.335472      9.692274  104.6973 52.33838 138.5341 65.89658 -33.83682      84.15263 
1 1 1 21  1  5  o 160.3373 69.74219 4.174692       8.108385      25.36364       15.64829      -3.602575      9.480376  249.1466 101.8749 139.2973 65.94193 109.8493       121.3542 
1 1 1 21  1  6  o 178.8387 72.37228 7.813272       7.800045      10.24631       15.29848      6.958622       9.067091  197.6732 90.12041 176.6472 75.24156 21.02606       117.4009 
1 1 1 21  1  7  o 207.3375 75.17242 12.14255       7.801405      8.867682       15.84755      13.19001       8.962621  194.3423 89.74503 211.2815 79.83539 -16.93918      120.1160 
1 1 1 21  1  8  o 183.6764 73.36798 8.633581       7.903275      21.95878       16.06216      4.376894       9.078268  233.9712 99.91296 164.7748 72.66946 69.19637       123.5453 
1 1 1 21  1  9  o 324.1447 64.32879 26.46842       7.812122      42.58471       15.31645      20.80156       9.082322  338.4119 105.3114 264.4485 80.89835 73.96341       132.7970 
1 1 1 21  1  10 o 456.5019 44.70318 46.15983       7.823476      65.13840       15.41769      39.57836       9.079225  471.3553 87.44504 404.3481 59.60616 67.00720       105.8278 
1 1 1 21  2  0  o 148.5145 63.01992 3.858335       6.318214      12.14049       8.679517      -5.477540      9.215127  201.3307 77.93556 130.5916 62.69269 70.73909       100.0216 
1 1 1 21  2  1  o 281.0788 59.05941 19.54141       6.241926      22.10337       8.784872      16.92921       8.870584  274.2383 78.49853 234.1181 80.58272 40.12021       112.4971 
1 1 1 21  2  2  o 219.8927 67.29202 12.96761       6.283485      19.83070       9.242341      7.069097       8.568273  253.8046 82.16006 174.8121 73.73898 78.99249       110.3980 
1 1 1 21  2  3  f 138.8473 60.96441 1.825343       6.324863      -1.195902      8.771656      5.097349       9.128421  141.8911 65.95502 167.6030 73.42361 -25.71196      98.69697 
1 1 1 21  2  4  o 231.2943 74.17244 15.13054       7.546052      17.09575       8.986323      10.43086       13.89671  237.2337 81.12701 196.4714 88.06898 40.76233       119.7403 
1 1 1 21  2  5  o 135.9302 64.45478 -3.936885      9.131672      0.000000       0.000000      -3.936885      9.131672  ?        ?        135.9302 64.45478 0.000000       64.45478 
1 1 1 21  2  6  o 152.0003 67.25392 2.705872       7.837770      1.111304       16.37882      3.179464       8.926126  177.2937 84.70035 159.0576 70.99073 18.23611       110.5162 
1 1 1 21  2  7  o 134.1271 62.63941 -2.209467      8.061156      -1.033129      16.03806      -2.607107      9.324606  172.1270 82.65225 140.9207 66.30789 31.20631       105.9629 
1 1 1 21  2  8  o 227.2963 68.67705 13.91004       6.574345      20.25721       9.941093      8.976209       8.764684  252.8304 85.33348 186.0394 76.17684 66.79094       114.3884 
1 1 1 21  2  9  o 133.6985 63.47371 -4.214760      8.908615      -4.214760      8.908615      0.000000       0.000000  133.6985 63.47371 ?        ?        0.000000       63.47371 
1 1 1 21  2  10 o 158.3753 63.76926 5.273449       6.022957      -0.3014393     8.385360      11.21484       8.656610  143.1854 65.81638 199.6691 77.68149 -56.48367      101.8146 
1 1 1 21  3  0  o 465.1783 38.46899 46.94686       6.887214      62.30387       9.809312      32.01641       9.672119  519.5745 49.20023 336.4816 75.83280 183.0929       90.39511 
1 1 1 21  3  1  o 188.9142 71.18990 9.782887       7.114500      0.7145262      8.198807      37.42657       14.31476  143.9209 65.75385 311.6969 102.3274 -167.7760      121.6325 
1 1 1 21  3  2  o 297.3151 57.15626 21.48713       6.359741      28.47773       8.840174      13.98776       9.156214  324.4608 72.03476 213.1900 80.66019 111.2708       108.1438 
1 1 1 21  3  3  o 187.4401 68.78841 9.302922       6.561138      6.735835       7.463615      18.03399       13.76457  170.5815 70.12329 222.1361 93.56830 -51.55461      116.9286 
1 1 1 21  3  4  o 243.5445 66.60671 15.66555       6.481278      13.01460       7.356595      24.85920       13.69999  214.4574 73.40253 253.7929 98.00679 -39.33553      122.4470 
1 1 1 21  3  5  o 218.9977 64.16264 12.49806       5.808260      11.35227       7.127549      14.76304       10.02120  202.4274 72.03831 216.5947 83.77121 -14.16733      110.4859 
1 1 1 21  3  6  o 252.7235 82.33089 19.64237       9.273335      0.000000       0.000000      19.64237       9.273335  ?        ?        252.7235 82.33089 0.000000       82.33089 
1 1 1 21  3  7  o 108.0320 52.07873 -6.404462      6.514985      6.331291       9.781734      -16.55843      8.734164  174.4423 76.22315 105.2059 52.50710 69.23639       92.55789 
1 1 1 21  3  8  o 158.3975 65.09233 5.159182       6.428344      2.768452       8.991588      7.658701       9.193891  157.2018 70.62732 179.2734 76.04331 -22.07155      103.7825 
1 1 1 21  3  9  o 120.5747 55.74063 -1.811601      6.138067      -5.002752      8.581262      1.531614       8.783340  129.0455 61.55525 151.6381 68.80438 -22.59261      92.32059 
1 1 1 21  3  10 o 141.4637 60.49734 2.739171       5.904367      -1.140404      8.311333      6.691861       8.389286  139.5700 64.64156 173.5281 73.06853 -33.95810      97.55788 
1 1 1 21  4  0  o 166.0867 65.31841 6.824834       6.174365      19.70083       8.647575      -6.565747      8.818680  252.2016 79.23663 124.3118 60.09017 127.8898       99.44482 
1 1 1 21  4  1  o 124.6129 56.74589 -0.3764247     6.043319      -10.46738      8.220942      11.48812       8.914174  111.5612 54.80666 196.2029 78.06246 -84.64169      95.38091 
1 1 1 21  4  2  o 143.7713 62.42250 2.841069       6.472170      -7.047671      7.344351      37.21552       13.69307  112.9196 54.64471 317.9197 99.67920 -205.0001      113.6749 
1 1 1 21  4  3  o 256.0674 63.74838 16.96285       6.314787      14.79057       7.175954      24.41892       13.29465  228.6503 72.22613 250.9547 96.64832 -22.30443      120.6545 
1 1 1 21  4  4  o 157.5153 64.16369 5.277680       6.177911      7.060619       6.986814      -1.112482      13.22717  171.1000 68.75652 161.3002 76.79755 9.799866       103.0792 
1 1 1 21  4  5  o 272.9889 60.61611 18.65454       6.258891      19.67693       7.156025      15.32670       12.91060  272.2161 67.91367 211.8604 90.00099 60.35570       112.7495 
1 1 1 21  4  6  o 193.7576 69.38068 10.16272       6.621085      11.49667       9.332542      8.810850       9.395026  198.3482 79.54987 184.2557 77.44118 14.09250       111.0194 
1 1 1 21  4  7  o 349.9636 52.42432 28.68652       6.905643      24.73745       10.21127      32.01482       9.374414  279.7006 85.81490 344.7416 72.32751 -65.04095      112.2295 
1 1 1 21  4  8  o 105.8229 52.76158 -16.03762      8.725492      0.000000       0.000000      -16.03762      8.725492  ?        ?        105.8229 52.76158 0.000000       52.76158 
1 1 1 21  4  9  o 168.3121 65.28092 6.760571       6.098915      4.419118       8.558456      9.176478       8.693463  162.1926 71.07289 186.3057 76.02797 -24.11313      104.0750 
1 1 1 21  5  0  o 300.3989 56.59231 22.31590       6.359928      37.07316       9.216008      8.897966       8.787853  375.7915 65.53213 179.1999 75.08474 196.5917       99.66031 
1 1 1 21  5  1  o 375.3827 44.81689 31.89662       6.404299      47.74321       9.180545      16.87493       8.938402  446.1954 54.08550 228.7252 80.74940 217.4702       97.18903 
1 1 1 21  5  2  o 311.3016 57.98991 23.92273       6.752750      34.61304       7.925006      -4.408811      12.90147  378.5644 55.55846 150.8298 72.85368 227.7346       91.62096 
1 1 1 21  5  3  o 245.2814 65.49144 16.00637       6.355697      20.58474       7.400087      3.133085       12.40869  275.1152 69.29785 167.6134 78.08932 107.5017       104.4037 
1 1 1 21  5  4  o 331.0146 50.96312 25.63296       6.341173      32.65492       7.366962      5.553073       12.45776  372.3096 52.40145 175.1562 80.40477 197.1534       95.97312 
1 1 1 21  5  5  o 161.6752 65.24686 5.936466       6.320944      4.030354       7.236713      12.07044       12.98189  153.6778 66.36449 197.4414 86.99711 -43.76355      109.4200 
1 1 1 21  5  6  o 172.7438 68.82337 7.419548       6.937727      12.50411       9.792443      2.295366       9.830524  201.8885 81.30385 157.3360 71.92853 44.55251       108.5543 
1 1 1 21  5  7  o 150.1472 64.28916 3.773352       6.682340      4.933327       9.338888      2.556346       9.565706  165.7623 73.37425 157.4061 71.56844 8.356171       102.4979 
1 1 1 21  5  8  o 134.6739 60.65308 0.6487157      6.678336      -10.08904      10.45736      8.044228       8.678596  128.5438 62.87125 179.0220 74.78133 -50.47821      97.69873 
1 1 1 21  5  9  o 128.8932 61.46742 -4.765982      8.545732      0.000000       0.000000      -4.765982      8.545732  ?        ?        128.8932 61.46742 0.000000       61.46742 
1 1 1 21  6  0  o 178.5917 70.28607 9.010043       7.153969      8.387653       8.929737      10.12533       11.95363  174.8944 74.58644 183.0964 81.90457 -8.201996      110.7768 
1 1 1 21  6  1  o 111.1854 56.13069 -24.36377      11.52034      0.000000       0.000000      -24.36377      11.52034  ?        ?        111.1854 56.13069 0.000000       56.13069 
1 1 1 21  6  2  o 146.9113 63.33987 3.670554       6.570621      2.094379       7.887411      7.244857       11.87758  145.6558 65.72759 176.1058 79.94669 -30.45006      103.4968 
1 1 1 21  6  3  o 303.4181 59.01680 23.04587       6.703814      30.07490       8.035419      6.950924       12.15921  342.7806 62.67158 176.4244 80.39835 166.3562       101.9393 
1 1 1 21  6  4  o 214.7368 69.07793 12.96250       6.541174      12.62564       7.778090      13.77624       12.08922  205.5133 74.97595 201.7910 86.43842 3.722244       114.4246 
1 1 1 21  6  5  o 219.2949 68.78945 13.41355       6.520451      19.52455       7.703273      -2.029541      12.24578  261.6526 73.02783 153.3851 73.26711 108.2675       103.4463 
1 1 1 21  6  6  o 279.9525 57.21886 19.31461       6.010840      31.24049       7.688577      0.5674762      9.639805  357.5841 57.30052 149.7603 69.45116 207.8238       90.03785 
1 1 1 21  6  7  o 111.3325 53.77976 -6.570695      7.033665      -5.697232      10.59437      -7.259137      9.405605  137.8864 66.45556 127.2541 61.64392 10.63234       90.64388 
1 1 1 21  6  8  o 144.7242 63.42578 2.674841       6.817635      6.738616       10.76692      -0.4502580E-01 8.808468  175.8722 78.27007 144.3307 66.74073 31.54155       102.8617 
1 1 1 21  7  0  o 114.2449 54.43587 -3.740013      6.672787      -0.7913219     8.586250      -8.236738      10.60320  135.9388 63.85674 128.3238 62.87880 7.614960       89.61823 
1 1 1 21  7  1  o 185.0654 68.55171 9.860853       6.541675      10.42630       8.209340      8.877201       10.82759  185.1895 74.49034 177.0657 78.66098 8.123810       108.3345 
1 1 1 21  7  2  o 266.4987 65.09986 19.17715       6.679801      6.653290       8.136685      45.06491       11.69838  165.7012 70.94479 387.4723 80.37734 -221.7710      107.2086 
1 1 1 21  7  3  o 137.0640 60.63705 2.105396       6.369293      -12.62667      7.700919      34.00335       11.33163  101.9506 50.62129 319.2921 88.37972 -217.3415      101.8503 
1 1 1 21  7  4  o 199.7974 68.17135 11.28941       6.345200      17.98687       7.830302      -1.519303      10.82870  244.6219 75.16282 147.1039 69.87940 97.51807       102.6284 
1 1 1 21  7  5  f 160.2042 64.55360 6.062984       6.177007      8.160952       7.574467      1.897489       10.67299  175.1866 71.16872 156.4541 72.73382 18.73251       101.7605 
1 1 1 21  7  6  o 156.9691 63.87433 5.550698       6.114240      8.409682       7.252761      -1.472289      11.36733  177.1690 70.43718 150.3503 71.47242 26.81876       100.3479 
1 1 1 21  7  7  o 164.2159 65.97271 6.464000       6.430654      2.848923       9.057664      10.13819       9.131420  154.6596 70.05336 187.5128 77.37940 -32.85324      104.3793 
1 1 1 21  7  8  o 158.3420 71.49069 3.359193       9.345775      0.000000       0.000000      3.359193       9.345775  ?        ?        158.3420 71.49069 0.000000       71.49069 
1 1 1 21  8  0  o 116.4830 53.12753 -0.1177141     5.323733      -0.6341438     7.752237      0.3432118      7.323809  130.5235 61.10883 131.6463 60.86881 -1.122818      86.25139 
1 1 1 21  8  1  o 175.0060 64.86491 8.584824       5.858716      6.754074       7.350572      11.77362       9.701087  162.1969 68.35165 187.1985 78.68600 -25.00159      104.2278 
1 1 1 21  8  2  o 282.3580 57.71484 20.32403       6.115067      20.84550       7.552565      19.33153       10.41947  267.0595 71.43005 226.4140 85.95316 40.64552       111.7596 
1 1 1 21  8  3  o 121.8212 55.36240 0.5935929E-01  5.715334      1.926421       6.934647      -3.894643      10.09168  138.1548 62.05053 135.8159 65.30644 2.338898       90.08440 
1 1 1 21  8  4  o 168.4482 63.98637 7.469263       5.776461      7.512974       6.950070      7.371608       10.38806  168.8116 68.31505 171.7982 76.63729 -2.986588      102.6656 
1 1 1 21  8  5  o 124.3161 55.83720 0.5946752      5.615968      4.977067       6.719027      -9.563662      10.22968  153.7371 65.09808 125.2938 61.46863 28.44334       89.53296 
1 1 1 21  8  6  o 203.8302 63.31264 11.22745       5.538801      4.672202       6.526448      28.10396       10.47186  151.8956 64.22946 290.6212 86.42117 -138.7256      107.6756 
1 1 1 21  8  7  o 127.9570 58.02289 0.2437923      6.233799      -2.486011      8.774840      3.025324       8.857590  134.5961 63.63300 153.6662 69.46889 -19.07004      94.20767 
1 1 1 21  9  0  o 284.2715 61.02484 21.81861       6.535628      22.96342       7.620583      18.63478       12.70855  276.8706 70.64274 201.4904 87.47696 75.38025       112.4394 
1 1 1 21  9  1  o 105.5803 50.47755 -3.880375      5.839683      -4.321440      7.206829      -3.037097      9.965035  115.0646 55.29267 134.1467 64.60216 -19.08205      85.03363 
1 1 1 21  9  2  o 151.6055 61.79215 5.562764       5.733860      9.970330       7.361814      -1.234324      9.142119  180.4399 71.20853 135.9350 64.46709 44.50487       96.05550 
1 1 1 21  9  3  o 361.1869 45.86463 30.38587       6.288333      38.62106       8.035695      17.37528       10.10032  396.1711 53.60574 215.2285 83.86090 180.9426       99.53003 
1 1 1 21  9  4  o 114.2870 52.69037 -0.9950321     5.429691      -2.333392      6.598604      1.811288       9.555076  118.4333 55.74289 148.5081 68.96640 -30.07473      88.67713 
1 1 1 21  9  5  o 103.2176 49.09667 -3.727983      5.379812      -3.384423      6.458144      -4.506928      9.724342  114.1438 54.14743 132.4673 63.79941 -18.32343      83.67979 
1 1 1 21  9  6  o 152.8905 60.48114 5.480191       5.322649      10.85191       6.402007      -6.545315      9.578799  194.3696 68.36900 127.5303 61.87897 66.83929       92.21349 
1 1 1 21  10 0  o 166.7732 68.78017 8.604587       7.209318      16.57238       9.022112      -5.469528      11.99085  206.9310 79.63915 134.1312 65.95438 72.79971       103.4039 
1 1 1 21  10 1  o 220.7637 66.56850 14.56916       6.181426      18.76447       7.336066      4.298486       11.47838  243.5382 72.31383 155.1996 73.19104 88.33853       102.8894 
1 1 1 21  10 2  f 180.9902 65.84155 9.723895       5.992170      9.453934       7.541382      10.18622       9.869011  174.5338 70.97062 175.4763 76.62171 -0.9425049     104.4400 
1 1 1 21  10 3  o 136.6808 58.04948 3.548644       5.368513      10.03152       6.955079      -6.007442      8.444196  181.0620 69.85594 119.1498 57.87839 61.91225       90.71803 
1 1 1 21  10 4  o 116.0904 52.55883 0.1251677      5.091735      0.3631705      6.318078      -0.3158165     8.600140  126.1426 57.66646 136.4238 64.02809 -10.28120      86.16854 
1 1 1 21  10 5  o 161.7936 60.86380 6.803977       5.195879      8.464231       6.374384      3.516843       8.969326  173.6093 66.90549 152.0166 69.18882 21.59268       96.24675 
1 1 1 21  11 0  o 170.2955 64.53442 8.955427       5.867046      5.222035       6.828113      19.48840       11.46897  145.8699 63.71255 201.4049 85.15359 -55.53500      106.3505 
1 1 1 21  11 1  o 94.81465 46.37273 -6.523125      5.687763      -4.710529      6.668910      -11.35982      10.89378  108.0306 52.22856 119.4781 59.46999 -11.44749      79.14861 
1 1 1 21  11 2  o 117.2762 54.10792 -0.2674370     5.741288      -1.851415      6.756497      3.847650       10.89022  118.2423 55.88170 152.2978 71.66042 -34.05547      90.87343 
1 1 1 21  11 3  o 121.2040 54.88805 0.7179303      5.557137      -6.488318      6.740222      16.01413       9.819996  105.0707 51.19053 203.0613 81.54411 -97.99059      96.28039 
1 1 1 21  12 0  o 114.2828 53.33961 -0.5037028     5.831293      -2.495718      7.031126      3.885431       10.43682  115.0528 55.10788 145.6843 69.02981 -30.63152      88.32890 
1 1 1 21  12 1  o 173.4169 64.45930 9.319081       5.793824      6.591875       6.863684      16.07950       10.80650  153.0584 65.33556 189.8197 81.52834 -36.76123      104.4778 
1 1 1 22  0  0  o 261.7923 112.4569 23.92303       11.71447      23.92303       11.71447      23.92303       11.71447  261.7923 112.4569 261.7923 112.4569 0.000000       0.000000 
1 1 1 22  0  1  o 76.15936 54.94835 -12.79903      8.260571      -12.79903      8.260571      -12.79903      8.260571  76.15936 54.94835 76.15936 54.94835 0.000000       0.000000 
1 1 1 22  0  2  o 106.7253 71.50935 -0.5686586     8.269987      -0.5686586     8.269987      -0.5686586     8.269987  106.7253 71.50935 106.7253 71.50935 0.000000       0.000000 
1 1 1 22  0  3  o 100.5391 68.68915 -2.506204      8.402993      -2.506204      8.402993      -2.506204      8.402993  100.5391 68.68915 100.5391 68.68915 0.000000       0.000000 
1 1 1 22  0  4  o 86.01787 61.76237 -12.57003      9.877128      -12.57003      9.877128      -12.57003      9.877128  86.01787 61.76237 86.01787 61.76237 0.000000       0.000000 
1 1 1 22  0  5  o 157.4086 103.4757 8.104727       15.99956      8.104727       15.99956      8.104727       15.99956  157.4086 103.4757 157.4086 103.4757 0.000000       0.000000 
1 1 1 22  0  6  o 164.4721 106.6503 10.78518       16.18222      10.78518       16.18222      10.78518       16.18222  164.4721 106.6503 164.4721 106.6503 0.000000       0.000000 
1 1 1 22  1  0  o 187.7296 69.87607 11.99865       6.813140      11.30331       8.735624      13.07842       10.88584  174.6866 74.11229 176.8028 78.69142 -2.116135      108.0970 
1 1 1 22  1  1  o 109.1426 53.43678 -6.780288      7.612197      -10.25952      10.69729      -3.211190      10.83457  119.8228 59.52378 133.1626 64.88245 -13.33981      88.05006 
1 1 1 22  1  2  o 160.0359 66.64435 7.401203       6.862549      7.897747       8.750647      6.607948       11.06032  162.4701 71.51361 159.3158 74.05676 3.154236       102.9495 
1 1 1 22  1  3  o 91.85295 45.65676 -10.50533      6.330437      -15.96718      7.870458      -0.4969232     10.65400  94.83468 47.68555 140.8149 67.54985 -45.98020      82.68551 
1 1 1 22  1  4  o 186.0443 68.20377 10.68252       6.447644      5.617972       6.967689      40.86124       17.00860  152.2691 65.43453 256.5954 105.7137 -104.3263      124.3265 
1 1 1 22  1  5  o 217.3459 76.64732 16.07671       8.051177      21.78882       9.384446      0.1487446      15.67077  244.9638 82.90882 157.0727 76.85422 87.89104       113.0506 
1 1 1 22  1  6  o 168.0400 70.74781 7.981892       7.863087      10.96658       9.064759      -1.089987      15.80358  182.6501 76.37301 156.8817 76.84937 25.76840       108.3451 
1 1 1 22  2  0  o 145.0372 63.11937 5.274284       6.648286      8.342685       8.532616      0.5332053      10.60632  160.6141 70.65868 138.8346 66.80643 21.77950       97.24067 
1 1 1 22  2  1  o 162.2029 66.19763 7.996982       6.591389      12.47451       8.564438      1.491574       10.32326  183.0289 75.16410 141.8963 67.63800 41.13263       101.1165 
1 1 1 22  2  2  o 94.78796 47.01601 -9.894454      6.576009      -15.96251      8.071670      2.083225       11.34031  95.79691 48.18605 147.3289 70.41091 -51.53195      85.32053 
1 1 1 22  2  3  o 193.2440 82.15803 15.44351       10.77418      15.44351       10.77418      0.000000       0.000000  193.2440 82.15803 ?        ?        0.000000       82.15803 
1 1 1 22  2  4  o 99.98650 49.36614 -9.313107      6.953318      -9.313107      6.953318      0.000000       0.000000  99.98650 49.36614 ?        ?        0.000000       49.36614 
1 1 1 22  2  5  o 100.5519 49.95749 -11.55680      7.545218      -12.18140      8.707561      -9.674512      15.11602  107.8073 53.58023 141.0887 70.19833 -33.28143      88.30995 
1 1 1 22  2  6  o 157.4979 65.60379 6.297824       6.652285      12.21546       9.470842      0.5352872      9.345906  187.9135 78.27573 141.7210 66.58856 46.19249       102.7673 
1 1 1 22  3  0  o 106.8876 53.14382 -10.41077      8.600121      -10.41077      8.600121      0.000000       0.000000  106.8876 53.14382 ?        ?        0.000000       53.14382 
1 1 1 22  3  1  o 112.6088 53.95206 -3.068643      6.749576      8.149018       8.207026      -26.51248      11.86449  160.9912 70.09612 105.0967 53.46765 55.89451       88.16039 
1 1 1 22  3  2  o 105.3242 50.22786 -3.097566      5.706328      -9.726094      7.919726      4.058939       8.229095  105.1866 52.07105 145.1212 66.13618 -39.93462      84.17475 
1 1 1 22  3  3  o 112.4351 53.34873 -2.494575      6.275868      -9.401525      7.210216      19.09477       12.74749  101.2153 50.02845 199.2094 87.03067 -97.99407      100.3852 
1 1 1 22  3  4  o 126.8519 63.10561 -11.41018      12.19740      0.000000       0.000000      -11.41018      12.19740  ?        ?        126.8519 63.10561 0.000000       63.10561 
1 1 1 22  3  5  o 193.0541 73.89648 12.44650       7.741287      5.826293       12.66625      16.39384       9.780578  162.8020 76.80946 206.2521 81.86033 -43.45003      112.2533 
1 1 1 22  4  0  f 156.1802 65.85004 7.556609       6.828037      13.43254       8.588756      -2.535561      11.25600  183.5938 75.31880 132.8267 65.02141 50.76704       99.50229 
1 1 1 22  4  1  o 296.2910 60.45058 24.37406       6.720220      26.46435       8.371173      20.58519       11.27036  282.6844 75.01168 205.9192 85.54990 76.76515       113.7785 
1 1 1 22  4  2  o 169.5930 67.33691 9.116405       6.620348      18.99749       8.213243      -9.212348      11.18610  228.6889 77.56206 123.4957 61.26639 105.1933       98.84049 
1 1 1 22  4  3  o 152.1370 64.53241 6.097565       6.621094      8.922098       8.049026      0.1865126      11.64401  167.3492 71.07705 143.8982 69.43311 23.45100       99.36249 
1 1 1 22  4  4  o 134.9753 60.34077 2.683291       6.477086      8.794991       7.708403      -11.99607      11.94640  168.5892 70.45505 124.5042 62.02152 44.08501       93.86470 
1 1 1 22  4  5  o 178.5447 66.41832 9.545176       6.153762      10.12730       7.854646      8.619974       9.902290  177.5285 72.33618 168.6240 75.05169 8.904526       104.2366 
1 1 1 22  5  0  o 241.7607 69.24310 19.01310       6.833577      13.68909       8.663514      27.78007       11.11729  182.9284 75.41549 238.3850 89.15507 -55.45660      116.7738 
1 1 1 22  5  1  o 97.59853 48.13398 -7.907979      6.547346      -3.502542      8.117644      -16.10877      11.07550  118.5771 57.39871 111.6063 56.17728 6.970749       80.31499 
1 1 1 22  5  2  o 218.6597 69.44712 15.50457       6.627423      9.131594       8.175275      27.72149       11.31910  165.5650 71.00565 244.5492 90.25543 -78.98419      114.8383 
1 1 1 22  5  3  o 119.7125 55.76143 -0.3781172     6.322057      8.797763       7.788414      -18.10300      10.82472  166.1179 70.19988 109.5651 55.19890 56.55283       89.30254 
1 1 1 22  5  4  o 113.7038 53.88480 -2.318121      6.364398      -3.214306      7.614626      -0.2410766     11.59238  119.2249 57.17030 143.5410 69.26539 -24.31611      89.81168 
1 1 1 22  6  0  o 194.8137 77.39689 16.24932       8.751057      16.24932       8.751057      0.000000       0.000000  194.8137 77.39689 ?        ?        0.000000       77.39689 
1 1 1 22  6  1  o 148.4456 60.15726 6.235940       5.397409      9.346123       7.538231      2.964128       7.731621  164.5962 69.28300 135.8522 62.71749 28.74396       93.45383 
1 1 1 22  6  2  o 135.6273 59.64179 3.766509       6.073807      8.189795       7.249756      -6.648468      11.12449  160.6922 67.80818 126.1029 62.29443 34.58933       92.07902 
1 1 1 22  6  3  o 230.4687 64.28522 15.72453       5.971164      19.58781       7.118846      6.555725       10.96700  248.7075 70.48221 156.7532 73.15779 91.95428       101.5864 
1 1 1 22  7  0  o 192.8764 63.64627 12.01680       5.535295      19.26233       8.619925      6.932496       7.220785  212.7117 78.71120 149.0663 65.30280 63.64542       102.2737 
1 1 1 22  7  1  f 224.8418 65.11092 15.80874       6.012415      19.71463       7.732101      9.835085       9.562187  232.2474 75.14470 161.8692 72.76916 70.37825       104.6044 
1 1 1 22  7  2  o 187.1372 65.82920 11.33499       5.935265      14.71285       7.170394      3.983910       10.57785  203.0820 72.25629 146.0605 69.29103 57.02147       100.1110 
1 1 1 22  8  0  o 139.2908 60.00934 5.347548       5.888861      8.728407       7.500292      -0.8651529E-01 9.508830  156.3111 67.53184 128.5226 62.19113 27.78847       91.80569 
1 1 1 22  8  1  o 142.1668 59.95828 5.564147       5.663395      23.58480       7.339231      -20.96124      8.904225  270.1602 69.54105 92.40387 46.94125 177.7563       83.90136 
# 
#END OF REFLECTIONS
